data_2h3a_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 2h3a _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 . . . . . 0.532 ' HD3' ' HB3' ' B' ' 110' ' ' ASP . 8.8 mmtm . . . . . 0 CA--C 1.534 0.349 0 CA-C-O 120.243 0.068 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.458 ' O ' ' HA ' ' B' ' 108' ' ' THR . 7.5 tt0 -130.26 120.74 24.9 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.916 0.389 . . . . 0.0 111.795 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.817 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -81.95 116.99 21.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.75 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.5 OUTLIER -113.78 122.22 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.105 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.59 129.85 41.44 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.025 -1.07 . . . . 0.0 112.954 -177.888 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.605 ' CG2' ' HB ' ' A' ' 9' ' ' VAL . 0.2 OUTLIER -100.22 103.54 14.93 Favored 'Isoleucine or valine' 0 C--N 1.346 0.421 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 175.381 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.624 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -69.77 67.17 0.25 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 122.009 0.909 . . . . 0.0 109.774 -178.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.616 ' CG2' ' HB2' ' A' ' 12' ' ' ASP . 9.4 p -106.09 -132.32 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.389 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.596 ' N ' HG13 ' A' ' 9' ' ' VAL . 3.2 t70 148.34 -87.16 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 70.7 m -74.65 -5.67 44.34 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.616 ' HB2' ' CG2' ' A' ' 9' ' ' VAL . 4.2 t0 -79.68 56.76 2.32 Favored 'General case' 0 C--N 1.353 0.727 0 CA-C-N 120.437 1.471 . . . . 0.0 109.936 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.467 ' O ' ' HB3' ' B' ' 132' ' ' MET . 13.2 m 65.25 -18.5 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.747 ' CD1' HG21 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -50.63 -56.03 13.71 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 118.347 0.521 . . . . 0.0 110.777 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.739 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -50.75 -43.84 58.36 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.641 -0.708 . . . . 0.0 112.763 -177.906 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.436 ' HA ' ' HB1' ' A' ' 19' ' ' ALA . 1.6 mt -54.43 -40.59 68.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.886 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.93 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.665 0.745 . . . . 0.0 110.634 179.782 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.739 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 13.9 pttt -69.06 -25.78 64.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.655 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.436 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -59.17 -22.04 60.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 178.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 15.1 m-30 -87.84 -54.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.668 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 12.4 p-10 163.92 35.15 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.764 0.665 . . . . 0.0 112.117 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.573 ' C ' ' H ' ' A' ' 24' ' ' ILE . 9.6 p -154.39 99.12 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.524 0.678 . . . . 0.0 112.622 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.655 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 16.0 m-20 -60.71 13.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.962 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.761 HG12 ' CE ' ' B' ' 132' ' ' MET . 1.7 pp 65.12 -5.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 N-CA-C 117.484 2.401 . . . . 0.0 117.484 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.742 ' HA ' ' HB ' ' B' ' 107' ' ' VAL . 9.8 p -38.49 -62.35 0.6 Allowed 'General case' 0 C--N 1.308 -1.233 0 O-C-N 123.243 0.339 . . . . 0.0 111.734 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.555 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -67.05 -38.72 92.74 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.663 -0.779 . . . . 0.0 113.059 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.554 HD21 ' CG2' ' A' ' 24' ' ' ILE . 3.5 tp -63.5 -61.44 2.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 117.208 0.504 . . . . 0.0 112.299 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.682 HG23 ' HB ' ' A' ' 24' ' ' ILE . 53.6 t -40.1 -73.4 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -178.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.733 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -57.71 -32.55 67.5 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.555 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.9 OUTLIER -66.54 -54.09 27.53 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 177.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.404 HG21 ' OG1' ' B' ' 131' ' ' THR . 9.4 m -51.78 -47.83 64.03 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.317 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.712 ' SD ' ' HA ' ' A' ' 29' ' ' SER . 5.3 mtt -49.07 -48.99 43.68 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.242 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.15 -36.33 18.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.446 0.566 . . . . 0.0 110.394 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -67.8 -51.42 48.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.467 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.455 ' HB3' HD23 ' B' ' 117' ' ' LEU . 2.4 tp10 -75.34 -17.23 60.29 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.625 0.25 . . . . 0.0 110.84 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.577 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -86.28 -25.74 25.33 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 123.193 0.597 . . . . 0.0 109.691 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.22 -47.83 12.0 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 121.858 0.837 . . . . 0.0 109.756 177.916 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 . . . . . 0 N--CA 1.443 -0.799 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.414 -177.419 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.521 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 52.9 tp60 -105.58 113.32 26.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.772 0.796 . . . . 0.0 110.31 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.686 ' HB3' ' NH1' ' B' ' 104' ' ' ARG . 7.9 ttp-105 -79.31 103.55 9.31 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.712 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.747 HG21 ' CD1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.66 129.03 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.342 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.608 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -128.61 115.6 18.32 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.859 -177.868 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.742 ' HB ' ' HA ' ' A' ' 25' ' ' SER . 0.1 OUTLIER -101.14 98.72 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.701 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.817 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 41.6 p -68.13 84.3 0.24 Allowed 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.731 HG22 ' CB ' ' B' ' 114' ' ' TYR . 6.4 t -72.56 -116.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.413 -177.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.623 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 4.9 t70 75.63 -7.48 1.78 Allowed 'General case' 0 C--N 1.351 0.649 0 CA-C-O 121.443 0.64 . . . . 0.0 109.597 -176.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' SER . . . . . 0.42 ' OG ' ' NZ ' ' A' ' 2' ' ' LYS . 2.4 m -127.18 -69.43 0.75 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.46 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.733 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 0.6 OUTLIER -42.36 -78.28 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.68 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.456 ' H ' ' HB2' ' A' ' 29' ' ' SER . 1.7 m 169.0 46.78 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.55 0.691 . . . . 0.0 110.662 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.75 ' CG ' HG23 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -83.89 -52.55 6.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.831 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.69 -35.31 13.66 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -175.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.565 ' HB3' ' HB2' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -62.47 -57.03 12.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.632 0.651 . . . . 0.0 111.658 179.582 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.568 ' HB2' ' HB3' ' A' ' 32' ' ' MET . 0.2 OUTLIER -46.37 -48.76 18.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.506 0.67 . . . . 0.0 111.411 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.712 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 5.2 pttt -79.35 -27.88 42.03 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.004 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.45 -28.06 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.573 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.2 OUTLIER -88.42 -45.81 9.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.254 177.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.573 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 157.04 22.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 175.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 49.5 t -138.93 82.57 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.542 ' O ' HD13 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -64.54 56.74 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.006 0.431 . . . . 0.0 111.489 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.689 ' CG2' ' HE1' ' A' ' 32' ' ' MET . 0.6 OUTLIER 44.66 -11.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.474 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.1 OUTLIER -38.19 -60.64 0.75 Allowed 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.362 1.437 . . . . 0.0 110.542 -178.523 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -81.11 -27.84 47.73 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.608 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.538 ' CD1' ' HG ' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -66.95 -62.35 1.48 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.701 0.4 . . . . 0.0 111.101 -179.901 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.67 ' O ' ' HG2' ' B' ' 132' ' ' MET . 3.0 t -47.08 -66.6 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-O 121.144 0.497 . . . . 0.0 109.877 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.529 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 13.7 p -47.99 -34.97 10.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.267 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.7 m -73.77 -56.24 5.23 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.404 ' OG1' HG21 ' A' ' 31' ' ' THR . 0.7 OUTLIER -51.74 -39.16 58.0 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.365 -0.834 . . . . 0.0 108.914 178.668 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.886 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 19.0 mmt -52.91 -54.08 39.86 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.042 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.2 -46.85 79.29 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.34 -54.57 30.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.882 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.528 ' HB2' HD22 ' A' ' 17' ' ' LEU . 21.7 mm-40 -62.76 -27.14 69.08 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.282 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.556 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -72.31 -46.45 55.58 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.571 0.348 . . . . 0.0 110.72 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -56.59 5.77 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.213 0.53 . . . . 0.0 111.545 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.725 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -176.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 7.4 mmmm . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' B' ' 109' ' ' VAL . 25.1 tt0 -95.31 115.97 28.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.24 0.543 . . . . 0.0 111.556 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.732 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 7.9 ttm-85 -79.55 100.01 7.56 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.677 HG22 ' CE2' ' B' ' 114' ' ' TYR . 0.7 OUTLIER -103.28 130.54 53.37 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.842 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.367 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.762 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -130.05 127.66 40.36 Favored 'General case' 0 C--N 1.311 -1.083 0 C-N-CA 118.73 -1.188 . . . . 0.0 113.893 -177.1 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.598 HG21 ' HA ' ' B' ' 125' ' ' SER . 1.1 t -101.02 112.54 34.26 Favored 'Isoleucine or valine' 0 C--N 1.347 0.49 0 C-N-CA 124.39 1.076 . . . . 0.0 108.789 176.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.0 p -70.92 85.17 0.69 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.826 0.739 . . . . 0.0 110.386 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.752 HG11 ' CG ' ' A' ' 14' ' ' TYR . 10.3 m -72.26 -162.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.981 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.547 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.6 t70 84.7 -23.59 0.17 Allowed 'General case' 0 C--N 1.351 0.636 0 C-N-CA 123.396 0.679 . . . . 0.0 109.365 -177.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.36 -75.52 0.53 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.294 177.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.887 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 1.0 OUTLIER -51.46 -87.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.506 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 5.2 t -176.85 41.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.256 0.935 . . . . 0.0 112.259 -178.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.814 ' CE2' HG13 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -83.2 -43.8 15.74 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.657 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 16.8 mt-30 -47.84 -37.8 14.66 Favored 'General case' 0 C--O 1.221 -0.418 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -174.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.684 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -58.42 -56.22 24.93 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.473 1.033 . . . . 0.0 111.693 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.779 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -48.05 -47.89 33.47 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.454 0.645 . . . . 0.0 111.63 -178.214 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.657 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -76.74 -27.16 55.27 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.41 178.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.448 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . . . -66.03 -27.61 68.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.855 178.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.547 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -87.8 -40.48 14.01 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.57 178.482 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.8 OUTLIER 151.21 21.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.267 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.476 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 68.4 t -155.9 89.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.515 0 C-N-CA 120.886 -0.326 . . . . 0.0 111.833 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.466 ' O ' ' CE ' ' B' ' 132' ' ' MET . 1.1 m120 -61.2 -100.28 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.77 HG13 ' HE1' ' B' ' 132' ' ' MET . 0.2 OUTLIER -146.26 4.79 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.409 ' C ' ' O ' ' A' ' 24' ' ' ILE . 89.5 p -44.38 -64.82 0.61 Allowed 'General case' 0 C--O 1.244 0.794 0 C-N-CA 119.395 -0.922 . . . . 0.0 108.826 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.4 -28.65 29.58 Favored Glycine 0 CA--C 1.519 0.319 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.593 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.686 HD13 ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -58.74 -59.6 5.16 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 122.198 0.199 . . . . 0.0 110.858 179.489 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.697 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.1 t -52.31 -61.65 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.805 ' HB3' ' CB ' ' B' ' 112' ' ' ASP . 12.1 p -50.55 -42.73 55.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 89.3 m -71.34 -53.29 14.68 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.47 -41.46 89.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.129 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.89 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.5 OUTLIER -56.0 -52.99 62.24 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.446 178.433 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.426 ' O ' ' HB1' ' A' ' 36' ' ' ALA . 53.2 mt-30 -53.68 -56.68 15.17 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.35 -53.27 56.11 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.441 ' HB3' ' CD2' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -66.83 -23.33 66.02 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.145 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.569 ' HB2' ' HB3' ' B' ' 116' ' ' LEU . . . -72.19 -47.57 49.66 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.408 ' CG ' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.79 -51.58 66.52 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? . . . . . 0 N--CA 1.444 -0.731 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.151 -179.706 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.413 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 12.3 mptt . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.641 ' HB3' HG23 ' A' ' 9' ' ' VAL . 3.5 tp60 -99.36 125.06 44.96 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.976 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.435 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.3 OUTLIER -77.91 114.61 16.94 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.279 -177.911 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.814 HG13 ' CE2' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -102.89 108.98 25.48 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.949 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 177.899 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.762 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -115.25 114.02 24.65 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.986 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.581 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.21 101.35 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 176.849 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.732 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 77.0 p -68.61 95.2 0.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.692 HG21 ' CG ' ' B' ' 114' ' ' TYR . 16.5 m -91.29 -148.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.613 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.412 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 15.9 t70 88.84 -13.33 0.39 Allowed 'General case' 0 C--N 1.346 0.445 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 -176.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.4 t -114.46 -62.48 1.59 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.805 ' CB ' ' HB3' ' A' ' 29' ' ' SER . 0.6 OUTLIER -48.66 -89.34 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 O-C-N 123.591 0.557 . . . . 0.0 111.865 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.405 ' HB3' ' HG3' ' A' ' 33' ' ' GLN . 1.3 m 176.04 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.865 0.757 . . . . 0.0 111.438 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.861 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -82.37 -44.36 16.23 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.312 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.581 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 4.4 mt-30 -48.78 -42.63 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.569 ' HB3' ' HB2' ' A' ' 36' ' ' ALA . 0.8 OUTLIER -52.32 -30.19 27.11 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.89 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -77.5 -53.62 7.41 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 121.599 0.714 . . . . 0.0 111.204 179.534 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.619 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -70.43 -28.83 65.35 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.556 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -60.57 -28.13 68.23 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.864 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.684 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -89.16 -36.81 15.48 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.022 179.097 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.684 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 33.2 t70 146.83 25.36 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 176.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.587 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 61.8 t -159.67 101.13 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 O-C-N 121.841 -0.537 . . . . 0.0 112.396 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.503 ' HB3' HD11 ' B' ' 124' ' ' ILE . 67.8 m-80 -58.9 -92.51 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 177.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.721 ' CG2' ' HB3' ' B' ' 127' ' ' LEU . 0.1 OUTLIER -154.84 6.76 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.727 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.598 ' HA ' HG21 ' A' ' 7' ' ' VAL . 54.0 p -38.6 -64.27 0.45 Allowed 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.076 -177.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.52 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.25 -20.25 46.41 Favored Glycine 0 CA--C 1.522 0.471 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.834 177.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.721 ' HB3' ' CG2' ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.82 -61.21 2.56 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.061 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.67 HG22 ' HB ' ' B' ' 124' ' ' ILE . 26.0 t -55.15 -65.16 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 CA-C-O 121.687 0.755 . . . . 0.0 109.136 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.887 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 3.0 p -49.44 -47.96 47.8 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.52 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -81.14 -48.53 12.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.441 1.019 . . . . 0.0 111.198 -178.404 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.664 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.98 -37.91 69.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.102 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.779 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 1.6 mmt -64.21 -48.19 76.83 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.389 178.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.506 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 14.6 tt0 -48.79 -42.13 34.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.096 0.407 . . . . 0.0 110.659 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.51 -55.68 22.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.177 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.48 ' CG ' HD13 ' A' ' 17' ' ' LEU . 23.9 tp10 -71.31 -9.76 58.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.102 178.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.684 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -88.19 -46.93 8.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.985 0.421 . . . . 0.0 109.925 178.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -63.3 -56.17 18.65 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.623 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 2.8 tpt85 . . . . . 0 N--CA 1.438 -1.04 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.236 -178.884 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 3.5 mptt . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 121.211 0.529 . . . . 0.0 110.986 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.415 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 29.7 tp60 -104.64 109.62 21.61 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.13 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.867 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 2.3 ttm105 -78.91 104.6 9.65 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.331 -179.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.613 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -104.08 130.21 55.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 177.786 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.663 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.36 128.41 39.6 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 119.117 -1.033 . . . . 0.0 112.901 -177.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.566 ' O ' HG22 ' B' ' 105' ' ' ILE . 1.2 t -100.1 107.64 21.33 Favored 'Isoleucine or valine' 0 C--N 1.35 0.598 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.2 p -71.23 98.34 1.71 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.94 -0.475 . . . . 0.0 110.442 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.727 HG23 ' CG ' ' A' ' 14' ' ' TYR . 3.8 t -92.35 -130.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 119.094 -0.479 . . . . 0.0 112.077 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.521 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 31.4 t70 85.18 -9.23 0.84 Allowed 'General case' 0 C--N 1.351 0.641 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.4 m -132.23 -56.54 0.97 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.856 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.787 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 2.8 m-20 -49.86 -98.36 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -177.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.447 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 41.3 t -178.41 36.78 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.376 -0.828 . . . . 0.0 110.606 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.727 ' CG ' HG23 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.79 -45.71 14.0 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.794 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.694 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.1 -39.24 27.4 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -176.014 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -59.14 -56.84 17.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.439 0.563 . . . . 0.0 112.284 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.778 ' CD1' ' HA ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -59.61 -39.46 84.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 120.027 -0.669 . . . . 0.0 112.744 -177.471 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.694 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -80.14 -35.47 36.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.041 0.448 . . . . 0.0 112.123 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.592 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -73.66 -21.57 60.23 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.896 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.589 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -87.79 -40.08 14.36 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 118.913 -0.565 . . . . 0.0 109.642 178.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.589 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 7.0 t70 171.52 -5.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.699 ' CG1' ' HB2' ' A' ' 27' ' ' LEU . 74.4 t -121.57 82.0 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -177.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.548 ' O ' HD11 ' A' ' 24' ' ' ILE . 45.5 p30 -67.19 51.44 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 111.068 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.763 ' CG2' ' HE2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 46.11 -15.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.556 ' HA ' HG21 ' B' ' 107' ' ' VAL . 0.3 OUTLIER -37.99 -63.01 0.51 Allowed 'General case' 0 C--O 1.238 0.486 0 CA-C-N 120.166 1.348 . . . . 0.0 110.838 -177.688 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.52 -29.16 30.69 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.473 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.699 ' HB2' ' CG1' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -58.0 -62.33 1.9 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.463 179.511 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.626 ' O ' ' HG2' ' A' ' 32' ' ' MET . 2.8 t -48.48 -63.48 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.382 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.809 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 94.2 p -49.55 -38.73 32.05 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 81.3 m -67.31 -54.41 20.96 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.43 HG22 ' HG ' ' B' ' 127' ' ' LEU . 93.0 m -58.15 -40.85 82.45 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.257 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.738 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 8.1 mmt -53.52 -54.27 39.63 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.974 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? -62.73 -45.11 94.22 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.935 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.47 -50.72 71.62 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.555 ' HG2' ' CD1' ' B' ' 127' ' ' LEU . 5.6 tp10 -64.57 -37.93 89.24 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.468 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -56.11 -43.5 78.18 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 177.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -53.24 19.86 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.539 0.521 0 CA-C-N 114.187 -1.369 . . . . 0.0 113.224 -177.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.512 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 12.0 mmmt . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.505 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 33.8 tp60 -121.15 112.53 18.78 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.535 0.683 . . . . 0.0 112.121 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.468 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 5.5 ttm105 -79.55 111.91 16.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.895 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.707 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.8 OUTLIER -101.47 130.06 51.61 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.758 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.255 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.636 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.96 116.56 17.3 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.281 -177.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.556 HG21 ' HA ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -101.66 104.54 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 174.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.867 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 8.9 p -70.02 95.29 0.94 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.697 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 0.9 OUTLIER -93.2 -145.3 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.992 -178.632 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.466 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 28.2 t0 92.69 -10.62 0.18 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -175.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.46 -64.35 1.26 Allowed 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.354 177.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.809 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -44.0 -94.44 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.436 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -177.59 42.33 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.699 -0.625 . . . . 0.0 110.94 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.697 ' HB3' ' CG1' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.13 -45.52 15.05 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.055 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.532 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 3.9 mt-30 -49.86 -43.67 49.26 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.43 -33.82 22.29 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.738 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.1 -53.94 6.83 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.894 -0.722 . . . . 0.0 111.771 178.594 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.549 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -63.44 -25.49 68.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.995 178.621 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.62 -26.18 31.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.775 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.641 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 97.4 m-85 -87.64 -49.11 7.37 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.295 178.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.641 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 25.0 p-10 136.46 34.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 124.844 1.34 . . . . 0.0 112.078 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 5.5 p -120.76 -39.7 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.456 ' O ' HD13 ' B' ' 117' ' ' LEU . 36.8 m-80 59.95 -119.64 0.92 Allowed 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.681 HG13 ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -139.21 4.02 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 179.477 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.494 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.4 OUTLIER -40.53 -64.96 0.46 Allowed 'General case' 0 C--O 1.243 0.744 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.466 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -84.5 -23.13 51.95 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.128 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.699 HD23 ' SD ' ' A' ' 32' ' ' MET . 7.0 tp -63.99 -61.27 2.38 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-N 116.843 0.322 . . . . 0.0 111.187 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.66 HG22 ' CG2' ' B' ' 124' ' ' ILE . 24.8 t -51.83 -61.19 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.787 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.8 p -48.41 -49.08 36.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.04 -43.73 33.45 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.61 0.641 . . . . 0.0 110.496 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.507 HG21 ' N ' ' B' ' 132' ' ' MET . 0.6 OUTLIER -63.14 -39.89 96.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.647 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.778 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 4.8 mmt -63.48 -57.05 11.45 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.62 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.447 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 5.3 tp60 -48.82 -37.52 19.55 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.962 0.164 . . . . 0.0 111.225 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -65.18 -57.47 8.45 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.769 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.627 ' HB2' HD11 ' A' ' 17' ' ' LEU . 1.3 mm-40 -75.81 -8.56 57.17 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.569 0.223 . . . . 0.0 111.053 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.531 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -87.23 -32.48 19.75 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.39 -46.77 13.11 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.898 0.856 . . . . 0.0 110.326 178.245 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 11.4 mtt180 . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 113.617 -1.629 . . . . 0.0 114.614 -176.479 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.547 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 1.7 mmmt . . . . . 0 N--CA 1.47 0.529 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.708 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -119.28 107.64 13.64 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.312 0.577 . . . . 0.0 111.796 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.885 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.94 109.79 14.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.534 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.709 HD11 ' CD1' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -121.28 112.93 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 177.396 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.764 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.0 OUTLIER -123.46 132.92 54.08 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.84 -177.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.594 ' O ' HG23 ' A' ' 9' ' ' VAL . 0.5 OUTLIER -100.41 112.27 32.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 176.928 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.442 HG22 ' NH1' ' B' ' 104' ' ' ARG . 6.5 p -67.06 92.76 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.623 -0.673 . . . . 0.0 110.07 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.612 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -97.64 -155.13 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.404 -178.235 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 24.7 t0 113.22 5.27 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.597 1.159 . . . . 0.0 108.837 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.7 t -152.18 -38.8 0.11 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.756 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.693 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -73.3 32.64 0.07 Allowed 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -177.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.498 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER 70.71 1.71 3.83 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 120.692 -1.255 . . . . 0.0 113.856 178.202 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.854 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.7 OUTLIER -55.92 -53.6 54.88 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.919 0.39 . . . . 0.0 110.919 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.609 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 3.0 mp0 -49.91 -41.55 46.21 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -177.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.562 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -51.08 -29.71 13.88 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.918 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.65 -59.8 2.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.466 0.651 . . . . 0.0 110.919 178.2 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.609 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 4.4 pttt -63.63 -25.91 68.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.799 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.464 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.25 -25.64 34.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.098 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.579 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 21.0 m-85 -88.32 -50.24 6.46 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.565 178.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 19.7 t0 143.34 50.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.216 0.947 . . . . 0.0 110.166 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.556 ' CG1' ' O ' ' A' ' 22' ' ' VAL . 1.4 p -176.05 96.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.738 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.51 ' HB3' HD11 ' A' ' 24' ' ' ILE . 68.4 m-80 -60.83 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.109 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.669 ' HB ' ' CG2' ' A' ' 28' ' ' VAL . 0.2 OUTLIER -146.38 5.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 24' ' ' ILE . 36.2 p -39.11 -62.99 0.58 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.455 -177.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.18 -30.04 32.12 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.098 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.567 ' HB3' ' CG2' ' A' ' 24' ' ' ILE . 22.0 tp -60.56 -56.3 22.95 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.193 0.197 . . . . 0.0 111.28 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.669 ' CG2' ' HB ' ' A' ' 24' ' ' ILE . 3.1 t -53.96 -64.43 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.439 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.687 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.701 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 10.8 p -49.73 -42.19 45.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.411 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.11 -46.15 52.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.436 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.549 HG23 ' HB ' ' B' ' 131' ' ' THR . 22.9 m -63.21 -36.13 82.63 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.981 179.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.878 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -54.57 -47.86 72.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.184 179.071 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.5 -36.85 76.84 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 120.475 0.179 . . . . 0.0 111.182 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.427 ' ND2' HG21 ' A' ' 31' ' ' THR . 0.0 OUTLIER -74.43 -44.8 50.21 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.32 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.603 ' HB3' HD22 ' B' ' 117' ' ' LEU . 1.2 tp10 -69.86 -26.63 64.3 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.045 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.593 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.34 -44.72 64.54 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -55.55 11.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.509 0.671 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 CA--C 1.543 0.708 0 CA-C-N 114.668 -1.151 . . . . 0.0 114.046 -176.627 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.501 ' HD3' ' HA ' ' B' ' 102' ' ' LYS . 1.8 mmtp . . . . . 0 N--CA 1.465 0.29 0 CA-C-O 121.007 0.432 . . . . 0.0 111.982 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.416 ' HG2' ' CG2' ' B' ' 105' ' ' ILE . 2.0 tt0 -113.54 110.6 20.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.965 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.678 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 11.8 ttm-85 -79.23 99.14 6.91 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.183 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.677 ' CG2' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -104.82 112.29 37.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.587 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.764 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -107.33 125.1 50.75 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.447 -175.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.558 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -99.33 93.3 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.576 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.885 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.3 p -66.31 67.64 0.05 Allowed 'General case' 0 CA--C 1.523 -0.079 0 CA-C-O 122.276 1.036 . . . . 0.0 109.526 -177.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.709 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 7.1 p -69.92 -127.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.848 -178.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.708 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 3.6 t70 83.44 -3.35 1.19 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.914 0.864 . . . . 0.0 109.082 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 38.0 m -127.06 -64.66 0.99 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.358 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.701 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.64 -85.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.712 0 O-C-N 123.696 0.623 . . . . 0.0 112.258 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.491 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.6 t 174.64 43.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.364 0.602 . . . . 0.0 110.881 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.853 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -84.06 -42.27 16.31 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.55 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.42 -42.24 21.86 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -175.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -49.79 64.18 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.996 0.816 . . . . 0.0 111.362 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.878 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.41 -48.98 78.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.819 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.569 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -71.27 -26.13 62.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.238 0.542 . . . . 0.0 110.529 179.534 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.16 -24.04 62.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.82 178.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.609 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 10.4 m-30 -87.98 -43.64 11.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.609 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 1.9 p-10 121.72 19.36 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.137 0 O-C-N 125.007 1.442 . . . . 0.0 111.81 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 79.2 t -101.7 -40.64 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.25 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 61.54 -124.96 0.84 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.775 ' HB ' HG21 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -131.51 3.59 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.425 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.5 OUTLIER -39.43 -64.33 0.48 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.253 -178.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.23 -25.39 33.92 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.387 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.574 ' CD1' ' HG ' ' B' ' 117' ' ' LEU . 6.1 tt -59.38 -61.44 2.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.188 0.518 . . . . 0.0 110.222 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.775 HG21 ' HB ' ' B' ' 124' ' ' ILE . 3.4 t -50.67 -63.54 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.443 178.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.693 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 92.4 p -48.58 -46.9 39.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.438 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.6 OUTLIER -70.17 -48.01 59.14 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.549 ' HB ' HG23 ' A' ' 31' ' ' THR . 0.6 OUTLIER -65.02 -33.72 76.72 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.817 179.949 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.918 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 mmt -56.13 -52.92 62.62 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.187 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.454 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -58.16 -36.86 73.64 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.622 0.231 . . . . 0.0 111.622 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . 0.454 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.44 -51.05 13.95 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.555 ' HG2' HD11 ' A' ' 27' ' ' LEU . 12.0 tp10 -67.47 -24.46 65.6 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.965 -0.384 . . . . 0.0 109.965 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.562 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -69.41 -46.28 67.2 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -53.45 12.96 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.853 178.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.636 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -175.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.498 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.275 0 CA-C-O 120.861 0.362 . . . . 0.0 110.45 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.617 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 43.2 tp60 -124.96 116.28 21.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.148 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.736 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 2.0 ttm105 -79.11 114.3 17.94 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.668 0.747 . . . . 0.0 111.667 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.592 HD11 ' CD1' ' B' ' 114' ' ' TYR . 4.4 pt -114.62 128.91 71.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.69 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.56 131.73 41.82 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.285 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.677 ' CG2' ' HB ' ' A' ' 9' ' ' VAL . 0.2 OUTLIER -101.22 103.45 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 106.914 -1.514 . . . . 0.0 106.914 174.208 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 9.7 p -70.36 69.08 0.37 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.715 0.769 . . . . 0.0 109.837 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.677 ' HB ' ' CG2' ' A' ' 7' ' ' VAL . 14.3 p -85.89 -135.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.384 -1.28 . . . . 0.0 111.468 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.705 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 20.4 t70 108.39 20.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.171 0.986 . . . . 0.0 109.607 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.3 t -160.7 -45.69 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.5 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.718 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -79.05 61.39 3.2 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 119.61 -0.836 . . . . 0.0 113.165 -177.317 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.511 ' HB2' ' O ' ' B' ' 129' ' ' SER . 3.7 m 68.19 -7.78 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 177.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.898 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 1.1 t80 -50.29 -57.61 7.48 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.674 1.125 . . . . 0.0 110.348 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.563 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 39.5 mt-30 -49.77 -38.81 35.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.878 -178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.463 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 1.5 mt -51.32 -33.09 27.62 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.917 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.67 -52.55 8.79 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.245 0.545 . . . . 0.0 111.317 178.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.686 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -66.28 -25.5 66.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.388 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 -28.21 62.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.411 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.706 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 6.8 m-30 -88.29 -40.78 13.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.888 178.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.706 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 120.39 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 125.203 1.565 . . . . 0.0 109.496 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.8 t -141.71 -48.15 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.04 0 CA-C-N 114.421 -1.263 . . . . 0.0 111.068 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 67.39 -113.71 0.17 Allowed 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.73 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -143.04 -1.27 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 178.628 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 24' ' ' ILE . 63.0 p -39.52 -64.9 0.43 Allowed 'General case' 0 C--O 1.245 0.853 0 CA-C-N 118.901 0.773 . . . . 0.0 110.468 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.552 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -79.0 -29.11 52.65 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.432 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.541 HD23 ' HG ' ' A' ' 17' ' ' LEU . 16.7 tp -62.41 -58.41 7.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.73 HG23 ' HB ' ' A' ' 24' ' ' ILE . 4.0 t -52.17 -71.39 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.396 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.763 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 93.7 p -47.37 -39.36 15.0 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.552 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.3 m -69.67 -48.0 61.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.251 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.3 m -65.34 -32.13 73.62 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.694 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.78 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 11.5 mmt -59.43 -57.42 13.04 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.959 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -55.56 -34.99 65.25 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.547 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -49.38 21.26 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.658 ' HB3' ' CD2' ' B' ' 117' ' ' LEU . 3.4 tp10 -72.15 -21.75 61.41 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.083 0.468 . . . . 0.0 109.776 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.612 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -70.38 -45.35 66.18 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.244 0.545 . . . . 0.0 109.628 178.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -55.02 5.12 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.883 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.662 0 CA-C-N 114.895 -1.048 . . . . 0.0 113.747 -176.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.4 mptt . . . . . 0 CA--C 1.532 0.287 0 CA-C-O 120.733 0.302 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.705 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 7.7 tt0 -97.22 108.87 21.69 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.237 0.542 . . . . 0.0 110.942 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.612 ' CZ ' HG22 ' B' ' 106' ' ' THR . 0.3 OUTLIER -78.34 99.09 6.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.428 0.632 . . . . 0.0 110.163 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.634 HG22 ' CD1' ' A' ' 14' ' ' TYR . 3.9 pt -100.34 126.93 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.69 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -131.75 122.85 26.53 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -175.669 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.527 ' O ' HG22 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -101.01 106.73 19.94 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.499 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.736 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 76.8 p -70.07 98.7 1.35 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.744 HG23 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.73 -124.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.85 -178.22 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.617 ' HB2' ' N ' ' A' ' 3' ' ' GLN . 26.0 t0 95.84 9.99 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 122.098 0.952 . . . . 0.0 108.845 -175.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.4 t -164.51 -43.13 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.985 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.763 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.1 OUTLIER -68.47 52.58 0.08 Allowed 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.153 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.61 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.1 m 56.03 7.97 0.34 Allowed 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.78 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.9 OUTLIER -63.99 -54.6 31.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.973 0.416 . . . . 0.0 111.491 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.555 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.95 -34.17 12.39 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.609 -176.421 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.481 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -52.15 -56.19 16.12 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.145 0.498 . . . . 0.0 110.781 178.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.742 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -55.11 -50.85 68.18 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.031 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.598 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -71.85 -25.6 62.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.36 -179.386 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -58.1 -26.03 62.09 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.063 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.679 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 4.6 m-30 -88.27 -44.43 10.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.65 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.679 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.8 m-20 129.68 38.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.884 1.365 . . . . 0.0 111.284 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 91.0 t -122.74 -44.11 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.011 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.431 ' OD1' ' HE1' ' B' ' 114' ' ' TYR . 0.6 OUTLIER 61.55 -132.61 0.65 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 -178.253 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.697 ' HB ' HG22 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -134.07 8.48 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.744 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.496 ' HA ' ' HB ' ' A' ' 7' ' ' VAL . 0.9 OUTLIER -39.72 -63.99 0.53 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 120.235 -0.586 . . . . 0.0 109.944 -178.023 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.46 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.0 -30.78 13.4 Favored Glycine 0 C--O 1.225 -0.439 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.712 177.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.574 ' HB3' ' CG2' ' B' ' 124' ' ' ILE . 0.0 OUTLIER -52.57 -61.11 2.49 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.638 0.375 . . . . 0.0 110.61 179.038 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.697 HG22 ' HB ' ' B' ' 124' ' ' ILE . 2.4 t -54.27 -64.35 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.544 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.718 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 4.9 p -49.22 -44.8 43.71 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.75 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.46 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -69.91 -53.72 16.67 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 121.767 -0.583 . . . . 0.0 109.843 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.9 -37.81 74.7 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.52 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.917 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -49.19 -46.46 45.58 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.328 179.138 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -48.37 80.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.584 0.23 . . . . 0.0 111.35 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -58.14 -56.54 20.73 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.485 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -59.98 -40.13 88.06 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.463 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -60.04 -44.33 94.73 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.605 178.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -56.51 7.7 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.315 0.579 . . . . 0.0 111.339 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.568 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.125 -177.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.439 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 11.1 mmtm . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.694 0.283 . . . . 0.0 111.509 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.4 tp60 -101.75 118.46 36.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.631 0.729 . . . . 0.0 112.087 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.803 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.39 101.03 7.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.94 -179.532 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.586 ' CD1' ' CD2' ' B' ' 114' ' ' TYR . 8.3 pt -104.52 128.79 57.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.683 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -131.56 124.59 30.35 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.882 -177.273 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.536 HG23 ' HA ' ' B' ' 125' ' ' SER . 0.2 OUTLIER -101.25 105.0 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 174.792 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 9.9 p -69.14 87.77 0.41 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -178.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.635 ' CB ' ' HB3' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -86.78 -139.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.16 -178.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.663 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 2.4 t70 87.22 -5.15 0.64 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -175.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.53 -67.7 0.94 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.117 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.787 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 1.1 m-20 -49.55 -87.45 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m -177.43 42.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.174 0.897 . . . . 0.0 111.751 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.855 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -82.53 -44.56 15.76 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.636 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.1 mp0 -49.67 -40.39 39.71 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -176.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.635 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -57.09 -54.0 51.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.736 0.698 . . . . 0.0 111.995 -179.503 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.863 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -49.54 -48.06 48.6 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.282 0.563 . . . . 0.0 111.387 -178.871 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.636 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.13 -30.41 43.68 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.045 179.274 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -63.78 -27.43 69.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.175 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.599 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -87.69 -44.77 10.93 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-O 118.765 -0.636 . . . . 0.0 109.399 178.816 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.599 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 157.28 16.46 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 177.028 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.496 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 70.9 t -156.85 90.37 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 118.265 0.484 . . . . 0.0 111.973 -177.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 0.1 OUTLIER -56.78 -100.1 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.338 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.72 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -139.97 1.26 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 24' ' ' ILE . 88.0 p -41.89 -65.26 0.47 Allowed 'General case' 0 C--O 1.239 0.519 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.866 -178.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.93 -25.88 43.54 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.813 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.579 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -62.17 -59.41 5.08 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.72 HG23 ' HB ' ' A' ' 24' ' ' ILE . 2.2 t -52.77 -66.25 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.713 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.743 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 18.1 p -48.74 -35.59 14.51 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.5 m -72.88 -56.26 5.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.541 HG21 ' HA ' ' A' ' 28' ' ' VAL . 3.1 t -58.74 -36.64 74.67 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.126 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.789 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -55.53 -55.37 32.65 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.641 178.775 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -56.19 -53.49 56.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.589 0.233 . . . . 0.0 110.782 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -57.69 -46.91 83.69 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 31' ' ' THR . 3.2 tp10 -70.23 -19.89 63.12 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.353 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -77.38 -44.48 29.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -54.74 7.61 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.564 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.741 -176.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.663 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 17.1 tt0 -98.41 115.18 27.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.799 178.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.646 ' CZ ' HG21 ' A' ' 6' ' ' THR . 28.7 ttt-85 -77.52 101.93 6.7 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.226 -0.589 . . . . 0.0 110.461 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.595 HG23 ' CG ' ' A' ' 14' ' ' TYR . 1.8 pt -102.62 130.21 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.657 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.683 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.4 OUTLIER -131.26 121.59 25.04 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.056 -0.657 . . . . 0.0 111.823 -176.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.552 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.8 OUTLIER -101.28 91.59 2.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.085 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 176.127 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.803 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 31.9 p -60.85 90.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.505 0.669 . . . . 0.0 110.385 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.654 ' CG2' ' CD1' ' B' ' 114' ' ' TYR . 31.6 m -87.5 -148.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.885 -177.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.486 ' HA ' ' CD ' ' B' ' 115' ' ' GLN . 23.7 t70 96.04 -10.33 0.09 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.371 1.069 . . . . 0.0 108.342 -176.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 58.4 m -118.15 -62.9 1.49 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 176.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.743 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.4 OUTLIER -42.03 -92.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.662 0.601 . . . . 0.0 112.34 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.474 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.2 m -180.0 41.18 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.724 -0.61 . . . . 0.0 110.765 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.789 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.2 OUTLIER -83.04 -45.2 14.32 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.584 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.7 mp0 -49.18 -45.27 43.83 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.8 -28.02 14.22 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.759 0.709 . . . . 0.0 112.356 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.628 ' CD1' HD13 ' B' ' 127' ' ' LEU . 0.6 OUTLIER -78.33 -57.25 3.88 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 120.113 -0.635 . . . . 0.0 111.329 178.111 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -62.36 -25.43 67.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.337 178.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.39 -27.06 34.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.004 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.626 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.5 m-30 -88.18 -49.56 6.93 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.644 178.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.626 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.9 m-20 139.4 46.14 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 O-C-N 124.407 1.067 . . . . 0.0 110.675 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.544 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 4.0 p -163.14 89.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.725 0.774 . . . . 0.0 110.783 -178.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.491 ' HB3' HD11 ' B' ' 124' ' ' ILE . 74.6 m-80 -58.41 -98.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.722 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.759 HG13 ' HE3' ' A' ' 32' ' ' MET . 0.2 OUTLIER -152.55 9.73 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.536 ' HA ' HG23 ' A' ' 7' ' ' VAL . 2.1 p -39.59 -64.7 0.45 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.144 -177.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.557 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.13 -28.5 20.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.628 HD13 ' CD1' ' B' ' 117' ' ' LEU . 0.1 OUTLIER -55.48 -61.43 2.35 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.485 0.314 . . . . 0.0 110.783 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.704 HG22 HG21 ' A' ' 24' ' ' ILE . 2.1 t -53.59 -62.7 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.602 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.808 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.787 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 2.3 p -50.13 -43.69 51.99 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.557 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.5 OUTLIER -70.16 -50.27 42.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.457 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.442 ' N ' ' CG2' ' B' ' 130' ' ' THR . 54.8 m -55.9 -43.46 77.29 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.51 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.863 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 4.6 mtt -61.08 -57.63 11.74 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.897 178.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -40.39 37.21 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.067 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -56.04 12.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.242 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.541 ' HB2' HD22 ' A' ' 17' ' ' LEU . 14.0 mm-40 -69.41 -13.45 62.37 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.544 0.211 . . . . 0.0 111.293 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.635 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -86.49 -38.18 17.52 Favored 'General case' 0 C--O 1.227 -0.1 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -47.61 45.4 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.3 ttp85 . . . . . 0 N--CA 1.441 -0.878 0 CA-C-N 114.075 -1.42 . . . . 0.0 110.613 -179.371 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 36.3 mmtt . . . . . 0 N--CA 1.476 0.83 0 CA-C-O 120.559 0.218 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.607 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 0.5 OUTLIER -102.72 101.8 11.93 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.711 0.767 . . . . 0.0 112.07 -179.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.892 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.2 ttp-105 -79.68 98.85 7.13 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.919 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.652 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -107.42 108.77 26.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.727 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.264 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.567 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -103.77 123.9 47.91 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.068 -176.33 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.469 HG13 HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.63 105.83 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.397 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.2 p -70.23 90.63 0.69 Allowed 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.013 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.593 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 2.7 t -83.28 -134.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.494 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.506 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 26.8 t70 90.56 -5.79 0.3 Allowed 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.23 -58.56 0.59 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.27 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.727 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -43.65 -92.08 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.491 ' N ' ' HB3' ' B' ' 129' ' ' SER . 0.6 OUTLIER -179.02 37.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.388 0.995 . . . . 0.0 112.034 -179.396 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.758 ' CE1' ' HG2' ' B' ' 103' ' ' GLN . 0.0 OUTLIER -82.76 -43.75 16.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.083 0.953 . . . . 0.0 112.56 179.472 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.603 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 38.6 mt-30 -50.05 -44.12 51.4 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.619 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 1.2 mt -48.1 -30.4 4.46 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.267 0.485 . . . . 0.0 112.291 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.769 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -78.26 -57.35 3.83 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.408 177.518 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.603 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -63.18 -25.49 68.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.842 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -26.31 33.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.335 178.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.557 ' O ' ' CB ' ' A' ' 21' ' ' ASP . 9.6 m-30 -87.85 -40.62 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.557 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.3 t0 120.91 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 122.34 1.067 . . . . 0.0 111.086 177.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.495 ' CG1' ' O ' ' A' ' 22' ' ' VAL . 8.1 p -151.49 92.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.852 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.537 ' O ' HD13 ' A' ' 24' ' ' ILE . 1.7 m120 -65.75 48.8 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.46 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.761 HG12 ' CE ' ' B' ' 132' ' ' MET . 1.3 pp 31.68 9.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.58 ' HA ' HG22 ' B' ' 107' ' ' VAL . 67.2 m -36.47 -63.06 0.42 Allowed 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.036 0.446 . . . . 0.0 111.252 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -17.38 70.27 Favored Glycine 0 C--N 1.335 0.493 0 CA-C-N 115.848 -0.614 . . . . 0.0 112.62 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.567 ' CB ' HG21 ' A' ' 24' ' ' ILE . 2.3 tm? -67.54 -61.21 2.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.67 ' O ' ' HG2' ' A' ' 32' ' ' MET . 87.2 t -45.02 -67.67 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.361 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.516 ' HA ' ' HG2' ' A' ' 32' ' ' MET . 1.2 p -48.43 -36.92 15.81 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.581 0.752 . . . . 0.0 112.396 178.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.6 m -68.54 -52.75 28.55 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.7 m -55.95 -35.71 66.98 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.756 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.843 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 1.3 mmt -56.94 -55.03 39.91 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.983 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.513 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -56.09 -49.91 72.5 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.745 0.307 . . . . 0.0 111.259 179.844 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -59.6 -51.44 69.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.871 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.7 ' HB3' HD13 ' B' ' 117' ' ' LEU . 5.2 tp10 -74.13 -14.89 61.03 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.392 178.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.776 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -84.26 -32.7 24.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -52.03 13.31 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.772 0.796 . . . . 0.0 109.475 178.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.729 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.506 -178.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.448 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 1.4 mmpt? . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 120.899 0.38 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.758 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 4.5 tp60 -115.27 116.52 28.45 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.208 0.528 . . . . 0.0 110.648 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.43 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.02 111.08 14.86 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.083 -178.607 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.708 HG23 ' CD2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -115.31 118.84 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 175.844 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.652 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -123.98 131.19 53.53 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 120.285 -0.566 . . . . 0.0 111.722 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.64 HG23 ' HB ' ' A' ' 28' ' ' VAL . 0.9 OUTLIER -101.23 86.45 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.892 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 68.2 p -64.88 77.1 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 -179.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.66 HG12 ' HB2' ' B' ' 114' ' ' TYR . 7.2 p -108.92 -120.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.893 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.607 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 1.1 t70 94.47 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.963 1.363 . . . . 0.0 109.506 -176.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 45.7 t -154.46 -52.45 0.09 Allowed 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 112.507 -2.133 . . . . 0.0 111.845 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' A' ' 29' ' ' SER . 55.1 m-20 -75.33 54.14 0.7 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -177.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.513 ' OG ' ' HB2' ' A' ' 33' ' ' GLN . 2.4 m 70.48 -3.31 1.92 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.843 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.3 OUTLIER -55.1 -53.92 49.75 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.482 0.583 . . . . 0.0 111.204 179.491 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.555 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 14.3 mt-30 -49.85 -42.79 48.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -177.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.776 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -52.09 -31.38 30.32 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.428 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.755 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -77.75 -53.69 7.23 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.603 179.403 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.555 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.6 -28.11 68.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -58.57 -29.87 66.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.213 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.606 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.9 OUTLIER -88.5 -43.02 11.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.372 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.606 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 151.39 31.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 176.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.445 ' CG2' ' O ' ' B' ' 121' ' ' ASP . 74.5 t -162.37 97.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.407 0.146 . . . . 0.0 111.08 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.507 ' O ' ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.1 -83.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 178.09 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.746 HG13 ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -165.2 3.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 178.543 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.433 ' C ' ' O ' ' B' ' 124' ' ' ILE . 7.0 p -38.24 -63.74 0.47 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.39 0.995 . . . . 0.0 111.19 -177.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -84.81 -29.47 29.0 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.195 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.682 HD21 HD13 ' B' ' 117' ' ' LEU . 14.2 tp -59.72 -59.87 4.75 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.692 HG21 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -50.97 -59.69 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.727 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.1 m -50.03 -40.32 44.53 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 17.7 m -71.07 -53.01 16.18 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.493 HG23 ' O ' ' B' ' 128' ' ' VAL . 4.9 t -59.6 -36.97 77.34 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.857 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.769 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 3.5 mmt -60.6 -58.3 9.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.892 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.467 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 1.8 tt0 -55.67 -39.99 71.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.445 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -49.63 55.74 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.311 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.448 ' HA ' ' OE1' ' B' ' 135' ' ' GLU . 3.7 mm-40 -69.87 -26.99 64.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.619 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -63.93 -48.17 77.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 176.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -53.92 49.0 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.276 -0.875 . . . . 0.0 108.833 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.33 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.289 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 10.0 mmtt . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 110.857 -0.053 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.467 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -110.41 106.38 15.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.858 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.1 ttm105 -78.62 102.32 7.91 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.247 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.629 ' O ' ' HA ' ' B' ' 106' ' ' THR . 4.5 pt -104.0 130.12 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.742 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.06 126.07 34.88 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.052 0.453 . . . . 0.0 111.681 -176.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.553 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -99.67 106.7 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.62 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.461 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 1.8 p -70.21 73.93 0.49 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.418 0.628 . . . . 0.0 109.388 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.709 ' CG2' ' HB3' ' A' ' 14' ' ' TYR . 7.3 p -76.85 -135.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.411 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.67 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 16.0 t70 89.07 -7.31 0.44 Allowed 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.064 1.302 . . . . 0.0 108.964 -176.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 67.8 m -132.13 -54.77 0.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.404 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.747 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 0.6 OUTLIER -46.14 -93.39 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.432 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.2 OUTLIER -178.32 38.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 118.964 0.802 . . . . 0.0 111.288 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.709 ' HB3' ' CG2' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.2 -41.85 17.95 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.318 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.663 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.6 mm100 -48.79 -40.6 29.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -173.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.709 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -57.58 -52.12 66.69 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 119.031 0.832 . . . . 0.0 112.141 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.816 HD21 ' SD ' ' B' ' 132' ' ' MET . 1.5 tp -61.66 -36.48 80.95 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 119.805 -0.758 . . . . 0.0 112.971 -177.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.663 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -79.89 -29.3 39.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.509 0.671 . . . . 0.0 110.737 177.71 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.538 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -75.19 -32.16 61.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.851 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.753 ' CE1' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -87.63 -41.92 13.06 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.655 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.614 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 165.42 12.36 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 176.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.6 t -155.79 86.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 118.377 0.535 . . . . 0.0 111.354 -177.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.515 ' HB2' HD13 ' A' ' 24' ' ' ILE . 4.9 p30 -58.9 -95.1 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.725 ' HB ' HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.81 -0.31 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 177.825 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.552 ' HA ' HG21 ' B' ' 107' ' ' VAL . 73.7 p -41.38 -64.36 0.57 Allowed 'General case' 0 C--O 1.244 0.796 0 C-N-CA 119.126 -1.029 . . . . 0.0 109.22 -179.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.439 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.06 -29.0 24.11 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.121 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.626 HD13 ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -56.06 -61.86 2.1 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 116.812 0.306 . . . . 0.0 110.81 179.518 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.725 HG22 ' HB ' ' A' ' 24' ' ' ILE . 2.5 t -52.33 -61.6 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.163 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.693 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.5 p -50.25 -48.62 54.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.439 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.11 -51.3 25.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.476 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 2.6 m -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.311 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.855 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 16.7 mtt -61.65 -49.95 74.47 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.986 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.478 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.69 -43.58 80.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.334 0.515 . . . . 0.0 109.862 178.731 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.478 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -66.07 -48.06 72.21 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.644 ' HB3' ' CD2' ' B' ' 117' ' ' LEU . 3.9 tp10 -64.37 -30.05 71.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.887 177.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.557 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -69.47 -49.52 54.1 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 177.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.39 -51.47 66.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.736 0.779 . . . . 0.0 109.004 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.426 ' NE ' ' OD1' ' A' ' 34' ' ' ASN . 2.0 mtm-85 . . . . . 0 N--CA 1.448 -0.551 0 CA-C-N 113.918 -1.492 . . . . 0.0 111.406 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.556 ' HE3' ' HA ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.377 0 CA-C-O 120.87 0.367 . . . . 0.0 111.122 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.556 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 4.9 tp60 -100.5 110.02 22.17 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.532 0.682 . . . . 0.0 111.111 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.503 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.1 OUTLIER -79.4 101.48 8.17 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.362 -178.897 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.601 HG23 ' CD2' ' A' ' 14' ' ' TYR . 5.5 pt -108.0 122.53 62.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.742 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.0 125.0 32.15 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.966 -178.176 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.594 HG12 ' CG1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -100.75 101.8 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.858 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.1 p -66.81 86.23 0.12 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.384 0.611 . . . . 0.0 110.83 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.671 ' O ' ' HB3' ' B' ' 110' ' ' ASP . 28.6 m -81.71 -141.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.849 -178.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.671 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.8 t70 93.1 -7.24 0.15 Allowed 'General case' 0 C--N 1.356 0.86 0 CA-C-O 121.97 0.89 . . . . 0.0 108.757 -176.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.04 -58.16 1.01 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.283 177.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.693 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.07 -89.69 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.395 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.8 m 179.91 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.266 0.939 . . . . 0.0 112.03 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.855 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -82.7 -40.8 20.12 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.742 0.817 . . . . 0.0 113.18 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.617 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 3.8 mt-30 -48.84 -42.03 34.98 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -175.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -58.42 -45.95 87.43 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.015 1.28 . . . . 0.0 112.091 -179.383 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.775 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -55.39 -45.63 76.61 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.532 0.682 . . . . 0.0 111.132 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.18 -34.37 43.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 179.98 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.541 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -60.3 -28.45 68.12 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.701 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.626 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.32 -45.34 10.1 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.52 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.626 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.5 m-20 147.63 41.82 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 176.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.452 HG21 ' O ' ' B' ' 121' ' ' ASP . 24.6 t -150.87 -37.92 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' B' ' 122' ' ' VAL . 17.0 m-80 64.26 -112.16 0.31 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.755 ' HB ' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -144.5 -0.99 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 179.169 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.449 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.1 OUTLIER -40.01 -64.39 0.5 Allowed 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.769 -178.706 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.22 -31.48 16.78 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.01 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.572 HD11 ' HG ' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.07 -61.18 2.39 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.562 0.345 . . . . 0.0 110.143 178.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.755 HG23 ' HB ' ' B' ' 124' ' ' ILE . 2.4 t -52.58 -61.31 0.82 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.121 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.747 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 28.8 t -48.92 -45.21 41.18 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -71.93 -51.42 22.23 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.41 ' OG1' HG22 ' A' ' 31' ' ' THR . 21.0 m -58.58 -47.81 83.03 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.027 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.816 ' SD ' HD21 ' A' ' 17' ' ' LEU . 5.5 mmt -56.25 -57.75 10.89 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.131 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.462 ' HA ' ' HB1' ' B' ' 136' ' ' ALA . 42.0 tt0 -51.66 -37.52 50.82 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.485 0.183 . . . . 0.0 111.301 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -55.38 14.43 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.646 ' HB3' HD11 ' A' ' 17' ' ' LEU . 3.2 mt-10 -74.92 -9.69 58.78 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.736 0.303 . . . . 0.0 110.72 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.709 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -87.33 -29.62 21.43 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 -48.34 11.45 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 122.153 0.977 . . . . 0.0 109.027 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 . . . . . 0 CA--C 1.545 0.763 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.103 -178.027 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.6 mtmm . . . . . 0 N--CA 1.468 0.463 0 CA-C-O 120.504 0.192 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.647 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -126.62 122.74 35.87 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.39 0.614 . . . . 0.0 112.488 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.832 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.72 111.46 14.85 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.669 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -111.75 122.91 66.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.435 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.65 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.04 128.8 41.02 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 119.99 -0.684 . . . . 0.0 112.641 -177.385 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.628 ' CG2' ' HB ' ' A' ' 9' ' ' VAL . 0.5 OUTLIER -100.86 109.91 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 175.614 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.4 p -70.59 77.47 0.59 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.79 0.805 . . . . 0.0 109.392 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.767 HG21 ' HB3' ' A' ' 14' ' ' TYR . 9.9 p -92.51 -147.45 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-N 114.044 -1.435 . . . . 0.0 111.086 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.715 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 20.1 t70 106.7 13.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.477 1.132 . . . . 0.0 109.658 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -160.22 -40.3 0.05 Allowed 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.529 -1.668 . . . . 0.0 109.911 179.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.817 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 0.6 OUTLIER -69.81 35.11 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.504 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 28.7 m 72.18 4.08 4.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 177.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 1.003 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -58.0 -55.09 39.45 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.167 0.508 . . . . 0.0 111.959 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.565 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.6 mt-30 -49.74 -40.38 40.63 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -176.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.756 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -54.86 -32.49 60.8 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.726 ' CD1' ' HA ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -77.35 -51.78 10.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.645 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.64 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -68.16 -26.09 65.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.398 0.618 . . . . 0.0 109.788 178.478 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -60.63 -30.61 69.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.749 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.667 ' CE2' ' HG ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -88.35 -44.32 10.87 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 118.677 -0.677 . . . . 0.0 110.041 178.704 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.588 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 160.4 24.22 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.533 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.451 ' CG2' ' O ' ' A' ' 21' ' ' ASP . 68.1 t -160.65 101.22 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.64 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 1.5 m120 -58.77 -82.92 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 106.287 -1.745 . . . . 0.0 106.287 177.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.682 HG13 ' HE1' ' B' ' 132' ' ' MET . 0.2 OUTLIER -161.04 -1.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.647 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.468 ' C ' ' O ' ' A' ' 24' ' ' ILE . 0.5 OUTLIER -38.81 -62.87 0.57 Allowed 'General case' 0 C--O 1.241 0.617 0 CA-C-N 118.872 0.76 . . . . 0.0 109.686 -178.483 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.34 -33.44 31.89 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.802 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 26.5 tp -59.13 -60.93 3.07 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.031 0.416 . . . . 0.0 111.21 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.662 HG23 HG22 ' A' ' 24' ' ' ILE . 3.2 t -48.91 -68.49 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 O-C-N 123.351 0.407 . . . . 0.0 109.995 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.661 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -47.16 -41.49 17.93 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.183 0.593 . . . . 0.0 112.561 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -69.94 -50.04 45.92 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.856 0.836 . . . . 0.0 108.981 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.1 m -63.77 -28.83 70.14 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.205 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.894 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 4.0 mmt -55.87 -47.42 77.39 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.649 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -56.42 -57.17 13.44 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.514 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 2.8 t-20 -50.65 -51.31 50.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.013 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.613 ' HB2' HD12 ' B' ' 127' ' ' LEU . 2.0 tp10 -68.57 -36.94 79.43 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.457 ' HB3' ' HB3' ' B' ' 116' ' ' LEU . . . -57.93 -42.95 85.92 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -52.13 18.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.17 178.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.514 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.92 -177.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.494 0 CA-C-O 120.941 0.401 . . . . 0.0 111.413 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.715 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.0 tp60 -98.3 109.73 22.44 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.468 0.652 . . . . 0.0 109.815 178.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.482 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.1 OUTLIER -78.83 99.82 6.89 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.283 -178.304 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 6' ' ' THR . 7.2 pt -102.41 123.41 55.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.669 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.6 OUTLIER -131.24 123.35 28.23 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.914 -177.518 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.553 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.05 96.82 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 175.464 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.832 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 67.3 p -68.79 94.31 0.6 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.291 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.617 HG22 ' HB2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -116.49 -108.78 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.401 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.647 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 2.4 t0 81.95 25.51 0.2 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 123.211 1.481 . . . . 0.0 107.844 -174.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.8 p -151.21 -57.77 0.16 Allowed 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 112.005 -2.362 . . . . 0.0 111.196 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.661 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 65.3 m-20 -72.87 59.14 0.48 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.536 ' O ' ' HB3' ' A' ' 32' ' ' MET . 64.8 m 60.68 2.65 0.52 Allowed 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.843 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -59.97 -49.91 75.82 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.473 0.654 . . . . 0.0 109.584 178.715 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.702 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -49.46 -39.56 33.79 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.66 -177.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.457 ' HB3' ' HB3' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -54.99 -45.62 75.07 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.134 0.879 . . . . 0.0 110.238 179.578 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.894 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.3 OUTLIER -56.51 -53.89 52.2 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.843 179.208 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.702 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 17.8 pttt -68.92 -25.29 64.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.537 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.468 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.66 -28.0 53.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.3 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.568 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 87.6 m-85 -87.92 -42.75 12.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 177.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.568 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.6 t70 118.27 61.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.648 178.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.534 ' CG1' HD13 ' B' ' 117' ' ' LEU . 3.2 p -151.62 -33.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.46 -178.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.413 ' OD1' ' HB3' ' B' ' 118' ' ' LYS . 67.9 m-80 61.83 -123.38 0.78 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -178.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.645 ' HB ' HG21 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -137.28 9.93 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.598 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.436 ' C ' ' O ' ' B' ' 124' ' ' ILE . 91.9 p -38.84 -63.42 0.52 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.107 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.07 -34.64 14.19 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.681 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.613 HD12 ' HB2' ' A' ' 35' ' ' GLU . 34.0 tp -52.85 -61.64 2.16 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 117.33 0.565 . . . . 0.0 110.993 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.776 ' CG1' ' SD ' ' B' ' 132' ' ' MET . 2.6 t -50.05 -63.86 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.251 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.817 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.81 -47.0 42.58 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 123.773 0.829 . . . . 0.0 112.916 178.085 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -65.46 -56.83 10.28 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.49 -40.48 71.77 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.835 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 1.003 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 31.6 mtt -58.94 -53.76 54.77 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.816 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.504 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -53.32 -45.14 68.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.438 0.563 . . . . 0.0 110.843 178.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -65.41 -56.95 9.69 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.085 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -64.22 -24.14 67.56 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.756 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -71.76 -49.42 39.14 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.045 0.45 . . . . 0.0 109.863 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -52.23 64.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.706 0.765 . . . . 0.0 109.83 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.547 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.442 -0.869 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.905 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.425 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 8.4 mtmm . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.475 0.179 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.545 ' O ' ' HA ' ' B' ' 108' ' ' THR . 44.4 tt0 -100.19 118.73 37.11 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.218 0.533 . . . . 0.0 111.833 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.741 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.12 103.12 7.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.67 0.748 . . . . 0.0 111.594 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.662 HG23 ' CG ' ' B' ' 114' ' ' TYR . 2.6 pt -108.08 122.83 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.648 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.39 125.97 32.07 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.859 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.618 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.69 109.83 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.393 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.405 HG23 ' HG3' ' B' ' 104' ' ' ARG . 3.3 p -70.34 85.93 0.59 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.37 0.605 . . . . 0.0 110.484 -179.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.697 ' CG2' ' CD1' ' A' ' 14' ' ' TYR . 26.6 m -77.98 -146.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.088 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.645 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 22.9 t0 91.95 -7.88 0.22 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.777 0.799 . . . . 0.0 109.153 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.5 t -130.91 -59.72 0.99 Allowed 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.053 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.734 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.7 OUTLIER -44.4 -94.26 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -178.443 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.519 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 3.1 m -179.8 38.15 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 118.978 0.808 . . . . 0.0 111.526 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.697 ' CD1' ' CG2' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.92 -44.29 15.53 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.634 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 3.4 mt-30 -48.78 -38.78 22.92 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.564 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 1.6 mt -53.74 -57.18 11.79 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.673 0.67 . . . . 0.0 112.331 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.692 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -54.25 -42.68 70.18 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 120.211 -0.596 . . . . 0.0 112.437 -178.05 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.634 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.7 -28.4 40.65 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.371 179.615 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -56.29 -24.86 45.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.587 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.59 ' HE2' ' HA ' ' B' ' 136' ' ' ALA . 2.8 m-85 -87.98 -49.15 7.25 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.146 -0.934 . . . . 0.0 108.82 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.571 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 3.8 m-20 143.46 37.15 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 O-C-N 124.443 1.089 . . . . 0.0 110.504 178.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 t -147.87 77.74 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.652 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.51 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 18.9 m-80 -59.0 -105.17 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.703 ' HB ' HG21 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -147.62 7.4 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.572 ' HA ' HG23 ' B' ' 107' ' ' VAL . 31.0 p -41.86 -64.42 0.58 Allowed 'General case' 0 C--O 1.24 0.594 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.335 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.8 -30.85 13.79 Favored Glycine 0 C--N 1.333 0.39 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.991 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.601 HD11 ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -52.3 -61.5 2.24 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 122.486 0.315 . . . . 0.0 110.226 178.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.703 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.2 t -51.23 -58.7 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.713 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 9.7 p -48.67 -42.4 34.56 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.403 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -79.59 -45.12 19.76 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.13 0.49 . . . . 0.0 110.256 179.826 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.403 ' N ' ' CG2' ' A' ' 30' ' ' THR . 3.2 m -59.3 -44.64 92.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.803 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.908 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.16 -48.52 61.84 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.436 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -61.38 -37.42 83.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.825 -0.17 . . . . 0.0 111.315 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -51.31 42.0 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.532 ' HG2' HD13 ' B' ' 127' ' ' LEU . 20.5 tp10 -65.77 -34.45 78.21 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -62.45 -45.16 94.33 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -50.42 71.77 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 122.121 0.962 . . . . 0.0 108.785 177.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.2 ttp85 . . . . . 0 CA--C 1.55 0.969 0 CA-C-N 113.322 -1.763 . . . . 0.0 113.673 -178.013 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.645 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.266 0 CA-C-O 121.204 0.526 . . . . 0.0 111.122 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.478 ' HB3' HG22 ' A' ' 9' ' ' VAL . 13.9 tt0 -105.21 107.63 18.72 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.823 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.438 ' HB2' ' NH1' ' B' ' 104' ' ' ARG . 5.2 ttm105 -78.6 101.48 7.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.393 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.651 ' O ' HG13 ' B' ' 105' ' ' ILE . 20.0 pt -102.94 116.6 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.65 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.648 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.92 119.19 35.12 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.223 -177.844 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.618 HG12 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.63 92.21 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 176.03 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.741 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 81.7 p -62.08 90.87 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.089 0.471 . . . . 0.0 110.412 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.681 ' O ' ' HB3' ' B' ' 110' ' ' ASP . 2.1 t -84.12 -136.43 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.04 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.681 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 90.14 -12.26 0.32 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -175.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 39.5 t -122.31 -63.11 1.32 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.161 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.713 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -43.49 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.365 0.416 . . . . 0.0 112.071 -179.018 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.525 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER 176.24 44.24 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.744 0.702 . . . . 0.0 110.671 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.834 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.3 OUTLIER -83.1 -41.9 18.03 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.471 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.592 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.58 -43.62 36.06 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -176.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.83 -30.61 5.96 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.713 0.688 . . . . 0.0 112.163 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.908 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.34 -60.11 2.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.374 178.351 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.608 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -63.38 -25.8 68.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.241 179.754 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.447 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.93 -29.17 55.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.518 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.583 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 14.4 m-30 -94.23 -42.32 9.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.583 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 27.6 t70 125.15 54.7 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 122.343 1.068 . . . . 0.0 110.177 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.683 HG11 HD12 ' B' ' 117' ' ' LEU . 4.8 p -142.84 -38.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 CA-C-N 113.846 -1.525 . . . . 0.0 111.856 -177.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.429 ' O ' ' HE1' ' A' ' 32' ' ' MET . 21.9 m-80 54.65 -117.05 1.12 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.732 ' HB ' HG21 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.78 5.86 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -179.296 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.456 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -39.18 -63.78 0.51 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.978 -178.471 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.98 -31.24 21.02 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.347 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.55 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 20.3 tp -55.5 -61.67 2.19 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 116.824 0.312 . . . . 0.0 110.664 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.732 HG21 ' HB ' ' B' ' 124' ' ' ILE . 3.2 t -52.76 -63.22 0.5 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.974 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.057 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.734 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 11.3 p -49.52 -46.78 48.91 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.418 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.6 OUTLIER -72.74 -47.4 47.21 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.418 ' N ' ' CG2' ' B' ' 130' ' ' THR . 16.7 m -57.78 -53.98 52.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.4 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.692 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 6.1 mmt -50.06 -52.65 32.78 Favored 'General case' 0 C--O 1.205 -1.246 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.118 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.519 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 3.6 tt0 -53.96 -49.1 69.5 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 117.735 0.243 . . . . 0.0 111.369 179.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -65.04 -43.42 92.43 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -76.19 -8.65 57.5 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.124 177.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.618 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -87.43 -47.21 8.95 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 123.158 0.583 . . . . 0.0 109.909 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -56.82 6.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.486 0.66 . . . . 0.0 109.867 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.545 0.757 0 CA-C-N 114.579 -1.191 . . . . 0.0 114.126 -177.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.491 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.2 mmtm . . . . . 0 C--O 1.235 0.29 0 CA-C-O 121.114 0.483 . . . . 0.0 110.149 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.479 ' HG2' ' CG2' ' A' ' 5' ' ' ILE . 1.0 OUTLIER -88.88 114.62 25.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.489 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.84 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -78.94 98.57 6.46 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.936 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.655 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -114.67 109.8 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.526 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.725 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.3 OUTLIER -108.87 133.81 52.39 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.582 -177.252 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.573 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -99.44 101.18 11.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.0 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 25.9 p -62.39 88.46 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.632 0.73 . . . . 0.0 110.189 -178.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.716 ' CG2' ' CD2' ' A' ' 14' ' ' TYR . 28.7 m -80.05 -137.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 114.258 -1.337 . . . . 0.0 112.032 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.508 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 24.6 t0 81.82 -10.54 1.13 Allowed 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -177.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.0 m -120.49 -69.68 0.83 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.674 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.705 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 0.2 OUTLIER -51.32 -89.41 0.0 OUTLIER 'General case' 0 C--N 1.353 0.747 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.146 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.515 ' HB3' ' O ' ' B' ' 129' ' ' SER . 29.2 t -177.14 47.55 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.249 0.931 . . . . 0.0 111.529 -178.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.874 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -80.35 -46.8 15.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -179.796 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.625 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 2.3 mm100 -49.18 -39.78 30.65 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -176.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HA ' ' HB3' ' A' ' 19' ' ' ALA . 0.7 OUTLIER -56.01 -56.15 24.26 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.588 ' HG ' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -45.5 -52.91 9.66 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.804 0.812 . . . . 0.0 111.508 -177.695 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.696 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 5.8 pttt -78.99 -26.58 43.35 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.772 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.511 ' HB3' ' HA ' ' A' ' 16' ' ' LEU . . . -62.2 -22.84 66.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.251 177.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.608 ' CD1' ' N ' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -87.83 -43.37 11.88 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 118.666 -0.683 . . . . 0.0 109.441 178.322 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.608 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 164.34 21.79 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 177.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.513 ' C ' ' H ' ' A' ' 24' ' ' ILE . 59.0 t -153.54 101.82 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.696 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 46.8 m-80 -66.25 52.37 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.141 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.695 HG23 ' HE3' ' B' ' 132' ' ' MET . 1.9 pp 35.61 -2.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 120.068 3.359 . . . . 0.0 120.068 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.48 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -38.05 -57.66 1.03 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 118.917 0.78 . . . . 0.0 110.204 -179.537 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.61 -29.55 43.25 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.868 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 1.1 tm? -60.83 -56.13 24.82 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.603 HG21 HG23 ' B' ' 128' ' ' VAL . 90.7 t -45.52 -67.95 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 109.987 178.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.602 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.1 p -50.57 -42.24 55.28 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.577 0.751 . . . . 0.0 112.71 178.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.2 m -66.46 -57.44 7.36 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -52.85 -41.64 64.46 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.038 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.812 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -48.68 -49.59 37.0 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.389 178.713 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.68 -45.49 85.55 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.361 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -51.79 57.02 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.737 ' HG3' HD23 ' B' ' 127' ' ' LEU . 1.4 mm-40 -64.5 -28.31 69.57 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.576 178.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.569 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.61 -45.57 61.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.002 0.43 . . . . 0.0 110.491 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -73.23 -56.54 4.94 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.088 0.471 . . . . 0.0 111.233 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.508 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.6 OUTLIER . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.388 0.137 . . . . 0.0 110.654 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.607 ' HB3' HG22 ' A' ' 9' ' ' VAL . 12.5 tp60 -114.62 116.98 29.61 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.324 0.583 . . . . 0.0 111.472 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.643 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.38 106.49 11.45 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.29 -0.868 . . . . 0.0 112.042 -179.124 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.724 HG13 ' O ' ' B' ' 105' ' ' ILE . 2.8 pt -115.03 115.65 50.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.725 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -124.46 132.12 53.5 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.612 -177.521 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.71 ' CG2' ' HB ' ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.37 99.28 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 174.676 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.84 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 71.8 p -69.15 71.92 0.27 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.71 ' HB ' ' CG2' ' B' ' 107' ' ' VAL . 14.4 p -101.81 -131.56 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.919 -176.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.586 ' O ' ' HG3' ' B' ' 115' ' ' GLN . 1.0 OUTLIER 155.38 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -178.335 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 8.3 t -80.43 -1.23 40.58 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.609 ' CB ' ' CG2' ' B' ' 109' ' ' VAL . 4.9 t0 -74.91 52.75 0.56 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 120.303 1.41 . . . . 0.0 109.534 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.469 ' O ' ' HB3' ' A' ' 32' ' ' MET . 2.8 m 65.17 -11.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.812 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.8 OUTLIER -53.53 -60.04 3.82 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 118.207 0.458 . . . . 0.0 110.326 179.719 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' B' ' 110' ' ' ASP . 85.8 mt-30 -49.56 -41.04 40.5 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.979 -177.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.502 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.93 -28.08 21.85 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.552 ' HG ' ' CD1' ' B' ' 127' ' ' LEU . 0.5 OUTLIER -77.52 -55.4 5.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.44 0.638 . . . . 0.0 110.885 178.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.689 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -64.01 -25.87 68.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.26 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.87 -27.8 45.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.379 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.573 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 13.0 m-30 -88.5 -42.53 12.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.078 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.573 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 18.7 t70 124.95 63.67 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 O-C-N 124.548 1.155 . . . . 0.0 110.469 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.538 ' CG1' ' CD1' ' B' ' 117' ' ' LEU . 3.7 p -159.7 -32.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.507 -178.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 6.7 p30 54.64 -102.91 0.16 Allowed 'General case' 0 C--N 1.343 0.29 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.775 ' CG2' ' HE2' ' A' ' 32' ' ' MET . 0.3 OUTLIER -158.4 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 179.3 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.556 ' O ' HG22 ' A' ' 7' ' ' VAL . 8.8 p -39.61 -64.63 0.46 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.436 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.674 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.04 -32.78 16.56 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.724 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.737 HD23 ' HG3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -56.57 -62.92 1.4 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.852 0.326 . . . . 0.0 111.12 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.74 HG11 ' SD ' ' B' ' 132' ' ' MET . 2.1 t -55.22 -69.16 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.729 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 1.1 t -51.38 -41.21 60.53 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.674 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -76.05 -50.08 15.75 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 118.754 0.706 . . . . 0.0 109.282 179.12 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 1.3 m -51.47 -35.96 42.23 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.874 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 2.4 mtt -55.4 -48.76 73.87 Favored 'General case' 0 C--O 1.201 -1.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.439 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -53.98 -36.44 62.92 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.216 0.916 . . . . 0.0 110.561 179.42 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . 0.463 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 1.3 m-20 -75.19 -48.49 23.27 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.507 ' HG2' HD12 ' A' ' 17' ' ' LEU . 2.7 tp10 -68.92 -21.94 64.19 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.834 177.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.64 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -76.71 -47.37 22.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.672 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -56.41 13.43 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.659 0.742 . . . . 0.0 109.549 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.444 -0.759 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.445 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt . . . . . 0 N--CA 1.47 0.527 0 CA-C-O 121.011 0.434 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.533 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -98.76 106.78 19.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.454 0.645 . . . . 0.0 110.397 179.516 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.827 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.48 103.91 9.72 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.187 -179.221 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.707 HG22 ' CD1' ' B' ' 114' ' ' TYR . 9.0 pt -100.05 128.88 51.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.71 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.3 OUTLIER -132.52 124.37 28.36 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 117.992 -1.483 . . . . 0.0 113.997 -177.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.631 HG13 ' CG2' ' B' ' 105' ' ' ILE . 1.2 p -100.33 101.72 12.47 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 176.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 37.7 p -69.98 80.71 0.48 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.447 0.641 . . . . 0.0 110.471 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.687 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 4.0 t -72.93 -124.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.912 -178.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.681 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 0.4 OUTLIER 99.95 6.02 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.179 0.992 . . . . 0.0 109.88 -176.294 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.7 t -167.44 -42.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.876 -1.056 . . . . 0.0 112.161 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.64 ' O ' ' HA ' ' B' ' 129' ' ' SER . 0.5 OUTLIER -62.24 47.92 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -177.274 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' B' ' 132' ' ' MET . 1.0 OUTLIER 53.66 7.51 0.11 Allowed 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 177.181 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.764 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -66.59 -52.57 43.95 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.278 0.49 . . . . 0.0 111.141 179.181 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.745 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.54 -36.88 24.92 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 0.4 OUTLIER -55.5 -56.47 19.82 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.477 0.58 . . . . 0.0 111.224 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.791 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.5 -54.09 15.62 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.288 0.566 . . . . 0.0 111.355 -178.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 7.5 pttt -71.9 -25.74 62.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.153 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -58.5 -20.12 42.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.469 178.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.642 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 23.5 m-85 -87.69 -53.58 4.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.642 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.65 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 O-C-N 124.303 1.002 . . . . 0.0 111.821 178.57 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.487 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 9.7 p -147.03 80.61 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.522 0.677 . . . . 0.0 112.439 -178.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.534 ' O ' ' N ' ' A' ' 25' ' ' SER . 48.8 m-80 -65.42 63.44 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.883 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.783 ' CG2' ' HE3' ' B' ' 132' ' ' MET . 0.5 OUTLIER 39.53 -7.94 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 118.336 2.717 . . . . 0.0 118.336 179.176 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -37.71 -60.07 0.75 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 120.432 1.469 . . . . 0.0 110.318 -178.28 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.53 -28.27 40.05 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.143 -0.551 . . . . 0.0 112.279 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.679 ' HB3' HG21 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -65.09 -61.35 2.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 122.677 0.391 . . . . 0.0 111.202 179.961 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.723 HG21 ' HB ' ' A' ' 24' ' ' ILE . 15.4 t -47.89 -61.25 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.478 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.793 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 7.7 p -49.2 -44.8 43.46 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 124.814 1.246 . . . . 0.0 113.417 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 97.4 m -67.07 -51.09 58.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 m -60.37 -34.07 73.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.288 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.902 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 3.3 mmt -57.73 -57.28 13.45 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.933 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.436 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -57.98 -45.42 86.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.606 0.241 . . . . 0.0 110.866 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.436 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 2.4 t-20 -64.06 -55.49 21.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.615 179.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.605 ' HG2' ' CD1' ' B' ' 127' ' ' LEU . 1.7 tp10 -67.57 -22.1 65.4 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.734 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -72.1 -42.94 65.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.71 -56.63 5.0 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.783 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.43 ' HD3' ' HA ' ' A' ' 38' ' ' ARG . 22.3 mmt180 . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -176.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.681 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.465 0.302 0 CA-C-O 120.716 0.293 . . . . 0.0 111.389 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.514 ' O ' ' HA ' ' A' ' 8' ' ' THR . 3.7 tt0 -122.79 125.65 45.88 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.572 ' HG3' ' OG1' ' A' ' 6' ' ' THR . 4.3 ttt-85 -78.32 112.51 15.4 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.958 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.764 HG13 ' CD1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -95.45 122.47 46.95 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.542 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 175.069 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.718 HG21 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -131.89 109.83 10.36 Favored 'General case' 0 C--N 1.299 -1.589 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.889 -177.03 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.567 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -102.92 107.71 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.364 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.827 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 6.1 p -70.97 98.19 1.57 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.464 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.632 ' HB ' ' HB3' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.94 -148.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.888 -178.449 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.598 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 15.6 t70 106.55 6.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 122.197 0.998 . . . . 0.0 108.591 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.68 -41.68 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.6 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.793 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -78.57 42.32 0.43 Allowed 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -176.875 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.493 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 41.0 m 67.97 -2.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 177.087 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.892 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -54.23 -51.02 65.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.878 0.763 . . . . 0.0 110.604 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.591 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 6.2 mm-40 -50.0 -43.99 50.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.94 -176.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.734 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -53.55 -27.9 28.65 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.764 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.902 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -77.58 -55.46 5.34 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.622 0.725 . . . . 0.0 110.906 178.184 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.591 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.6 OUTLIER -65.87 -25.44 67.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.832 179.848 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.82 -28.35 48.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.007 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.563 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 16.0 m-30 -88.57 -42.56 11.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.897 178.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 25.3 t70 121.29 62.4 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 124.58 1.175 . . . . 0.0 109.775 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.462 ' HB ' HD12 ' B' ' 117' ' ' LEU . 51.3 t -144.21 -48.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.975 -178.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.405 ' HB3' HD13 ' B' ' 124' ' ' ILE . 53.4 m-80 64.54 -113.95 0.34 Allowed 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -178.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.668 HG21 ' HE2' ' A' ' 32' ' ' MET . 0.1 OUTLIER -146.93 4.28 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 114.66 1.355 . . . . 0.0 114.66 179.245 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.427 ' C ' ' O ' ' B' ' 124' ' ' ILE . 27.6 t -40.58 -64.6 0.5 Allowed 'General case' 0 C--O 1.241 0.643 0 C-N-CA 120.139 -0.625 . . . . 0.0 109.905 -178.274 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.71 -25.41 35.36 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.787 177.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.605 ' CD1' ' HG2' ' A' ' 35' ' ' GLU . 4.3 tp -60.84 -61.41 2.61 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 179.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.726 ' O ' ' HG2' ' B' ' 132' ' ' MET . 3.1 t -52.48 -65.57 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.884 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.64 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 8.8 p -46.94 -44.23 19.75 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.24 -43.81 49.57 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 119.097 0.862 . . . . 0.0 109.392 178.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 18.9 m -59.58 -39.9 85.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.479 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.791 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 6.4 mmt -61.05 -57.5 12.34 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.341 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -34.24 56.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 118.152 0.433 . . . . 0.0 111.745 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -79.23 -47.86 15.2 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.182 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.411 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -72.87 -22.2 60.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.988 0.423 . . . . 0.0 109.925 177.855 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.57 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -71.71 -45.2 62.56 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.6 mmt85 -67.5 -56.05 11.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.104 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.424 ' HD2' ' C ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.751 0 CA-C-N 114.052 -1.431 . . . . 0.0 114.287 -177.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.588 ' HA ' ' CB ' ' B' ' 110' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.412 0 CA-C-O 121.193 0.52 . . . . 0.0 111.746 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.593 ' O ' ' HA ' ' B' ' 108' ' ' THR . 15.8 tt0 -129.6 113.12 14.42 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 121.491 0.662 . . . . 0.0 110.997 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.735 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.3 ttm180 -78.77 109.8 13.35 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.598 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.652 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -102.54 109.82 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.059 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 176.153 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.834 ' CG2' ' HG2' ' B' ' 104' ' ' ARG . 1.5 m -117.25 118.55 32.59 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 120.264 -0.574 . . . . 0.0 111.463 -175.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.483 ' CG1' HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.75 106.22 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.24 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.83 79.91 0.62 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.209 0.528 . . . . 0.0 110.375 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.695 HG22 ' CD1' ' A' ' 14' ' ' TYR . 6.2 m -72.84 -158.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.37 -178.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.581 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 10.9 t70 93.55 -22.66 0.06 Allowed 'General case' 0 C--N 1.351 0.643 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -176.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.473 ' OG ' ' HE3' ' B' ' 102' ' ' LYS . 0.4 OUTLIER -116.37 -1.58 12.27 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.896 177.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.723 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -110.7 -95.58 0.42 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.774 177.596 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.754 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.3 OUTLIER -173.85 30.34 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 118.481 0.582 . . . . 0.0 111.96 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.795 ' CD2' HG21 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -70.34 -39.11 74.89 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.533 0.733 . . . . 0.0 112.243 179.091 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.537 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.8 OUTLIER -49.79 -47.94 50.9 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -176.442 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.581 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -49.53 -28.96 6.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -179.468 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.574 HD21 ' CG1' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -78.26 -60.16 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.391 0.615 . . . . 0.0 111.057 178.101 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.538 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.67 -25.5 68.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.648 179.496 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.4 -27.11 34.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.647 179.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.686 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 14.8 m-30 -88.58 -52.32 5.22 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.862 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.686 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 16.6 p-10 147.02 40.86 0.0 OUTLIER 'General case' 0 C--N 1.357 0.924 0 O-C-N 124.638 1.211 . . . . 0.0 111.395 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.574 ' CG1' HD21 ' A' ' 17' ' ' LEU . 14.4 p -138.08 89.33 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.162 0.506 . . . . 0.0 112.317 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.532 ' O ' HD12 ' A' ' 24' ' ' ILE . 5.4 m-20 -76.78 50.89 0.73 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.161 0.505 . . . . 0.0 110.636 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.81 ' CG2' ' HE3' ' B' ' 132' ' ' MET . 1.4 pp 33.76 5.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.761 ' HA ' HG21 ' B' ' 107' ' ' VAL . 1.4 p -37.49 -63.55 0.44 Allowed 'General case' 0 C--O 1.247 0.961 0 CA-C-N 119.092 0.86 . . . . 0.0 110.743 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.445 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -76.44 -25.64 65.21 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.003 177.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.675 ' HB3' HG21 ' A' ' 24' ' ' ILE . 3.2 tm? -65.84 -60.21 3.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.51 -0.281 . . . . 0.0 110.791 179.369 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.542 HG21 ' HB ' ' A' ' 24' ' ' ILE . 61.8 t -42.14 -71.6 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 CA-C-N 117.586 0.175 . . . . 0.0 110.642 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.66 ' O ' ' HB2' ' B' ' 113' ' ' SER . 88.2 p -49.57 -34.17 16.95 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.1 m -75.2 -52.14 11.65 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 121.043 -1.036 . . . . 0.0 110.308 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -56.8 -28.45 61.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.403 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.865 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -54.2 -54.44 39.88 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.698 178.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.461 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.55 -33.14 65.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 111.633 -179.416 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.461 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.8 t-20 -76.33 -47.68 22.7 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.598 ' HG2' ' HG ' ' B' ' 127' ' ' LEU . 5.1 tp10 -67.41 -31.47 71.7 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.327 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.466 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -72.41 -39.47 67.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.74 179.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.457 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -70.14 -56.2 7.45 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.57 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 38' ' ' ARG . 12.0 mmm180 . . . . . 0 N--CA 1.446 -0.652 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.823 -177.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.581 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 5.7 mmtm . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.571 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -100.72 111.76 24.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.823 0.821 . . . . 0.0 112.627 -178.567 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.834 ' HG2' ' CG2' ' A' ' 6' ' ' THR . 0.1 OUTLIER -79.59 101.31 8.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.7 -178.602 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.795 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -107.3 128.52 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 176.101 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.652 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -132.09 129.12 39.54 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.659 -178.494 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.761 HG21 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.23 88.08 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 175.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.735 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 57.9 p -70.82 67.27 0.38 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.467 0.651 . . . . 0.0 109.691 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.707 HG21 ' HB3' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -63.77 -101.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 114.716 -1.129 . . . . 0.0 112.341 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.632 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.2 t70 75.75 -1.89 2.89 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 -173.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 111' ' ' SER . . . . . 0.462 ' H ' ' C ' ' B' ' 109' ' ' VAL . 54.9 p -94.26 -73.8 0.56 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.034 -1.439 . . . . 0.0 109.758 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' B' ' 114' ' ' TYR . 1.1 p-10 -144.83 156.1 43.84 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -175.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.66 ' HB2' ' O ' ' A' ' 29' ' ' SER . 1.0 OUTLIER 48.19 -27.3 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 175.539 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.865 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 1.7 t80 -54.6 -60.04 3.89 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.321 0.964 . . . . 0.0 109.393 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.638 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 48.0 mt-30 -49.75 -42.22 45.79 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.669 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.71 -55.7 15.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.468 0.651 . . . . 0.0 109.375 178.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.657 HD12 ' HB ' ' B' ' 122' ' ' VAL . 0.4 OUTLIER -46.72 -53.89 10.82 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.318 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.638 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -74.5 -25.47 59.38 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.085 179.666 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.501 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.82 -29.83 60.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.647 178.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.681 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 15.0 m-30 -87.94 -40.63 13.77 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.681 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 4.5 p-10 132.92 17.33 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 O-C-N 124.988 1.43 . . . . 0.0 111.751 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.657 ' HB ' HD12 ' B' ' 117' ' ' LEU . 26.1 t -105.34 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.177 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' B' ' 125' ' ' SER . 0.0 OUTLIER -67.43 45.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.092 0.472 . . . . 0.0 111.199 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.628 HG12 ' HE2' ' A' ' 32' ' ' MET . 1.8 pp 32.74 6.56 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 119.457 3.132 . . . . 0.0 119.457 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.517 ' N ' ' O ' ' B' ' 123' ' ' ASN . 3.7 p -37.93 -62.93 0.51 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 117.973 0.351 . . . . 0.0 111.347 -178.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.457 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -82.85 -24.36 53.15 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.058 178.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.598 ' HG ' ' HG2' ' A' ' 35' ' ' GLU . 2.3 tm? -66.81 -61.51 1.92 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.587 HG21 ' HB ' ' B' ' 124' ' ' ILE . 2.6 t -52.43 -60.64 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-O 121.007 0.432 . . . . 0.0 109.889 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.723 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 63.3 p -54.82 -33.25 61.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.075 -0.966 . . . . 0.0 113.397 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.457 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 3.4 m -79.57 -54.22 6.11 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 121.728 -0.607 . . . . 0.0 111.073 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.04 -36.64 40.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.915 -178.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.81 ' HE3' ' CG2' ' A' ' 24' ' ' ILE . 3.9 mtt -56.77 -53.23 60.18 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.36 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.754 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -56.26 -40.48 74.27 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.742 -179.777 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . 0.534 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 73.9 m-80 -67.98 -55.08 14.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.299 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -34.58 77.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.925 0.393 . . . . 0.0 110.248 178.369 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.581 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -66.38 -45.69 79.21 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.057 178.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -52.17 65.27 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.814 0.816 . . . . 0.0 109.378 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.444 -0.737 0 CA-C-N 114.003 -1.453 . . . . 0.0 112.145 -178.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.531 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.831 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.597 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 33.6 tp60 -112.59 110.34 20.45 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.276 178.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.77 ' HG2' HG23 ' B' ' 106' ' ' THR . 5.4 ttm105 -80.0 117.03 20.47 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-O 121.641 0.734 . . . . 0.0 112.662 -178.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.806 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.96 131.95 55.59 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 177.036 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.709 ' HB ' ' CG2' ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.48 121.93 32.08 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.557 -177.422 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.591 ' CG1' ' O ' ' A' ' 7' ' ' VAL . 1.0 OUTLIER -102.72 96.94 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 174.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.594 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 69.7 p -70.92 87.35 0.72 Allowed 'General case' 0 C--N 1.317 -0.84 0 O-C-N 121.102 -0.999 . . . . 0.0 109.921 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.706 HG22 ' HB3' ' A' ' 14' ' ' TYR . 14.0 m -144.86 55.47 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 117.217 2.302 . . . . 0.0 117.217 -177.396 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.753 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 0.8 OUTLIER -73.98 54.33 0.51 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 123.761 1.743 . . . . 0.0 108.277 173.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.51 ' H ' ' C ' ' A' ' 9' ' ' VAL . 28.6 t -164.65 -47.78 0.03 OUTLIER 'General case' 0 C--N 1.27 -2.85 0 CA-C-N 111.463 -2.608 . . . . 0.0 110.905 -178.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.585 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 20.4 m-20 -73.4 47.25 0.22 Allowed 'General case' 0 C--N 1.348 0.502 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.717 -178.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.526 ' O ' ' HB3' ' B' ' 132' ' ' MET . 51.0 m 69.5 -3.07 1.71 Allowed 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.896 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -61.64 -45.23 94.96 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.556 0.693 . . . . 0.0 110.213 179.26 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.747 ' HG3' ' HA ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -48.17 -44.68 32.75 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.092 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.527 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.1 OUTLIER -60.36 -49.01 79.3 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -178.63 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.924 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.1 -44.78 52.22 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.393 0.616 . . . . 0.0 111.372 -179.66 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.737 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 21.2 pttt -79.63 -33.85 41.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.32 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.517 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -62.07 -28.99 70.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.362 178.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.61 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -88.15 -45.29 10.24 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 117.772 -1.109 . . . . 0.0 110.864 179.218 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.61 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 152.35 31.46 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.453 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.43 HG22 ' O ' ' A' ' 21' ' ' ASP . 27.1 t -145.52 -33.67 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.502 -0.879 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.562 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 9.9 p30 53.89 -104.42 0.21 Allowed 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -176.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.7 ' HB ' HG21 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -153.66 -0.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 178.456 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.572 ' HA ' HG23 ' B' ' 107' ' ' VAL . 51.8 p -39.01 -64.31 0.46 Allowed 'General case' 0 C--O 1.241 0.648 0 CA-C-N 119.265 0.938 . . . . 0.0 109.505 -178.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.45 -28.64 24.13 Favored Glycine 0 CA--C 1.522 0.475 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.208 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.554 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 2.9 tp -56.45 -58.29 8.67 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.815 0.308 . . . . 0.0 110.357 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.7 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.6 t -53.99 -62.6 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.669 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 59.9 p -49.43 -45.16 46.11 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.72 -46.07 26.89 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.861 0.362 . . . . 0.0 110.221 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.3 m -61.2 -38.52 86.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.399 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.817 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -51.3 -43.34 61.63 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.135 179.258 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.492 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -63.49 -46.2 87.21 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.558 0.218 . . . . 0.0 110.731 179.02 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.492 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.27 -48.17 79.29 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.746 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.557 ' HG3' ' HG ' ' B' ' 127' ' ' LEU . 2.5 mm-40 -66.26 -36.14 82.24 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.483 ' N ' HD23 ' B' ' 117' ' ' LEU . . . -59.38 -42.78 92.45 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.719 -0.613 . . . . 0.0 109.466 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -78.36 -56.46 4.43 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.922 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -176.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.553 ' O ' ' HG2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 121.173 0.511 . . . . 0.0 111.927 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.753 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 1.4 tp60 -97.0 121.59 39.05 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.864 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.559 ' HG3' ' OG1' ' A' ' 6' ' ' THR . 2.7 ttm105 -77.8 105.99 9.34 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.734 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.684 HG21 ' CD1' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -99.8 108.69 23.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.022 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 178.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.77 HG23 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -119.35 112.74 19.81 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.416 -173.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.572 HG23 ' HA ' ' A' ' 25' ' ' SER . 1.2 p -100.59 112.13 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.45 177.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.759 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 3.3 p -70.93 87.51 0.73 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.697 HG21 ' CG ' ' B' ' 114' ' ' TYR . 13.2 m -89.37 -143.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.597 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 6.4 t70 87.95 -7.49 0.56 Allowed 'General case' 0 C--N 1.351 0.633 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -176.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.34 -65.52 1.1 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.244 -1.344 . . . . 0.0 107.839 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.669 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -43.53 -86.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.172 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 2.2 m 175.97 41.31 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 118.428 0.558 . . . . 0.0 111.454 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.806 ' CD1' HG21 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -83.6 -45.46 13.47 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.596 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -48.58 -40.68 28.19 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.048 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.81 -56.28 18.97 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.115 0.87 . . . . 0.0 111.705 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.817 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -55.67 -45.74 77.68 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.925 -178.534 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.596 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -73.41 -26.85 61.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.948 179.037 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -70.21 -14.36 62.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.34 177.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.679 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.8 m-85 -87.72 -44.54 11.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.679 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.2 m-20 128.1 9.17 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 O-C-N 125.166 1.541 . . . . 0.0 111.278 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.568 ' HB ' HD11 ' B' ' 117' ' ' LEU . 98.3 t -101.91 -36.29 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.171 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.443 ' OD1' ' HA ' ' B' ' 118' ' ' LYS . 1.3 m-20 54.31 -119.86 1.54 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.763 HG22 HG23 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -137.52 0.56 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 179.399 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.43 ' C ' ' O ' ' B' ' 124' ' ' ILE . 10.8 p -43.0 -64.63 0.59 Allowed 'General case' 0 C--O 1.243 0.734 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -83.31 -29.19 34.14 Favored Glycine 0 C--N 1.334 0.444 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.893 178.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.688 HD12 ' HG ' ' B' ' 117' ' ' LEU . 4.8 tt -59.57 -61.99 2.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 117.418 0.609 . . . . 0.0 110.944 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.763 HG23 HG22 ' B' ' 124' ' ' ILE . 3.2 t -50.97 -66.44 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 C-N-CA 120.526 -0.47 . . . . 0.0 109.902 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.585 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 22.0 p -48.34 -47.32 37.12 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.429 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.9 OUTLIER -71.3 -46.39 60.87 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 118.799 0.727 . . . . 0.0 110.457 -179.502 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.56 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.8 OUTLIER -66.37 -34.91 79.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.654 -179.82 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.924 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -60.77 -57.05 14.33 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.287 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.498 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -52.75 -42.0 64.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.651 0.262 . . . . 0.0 111.656 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . 0.497 ' O ' ' HD3' ' B' ' 138' ' ' ARG . 1.7 m-20 -62.29 -55.31 29.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.679 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.64 -8.96 58.01 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.634 178.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.527 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -82.32 -42.55 18.62 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -74.56 -51.99 13.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.398 177.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' B' ' 138' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.443 -0.804 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.568 -178.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.67 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.32 0 CA-C-O 120.872 0.368 . . . . 0.0 110.473 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.479 ' O ' HG23 ' B' ' 109' ' ' VAL . 33.1 tp60 -120.35 111.52 17.86 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.283 0.564 . . . . 0.0 111.294 -179.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.841 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.4 112.61 16.81 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.049 -179.557 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.736 HG22 ' CD1' ' B' ' 114' ' ' TYR . 0.6 OUTLIER -114.0 129.3 70.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.486 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.763 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.0 OUTLIER -133.01 135.59 45.54 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 117.886 -1.526 . . . . 0.0 113.768 -179.029 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.743 HG23 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.75 95.61 4.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.351 177.052 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 14.5 p -70.62 69.24 0.41 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.694 HG11 ' HB2' ' A' ' 14' ' ' TYR . 10.3 p -92.28 -133.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.835 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.648 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 25.6 t70 97.81 13.34 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.309 1.052 . . . . 0.0 109.348 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.0 t -145.25 -51.75 0.26 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 113.875 -1.511 . . . . 0.0 111.473 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.744 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.2 m-20 -72.82 41.41 0.1 Allowed 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 115.003 1.482 . . . . 0.0 115.003 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.2 OUTLIER 80.89 4.95 1.54 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 176.464 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.807 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 3.5 t80 -58.16 -59.58 5.07 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.525 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 11.7 mt-30 -49.73 -40.05 39.37 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.65 -33.33 9.76 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.548 ' CD1' ' SD ' ' B' ' 132' ' ' MET . 0.7 OUTLIER -78.25 -57.24 3.88 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.187 -0.605 . . . . 0.0 111.921 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.543 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -63.29 -25.18 68.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.718 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.94 -30.63 61.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.987 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.584 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 11.3 m-30 -88.34 -38.64 14.98 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 37.6 t70 133.19 43.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 O-C-N 124.336 1.022 . . . . 0.0 109.578 178.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.54 ' CG1' HD21 ' A' ' 17' ' ' LEU . 6.1 p -160.89 78.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.932 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.703 -177.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.489 ' O ' ' HE3' ' B' ' 132' ' ' MET . 0.0 OUTLIER -64.1 -86.9 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.487 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.765 HG13 ' HE2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -166.9 9.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 115.791 1.775 . . . . 0.0 115.791 178.966 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.442 ' C ' ' O ' ' A' ' 24' ' ' ILE . 29.0 t -38.36 -65.2 0.36 Allowed 'General case' 0 C--O 1.242 0.704 0 C-N-CA 120.211 -0.596 . . . . 0.0 110.551 -177.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.489 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -90.25 -24.91 27.8 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.584 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.557 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 0.7 OUTLIER -60.6 -56.94 15.26 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.105 -0.056 . . . . 0.0 111.008 179.317 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.723 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.0 t -57.21 -61.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.717 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 57.5 p -50.63 -41.92 55.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -75.21 -50.19 16.99 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.685 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.462 ' N ' ' CG2' ' A' ' 30' ' ' THR . 17.2 m -53.15 -43.76 67.25 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.804 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 11.7 mtt -52.59 -52.7 54.0 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.499 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -55.53 -37.38 67.86 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.828 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -48.46 40.23 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -68.41 -27.35 66.13 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.259 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.583 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -83.1 -46.27 12.98 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.746 0.818 . . . . 0.0 110.73 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.472 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -51.98 -51.64 55.84 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 121.819 0.819 . . . . 0.0 109.482 178.423 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.187 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.14 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 111.051 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.648 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 3.8 tm0? -95.62 123.2 39.06 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.541 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 14.3 ttm-85 -77.14 101.81 6.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.713 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.782 ' CG1' ' CE1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -93.34 107.64 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.392 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 177.354 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.789 HG21 ' HG2' ' A' ' 4' ' ' ARG . 1.2 m -118.18 110.91 18.16 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.317 0.579 . . . . 0.0 112.328 -175.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.52 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -102.13 106.3 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.987 177.138 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.841 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 4.7 p -70.92 88.36 0.75 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.844 0.354 . . . . 0.0 110.1 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.678 HG21 ' CD2' ' B' ' 114' ' ' TYR . 10.9 m -80.34 -142.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.488 -178.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.67 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER 86.28 -15.75 0.46 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -176.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.4 m -112.23 -68.93 0.9 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.944 -1.026 . . . . 0.0 108.691 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.717 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 2.2 m-20 -43.71 -93.24 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -178.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.505 ' HB3' ' O ' ' A' ' 29' ' ' SER . 1.8 t -177.98 47.71 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 121.567 0.699 . . . . 0.0 111.257 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.804 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -82.79 -45.51 14.24 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.082 -179.493 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.541 ' O ' ' N ' ' B' ' 119' ' ' ALA . 0.1 OUTLIER -48.59 -42.48 34.02 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.568 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.56 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -51.81 -47.37 64.33 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 119.305 0.957 . . . . 0.0 112.073 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.725 HD23 ' HA ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -59.72 -51.8 68.22 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.313 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.591 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -74.13 -28.6 61.41 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.618 179.773 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -60.31 -28.2 67.93 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.33 178.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.583 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.44 -44.64 10.58 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.235 -0.888 . . . . 0.0 109.602 178.18 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.583 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.58 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 176.631 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.461 ' O ' HD13 ' B' ' 117' ' ' LEU . 38.8 t -146.64 94.71 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.591 ' O ' HD13 ' B' ' 124' ' ' ILE . 28.9 m-20 -71.43 57.12 0.25 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.86 178.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.732 HG12 ' HE2' ' A' ' 32' ' ' MET . 0.6 OUTLIER 43.06 0.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 -179.483 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.743 ' HA ' HG23 ' A' ' 7' ' ' VAL . 14.9 p -38.66 -64.52 0.43 Allowed 'General case' 0 C--O 1.246 0.902 0 CA-C-N 119.144 0.884 . . . . 0.0 110.516 -178.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.603 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.9 -15.12 68.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.229 177.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.678 ' CD1' ' HG ' ' B' ' 117' ' ' LEU . 4.8 tt -72.63 -62.04 1.59 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 117.318 0.559 . . . . 0.0 110.348 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.686 HG23 HG21 ' A' ' 28' ' ' VAL . 75.1 t -44.78 -63.86 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.379 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.744 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 53.6 p -53.09 -51.45 61.82 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.603 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -67.55 -47.06 70.93 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 118.746 0.703 . . . . 0.0 110.103 -178.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.9 OUTLIER -53.22 -37.61 62.2 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.812 179.597 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.807 ' HG3' ' HA ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -49.83 -49.17 50.0 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.774 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -43.66 98.35 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -67.06 -51.51 53.73 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.53 ' HG2' ' CD1' ' A' ' 27' ' ' LEU . 4.7 tp10 -58.73 -36.18 73.9 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.888 178.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -71.25 -42.42 68.86 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 121.026 0.441 . . . . 0.0 110.077 178.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.454 ' HD2' ' HA ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -61.42 -52.6 63.89 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.617 0.723 . . . . 0.0 110.139 178.244 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.404 ' HD2' ' HA ' ' B' ' 138' ' ' ARG . 1.0 OUTLIER . . . . . 0 N--CA 1.439 -1.017 0 CA-C-N 114.228 -1.351 . . . . 0.0 113.865 -176.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.457 ' O ' ' N ' ' B' ' 109' ' ' VAL . 10.1 tp60 -105.63 111.57 24.32 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.465 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.838 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 1.3 ttm105 -79.3 105.93 10.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.754 HG23 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -112.59 122.32 66.56 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.754 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -125.41 129.67 50.34 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.921 -177.098 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.512 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.4 OUTLIER -100.36 107.07 20.32 Favored 'Isoleucine or valine' 0 C--N 1.343 0.295 0 N-CA-C 106.973 -1.492 . . . . 0.0 106.973 176.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.429 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 16.6 p -70.57 95.64 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.189 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.648 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 1.5 t -89.51 -143.55 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.21 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.508 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 33.7 t70 95.94 -10.14 0.09 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.5 t -126.0 -58.78 1.37 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 114.77 -1.105 . . . . 0.0 109.378 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.64 ' CB ' ' CB ' ' B' ' 129' ' ' SER . 0.9 OUTLIER -47.6 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.51 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 m -177.54 38.48 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.248 -0.908 . . . . 0.0 110.933 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.889 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -80.56 -39.17 28.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.346 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.551 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.78 -43.25 48.21 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.364 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.44 ' HB3' ' HB3' ' B' ' 136' ' ' ALA . 1.6 mt -48.33 -32.24 7.17 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.87 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -78.16 -60.09 2.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.092 179.028 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -61.79 -25.79 67.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.982 178.707 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.81 -30.85 71.79 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.75 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.63 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.2 OUTLIER -88.6 -35.47 16.84 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.772 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.63 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 27.7 t70 142.99 31.2 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 123.724 0.64 . . . . 0.0 112.211 176.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.599 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.0 t -160.95 100.85 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.531 ' HB3' HD11 ' A' ' 24' ' ' ILE . 70.1 m-20 -55.78 -89.75 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 178.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.749 ' CG2' ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -157.01 6.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.624 ' HA ' HG23 ' B' ' 107' ' ' VAL . 1.7 t -38.92 -64.44 0.45 Allowed 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.201 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.35 -23.36 51.5 Favored Glycine 0 C--N 1.335 0.496 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.02 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.749 ' HB3' ' CG2' ' A' ' 24' ' ' ILE . 0.1 OUTLIER -65.65 -57.9 7.01 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 122.621 0.369 . . . . 0.0 111.2 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.756 ' CG1' ' SD ' ' A' ' 32' ' ' MET . 3.8 t -51.55 -63.29 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.547 0.689 . . . . 0.0 109.21 178.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.703 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -50.16 -46.91 54.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.836 -1.075 . . . . 0.0 113.382 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.6 m -69.61 -50.27 46.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 121.311 0.577 . . . . 0.0 109.502 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.494 ' OG1' HG23 ' B' ' 131' ' ' THR . 1.8 m -55.16 -39.27 69.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.408 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.905 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -60.58 -57.28 13.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.429 179.006 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.408 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -53.7 -40.43 66.0 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.25 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.408 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 80.4 m-20 -70.69 -48.91 52.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.34 179.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.53 ' CB ' HD21 ' B' ' 117' ' ' LEU . 3.5 mm-40 -68.67 -24.92 64.57 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.27 178.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.26 -47.23 58.33 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -65.56 -54.79 22.97 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.49 0.662 . . . . 0.0 109.929 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.526 0 CA-C-N 114.438 -1.256 . . . . 0.0 110.928 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.598 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 1.3 tt0 -96.43 111.92 23.85 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.099 0.475 . . . . 0.0 111.747 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.431 HH11 ' HB2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -77.93 102.39 7.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.76 . . . . 0.0 112.198 -178.625 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.786 HG23 ' CD2' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -104.92 117.44 50.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 177.114 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.754 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -120.81 123.25 42.14 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -175.364 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.624 HG23 ' HA ' ' A' ' 25' ' ' SER . 0.9 OUTLIER -100.26 103.32 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.111 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.838 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.6 p -71.65 91.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.766 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -93.33 -139.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 118.028 -0.987 . . . . 0.0 111.332 -178.143 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.629 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 28.4 t70 119.86 5.1 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.003 0.921 . . . . 0.0 109.49 -177.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -175.15 -26.87 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.703 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.2 OUTLIER -70.77 41.57 0.06 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -176.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.613 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.8 m 62.57 -0.32 0.55 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.905 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -57.55 -52.04 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 179.856 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.429 ' O ' ' CB ' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.98 -36.83 18.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.505 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.428 ' HB3' ' HB2' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.05 -56.49 21.32 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -179.661 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.696 ' HB2' ' CG ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -48.26 -51.64 24.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.334 0.588 . . . . 0.0 111.603 -178.583 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.556 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.9 pttt -76.73 -26.68 54.88 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.891 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.429 ' CB ' ' O ' ' B' ' 115' ' ' GLN . . . -63.55 -25.63 68.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.856 178.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' B' ' 121' ' ' ASP . 0.2 OUTLIER -87.96 -42.38 12.51 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 118.524 -0.751 . . . . 0.0 109.8 178.698 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.541 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 158.41 37.04 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 177.264 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.57 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 0.8 OUTLIER -163.21 92.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.109 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.548 ' O ' HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -70.71 61.89 0.25 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.176 0.512 . . . . 0.0 110.531 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.805 ' CG2' ' HE3' ' A' ' 32' ' ' MET . 0.6 OUTLIER 39.37 -8.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 119.162 3.023 . . . . 0.0 119.162 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.479 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.61 -62.59 0.59 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.675 1.125 . . . . 0.0 110.944 -178.233 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.37 -30.15 25.62 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.44 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.56 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -60.87 -61.44 2.58 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 122.631 0.372 . . . . 0.0 111.447 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 28' ' ' VAL . 2.2 t -55.18 -58.02 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-O 120.636 0.255 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.64 ' CB ' ' CB ' ' A' ' 12' ' ' ASP . 12.0 p -50.29 -41.56 50.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.187 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.8 m -74.38 -52.87 10.87 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.494 HG23 ' OG1' ' A' ' 31' ' ' THR . 0.6 OUTLIER -51.93 -44.18 63.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.174 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.889 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 25.9 mtt -49.29 -40.77 35.99 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.872 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -43.92 94.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.757 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -49.76 67.56 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.545 ' HG2' HD13 ' A' ' 17' ' ' LEU . 2.6 tp10 -60.71 -37.49 81.86 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.44 ' HB3' ' HB3' ' A' ' 16' ' ' LEU . . . -67.41 -49.94 61.62 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.904 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.65 -48.22 63.46 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 121.965 0.888 . . . . 0.0 109.187 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? . . . . . 0 CA--C 1.541 0.618 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.753 -179.291 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.342 0 CA-C-O 120.996 0.426 . . . . 0.0 111.207 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.59 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 2.0 tt0 -101.39 109.02 20.79 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.868 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.2 ttm105 -78.5 103.84 8.71 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.655 HG23 ' CD1' ' B' ' 114' ' ' TYR . 1.7 pt -97.41 126.98 50.13 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.643 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -131.73 123.95 28.76 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.08 -1.048 . . . . 0.0 113.561 -177.139 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.507 HG23 ' HA ' ' B' ' 125' ' ' SER . 0.1 OUTLIER -101.28 106.22 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 175.772 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.496 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 37.5 p -70.86 98.18 1.53 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.655 ' CG2' ' HB3' ' A' ' 14' ' ' TYR . 2.4 t -87.9 -137.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.737 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 24.6 t70 99.27 -9.82 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.901 0.881 . . . . 0.0 108.836 -176.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.2 m -136.98 -55.71 0.72 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.515 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.7 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.68 -92.33 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.462 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 m 176.44 36.76 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 118.866 0.757 . . . . 0.0 111.219 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.904 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -83.77 -43.99 14.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.174 -0.921 . . . . 0.0 113.162 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.562 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -49.1 -44.06 41.9 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.824 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HA ' ' HB1' ' A' ' 19' ' ' ALA . 0.5 OUTLIER -54.04 -56.26 19.64 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.501 0.591 . . . . 0.0 112.265 179.821 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.592 ' HG ' ' HG2' ' B' ' 132' ' ' MET . 0.3 OUTLIER -46.17 -51.22 14.55 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.567 0.699 . . . . 0.0 111.302 -178.207 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.562 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 17.6 pttt -79.05 -29.27 43.42 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.505 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -61.45 -23.52 65.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.491 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.647 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -87.97 -44.4 11.04 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 118.255 -0.879 . . . . 0.0 109.746 178.302 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.647 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 163.13 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 177.944 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.557 ' CG1' ' O ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -169.59 106.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -178.816 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.492 ' O ' ' CD1' ' A' ' 24' ' ' ILE . 9.2 m-20 -66.68 55.85 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.672 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.721 HG12 ' CE ' ' B' ' 132' ' ' MET . 1.6 pp 36.24 1.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.464 ' N ' ' O ' ' A' ' 23' ' ' ASN . 7.0 p -37.74 -63.59 0.45 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.913 0.779 . . . . 0.0 112.372 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.446 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -75.34 -20.3 78.93 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.259 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 2.2 tm? -72.93 -58.55 3.24 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 122.597 0.359 . . . . 0.0 110.934 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.608 HG12 ' SD ' ' A' ' 32' ' ' MET . 59.7 t -45.43 -69.99 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.728 0.299 . . . . 0.0 110.973 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.533 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 45.6 p -49.43 -34.11 15.73 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.026 0.53 . . . . 0.0 112.099 178.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.5 m -69.74 -53.93 16.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 m -52.0 -43.39 63.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.182 178.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.787 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -55.75 -48.59 74.99 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.906 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.522 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -60.06 -42.78 95.28 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.355 0.525 . . . . 0.0 110.608 179.638 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.522 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 83.0 m-20 -67.33 -49.58 63.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.684 ' HB3' HD21 ' B' ' 117' ' ' LEU . 17.3 tp10 -65.04 -29.15 70.03 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.341 177.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.576 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -68.16 -45.48 73.41 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -54.27 36.27 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.248 177.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.54 0.581 0 CA-C-N 114.503 -1.226 . . . . 0.0 113.284 -177.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.737 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 120.69 0.281 . . . . 0.0 111.09 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.668 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 1.1 tt0 -109.84 116.73 32.19 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.072 0.463 . . . . 0.0 111.671 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.608 ' CZ ' HG21 ' B' ' 106' ' ' THR . 2.6 ttp85 -78.08 106.5 10.0 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.665 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -103.88 130.08 55.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.81 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.643 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -131.06 126.12 35.0 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.795 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.461 HG12 HD12 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -101.86 102.94 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.319 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.868 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -70.76 67.24 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 122.131 -0.356 . . . . 0.0 111.398 -179.472 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.643 ' O ' ' HB2' ' B' ' 110' ' ' ASP . 3.7 m -99.31 -124.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.643 ' HB2' ' O ' ' B' ' 109' ' ' VAL . 10.4 t0 157.02 -83.13 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 111' ' ' SER . . . . . 0.547 ' HA ' ' CD ' ' B' ' 115' ' ' GLN . 3.8 t -102.63 12.56 36.18 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.638 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.533 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.8 t0 -75.56 59.28 1.11 Allowed 'General case' 0 C--N 1.36 1.059 0 CA-C-N 120.191 1.359 . . . . 0.0 108.304 178.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.448 ' HB2' ' O ' ' A' ' 29' ' ' SER . 13.3 m 64.11 -20.55 0.07 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.177 -177.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.787 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -46.61 -60.33 2.45 Favored 'General case' 0 C--N 1.351 0.674 0 CA-C-O 121.383 0.611 . . . . 0.0 110.326 179.305 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.621 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.8 pt20 -49.53 -40.39 37.77 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.766 -1.107 . . . . 0.0 112.643 -177.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.434 ' HA ' ' HB2' ' B' ' 119' ' ' ALA . 0.3 OUTLIER -55.55 -42.09 74.16 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.684 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.5 OUTLIER -59.03 -52.4 65.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.633 179.753 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.696 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.5 pttt -73.38 -30.45 63.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.209 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.48 -29.21 67.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.198 178.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -87.7 -41.64 13.21 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.475 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.519 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 155.1 24.01 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 176.786 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.477 ' CG2' ' O ' ' B' ' 121' ' ' ASP . 71.0 t -162.38 101.58 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.609 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 33.4 m-80 -53.14 -84.62 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.771 ' CG2' ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -161.89 3.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 178.308 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.507 ' HA ' HG23 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -38.54 -63.5 0.5 Allowed 'General case' 0 C--O 1.241 0.658 0 CA-C-N 118.249 0.477 . . . . 0.0 110.691 -177.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -88.14 -29.91 18.61 Favored Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.234 178.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.593 HD12 ' HG ' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -58.6 -60.4 3.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.854 0.462 . . . . 0.0 111.127 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.765 HG13 ' SD ' ' B' ' 132' ' ' MET . 1.3 t -55.16 -61.54 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.963 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.7 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.6 p -50.71 -42.17 56.8 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 178.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 16.5 m -67.82 -55.17 14.0 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.518 HG21 ' O ' ' B' ' 128' ' ' VAL . 1.8 t -53.55 -42.63 67.68 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.242 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.904 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 4.3 mtt -58.18 -54.93 41.38 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.587 178.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.17 -37.46 22.48 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.944 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -52.62 13.15 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -69.45 -15.3 63.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.928 0.394 . . . . 0.0 110.343 178.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.625 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.96 -50.18 9.43 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.263 0.625 . . . . 0.0 109.512 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -54.33 29.59 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.718 0.77 . . . . 0.0 109.595 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 . . . . . 0 N--CA 1.441 -0.905 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.916 -178.99 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.675 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 46.1 tt0 -116.22 118.76 33.68 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.301 0.572 . . . . 0.0 110.601 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.781 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.18 105.9 10.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.206 -178.503 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.717 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -104.06 109.86 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.093 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.126 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.632 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -115.14 121.91 44.46 Favored 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.146 -176.587 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.582 HG13 ' CD1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.23 106.45 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 176.723 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.526 ' HB ' ' HB3' ' B' ' 102' ' ' LYS . 18.1 p -70.06 81.01 0.49 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.022 0.439 . . . . 0.0 110.601 -178.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.769 HG13 ' CB ' ' A' ' 14' ' ' TYR . 14.8 m -73.69 -141.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.627 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.626 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 27.4 t70 88.88 -12.45 0.41 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -124.53 -58.93 1.49 Allowed 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.63 ' HB2' ' OG ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.96 -98.59 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.5 OUTLIER -176.12 41.32 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.212 -0.93 . . . . 0.0 111.82 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.77 ' CD2' HG23 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -81.97 -41.49 20.71 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.94 0.896 . . . . 0.0 113.169 -179.474 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.517 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 1.8 mp0 -49.47 -46.59 48.25 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.52 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -50.02 -30.77 11.36 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.419 0.554 . . . . 0.0 111.917 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.666 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -78.14 -55.14 5.51 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.54 178.614 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.671 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -69.06 -25.54 64.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.335 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.54 -33.17 59.59 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.064 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.624 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 20.0 m-85 -88.87 -45.99 9.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.905 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.624 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 143.1 46.37 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 O-C-N 124.413 1.071 . . . . 0.0 110.824 178.85 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.429 ' HB ' HD23 ' A' ' 17' ' ' LEU . 7.5 t -128.24 73.45 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.333 -178.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.561 ' O ' HD11 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -76.14 45.35 0.36 Allowed 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.713 ' CG1' ' HE1' ' B' ' 132' ' ' MET . 0.6 OUTLIER 39.91 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 118.316 2.71 . . . . 0.0 118.316 177.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.675 ' HA ' HG21 ' B' ' 107' ' ' VAL . 3.1 p -39.35 -64.9 0.43 Allowed 'General case' 0 C--O 1.253 1.256 0 CA-C-N 119.272 0.942 . . . . 0.0 110.667 -177.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.416 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -80.53 -26.63 53.88 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.929 -0.653 . . . . 0.0 111.984 177.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.609 HD22 ' CD1' ' A' ' 17' ' ' LEU . 6.6 tp -66.2 -61.34 2.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.01 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.616 HG21 ' HB ' ' A' ' 24' ' ' ILE . 6.5 t -44.23 -66.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.476 ' HB3' ' O ' ' B' ' 112' ' ' ASP . 0.7 OUTLIER -50.03 -37.44 33.06 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 178.424 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.5 m -71.92 -58.5 3.4 Favored 'General case' 0 CA--C 1.507 -0.691 0 O-C-N 121.81 -0.556 . . . . 0.0 109.916 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.448 ' OG1' HG21 ' B' ' 131' ' ' THR . 1.0 OUTLIER -54.47 -31.61 56.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.586 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.959 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.7 mmt -56.32 -57.26 13.02 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.083 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.562 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 2.6 tt0 -50.12 -34.16 21.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -72.33 -48.99 37.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.79 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.442 ' HB2' HD13 ' B' ' 117' ' ' LEU . 3.5 mm-40 -79.63 -15.25 57.97 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.754 0.312 . . . . 0.0 110.311 177.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.579 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -88.06 -29.96 20.27 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.159 0.584 . . . . 0.0 110.418 178.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -75.73 -55.41 5.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.582 0.706 . . . . 0.0 110.299 179.625 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 . . . . . 0 N--CA 1.442 -0.839 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.04 -178.527 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.526 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.541 ' HB3' HG21 ' A' ' 9' ' ' VAL . 28.8 tp60 -98.72 116.52 31.14 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.242 0.544 . . . . 0.0 111.048 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.44 ' HG3' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER -78.55 99.9 6.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.483 -178.399 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.77 HG23 ' CD2' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -103.05 118.51 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.067 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -122.33 129.4 52.11 Favored 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.871 -176.916 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.675 HG21 ' HA ' ' A' ' 25' ' ' SER . 0.9 OUTLIER -99.04 96.06 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.868 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.781 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 46.6 p -70.01 67.65 0.29 Allowed 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.694 HG12 ' CD2' ' B' ' 114' ' ' TYR . 6.7 p -80.56 -117.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.264 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.675 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 35.6 t70 85.47 1.29 0.7 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -174.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.45 -67.02 0.88 Allowed 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.269 178.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -133.78 142.3 47.85 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -176.512 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.602 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 46.48 -23.79 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 118.824 2.898 . . . . 0.0 118.824 174.89 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.896 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.6 OUTLIER -52.13 -61.99 1.92 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 120.079 1.309 . . . . 0.0 111.6 -178.314 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.615 ' HA ' ' HE3' ' B' ' 118' ' ' LYS . 77.6 mt-30 -49.56 -37.62 28.02 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.113 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.451 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.49 -57.16 14.17 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.872 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.959 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -49.5 -45.67 47.37 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.187 0.518 . . . . 0.0 111.674 -178.176 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.639 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.4 pttp -80.26 -36.83 34.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.249 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.568 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -68.29 -23.88 64.8 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.914 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.522 ' C ' ' CD1' ' B' ' 120' ' ' TYR . 0.1 OUTLIER -87.76 -42.71 12.41 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.04 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.45 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 163.34 17.91 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.522 ' C ' ' H ' ' B' ' 124' ' ' ILE . 72.4 t -146.98 85.28 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.349 0 O-C-N 121.581 -0.699 . . . . 0.0 112.709 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.639 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 0.4 OUTLIER -69.11 50.21 0.08 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.557 0.694 . . . . 0.0 109.977 178.515 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.751 ' CG2' ' HE2' ' A' ' 32' ' ' MET . 1.6 pp 33.28 0.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 120.103 3.372 . . . . 0.0 120.103 179.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.531 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.27 -62.47 0.58 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 118.525 0.602 . . . . 0.0 110.791 -178.944 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.403 ' N ' ' OG ' ' B' ' 125' ' ' SER . . . -80.66 -27.08 52.34 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.695 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 1.9 tm? -67.04 -61.49 1.91 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.929 0.365 . . . . 0.0 110.978 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.673 HG21 ' HB ' ' B' ' 124' ' ' ILE . 12.3 t -48.63 -68.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.249 0 C-N-CA 121.139 -0.224 . . . . 0.0 111.386 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.63 ' OG ' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -49.86 -31.27 11.65 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.0 m -71.65 -54.67 9.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.448 HG21 ' OG1' ' A' ' 31' ' ' THR . 7.2 m -53.9 -36.47 62.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.183 178.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.713 ' HE1' ' CG1' ' A' ' 24' ' ' ILE . 5.3 mmm -53.15 -57.05 11.77 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.12 178.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.509 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -58.53 -36.01 73.2 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.109 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . 0.493 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.67 -48.42 22.12 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.087 -179.249 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.48 -19.25 60.45 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.692 177.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.52 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -72.37 -47.72 47.29 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 177.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.521 ' HA ' ' NE ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -65.84 -56.4 12.07 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-O 121.444 0.64 . . . . 0.0 109.912 178.22 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 . . . . . 0 N--CA 1.444 -0.766 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.32 -179.095 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.614 ' HE3' ' HA ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.584 0.706 . . . . 0.0 111.517 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.62 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 43.4 tp60 -117.69 109.15 16.28 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.373 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.806 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 17.8 ttp-105 -79.31 111.58 15.69 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.819 179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.664 HG22 ' CD1' ' B' ' 114' ' ' TYR . 3.3 pt -102.34 127.8 55.61 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.737 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -131.71 124.73 30.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -177.791 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.506 HG13 ' HB ' ' B' ' 128' ' ' VAL . 0.2 OUTLIER -99.43 105.56 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.206 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 14.5 p -70.19 89.72 0.65 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 178.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.661 HG12 ' CB ' ' A' ' 14' ' ' TYR . 3.8 p -108.36 -119.89 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.814 -177.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.664 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 0.8 OUTLIER 77.41 10.25 2.41 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-O 122.491 1.138 . . . . 0.0 109.089 -174.747 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.443 ' OG ' ' NZ ' ' B' ' 102' ' ' LYS . 0.5 OUTLIER -128.46 -66.83 0.82 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.507 178.59 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.813 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 1.1 m-20 -51.74 -79.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -177.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.712 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 1.0 OUTLIER 177.28 40.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.39 0.995 . . . . 0.0 111.683 -178.513 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.661 ' CB ' HG12 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.67 -49.84 9.38 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.333 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.56 ' CD ' ' HA ' ' A' ' 10' ' ' ASP . 1.1 mp0 -49.33 -37.69 25.31 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.632 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.7 OUTLIER -56.61 -56.73 17.63 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.598 0.636 . . . . 0.0 111.687 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.747 ' HB2' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.48 -48.11 56.91 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.108 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.551 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 1.9 pttt -80.28 -35.59 35.65 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.475 -178.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.538 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -70.39 -22.64 62.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.256 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.532 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -87.83 -41.54 13.18 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.855 179.269 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.499 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 168.52 -7.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 177.382 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.652 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 72.2 t -122.08 85.95 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -177.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.58 ' O ' HD11 ' A' ' 24' ' ' ILE . 11.2 p30 -65.08 48.41 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.701 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.736 HG12 ' HE2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 48.08 -15.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 117.203 2.298 . . . . 0.0 117.203 -179.546 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 23' ' ' ASN . 30.4 t -38.28 -62.84 0.54 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 119.137 0.88 . . . . 0.0 109.509 -178.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.424 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.28 -27.21 40.78 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.245 177.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.593 ' HB3' HG21 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -60.02 -62.24 2.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.972 0.386 . . . . 0.0 110.703 179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.699 ' O ' ' HG2' ' A' ' 32' ' ' MET . 12.4 t -51.43 -66.38 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.775 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.555 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 15.5 p -47.2 -40.84 16.97 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.44 ' HA ' ' OE1' ' A' ' 33' ' ' GLN . 0.5 OUTLIER -78.1 -47.82 17.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.558 1.072 . . . . 0.0 109.304 178.321 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.419 HG21 HG21 ' B' ' 131' ' ' THR . 9.0 m -53.24 -47.37 69.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.729 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 6.2 mmt -55.05 -46.83 75.4 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.656 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.508 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -57.3 -49.1 77.17 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.936 0.398 . . . . 0.0 110.336 178.445 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.478 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.64 -50.49 69.11 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.487 ' HG3' HD11 ' B' ' 127' ' ' LEU . 2.9 mm-40 -72.13 -8.59 55.53 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.808 178.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.589 ' HA ' ' HE2' ' B' ' 120' ' ' TYR . . . -88.39 -44.1 11.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 122.667 0.387 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -57.36 4.39 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.546 0.689 . . . . 0.0 110.004 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 . . . . . 0 N--CA 1.442 -0.873 0 CA-C-N 114.55 -1.204 . . . . 0.0 113.352 -178.204 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.443 ' NZ ' ' OG ' ' A' ' 11' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.668 0.271 . . . . 0.0 110.651 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.664 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 1.6 tp60 -114.2 121.77 44.75 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.146 0.498 . . . . 0.0 110.22 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.528 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 0.3 OUTLIER -78.83 112.39 15.93 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.071 -179.454 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.661 HG22 ' CD2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -113.7 114.04 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.737 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -117.57 129.01 55.51 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.482 ' O ' HG23 ' B' ' 107' ' ' VAL . 0.5 OUTLIER -102.37 102.59 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 174.667 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.806 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -71.22 67.29 0.45 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.371 -0.531 . . . . 0.0 111.223 -179.18 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.499 ' CG1' ' HB2' ' B' ' 112' ' ' ASP . 4.7 m -96.14 -127.64 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.736 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.62 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 1.4 t70 154.12 -89.18 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 111' ' ' SER . . . . . 0.619 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 39.0 t -94.19 9.47 37.8 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 118.685 -0.674 . . . . 0.0 111.521 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.555 ' O ' ' HA ' ' A' ' 29' ' ' SER . 2.3 m-20 -74.64 56.2 0.69 Allowed 'General case' 0 C--N 1.365 1.277 0 CA-C-N 119.943 1.247 . . . . 0.0 109.271 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.508 ' OG ' ' HB2' ' A' ' 33' ' ' GLN . 0.9 OUTLIER 62.07 -14.78 0.05 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.983 -178.774 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.805 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.2 OUTLIER -53.87 -54.67 35.32 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.117 0.484 . . . . 0.0 110.135 178.974 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.622 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.38 -41.11 27.9 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.168 -178.17 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.473 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 3.9 mt -52.46 -53.89 39.56 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.044 -0.41 . . . . 0.0 111.433 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.729 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -53.12 -41.1 64.71 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.764 0.792 . . . . 0.0 111.727 179.785 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.805 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.6 pttt -79.81 -25.74 40.75 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.51 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -59.24 -23.36 62.27 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.608 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 2.1 m-85 -88.35 -37.88 15.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.987 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.608 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.2 t70 117.98 75.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.629 1.205 . . . . 0.0 111.948 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.482 HG11 HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -166.8 -40.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.859 -179.306 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.476 ' HB3' HD11 ' B' ' 124' ' ' ILE . 58.7 m-80 65.59 -108.04 0.15 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 -177.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.666 HG13 ' HE3' ' A' ' 32' ' ' MET . 0.2 OUTLIER -153.06 2.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 178.576 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.445 ' C ' ' O ' ' B' ' 124' ' ' ILE . 81.8 p -39.04 -63.26 0.55 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . 0.403 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.27 -31.52 19.37 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.303 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.56 ' O ' ' HB ' ' B' ' 131' ' ' THR . 8.4 tp -56.97 -62.2 1.91 Allowed 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 117.3 0.55 . . . . 0.0 111.52 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.75 HG11 ' SD ' ' B' ' 132' ' ' MET . 1.5 t -53.48 -59.55 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.797 0.808 . . . . 0.0 109.079 178.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.813 ' HB3' ' CB ' ' A' ' 12' ' ' ASP . 3.5 m -48.29 -50.09 31.28 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.194 -1.366 . . . . 0.0 112.965 179.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 130' ' ' THR . . . . . 0.41 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.4 OUTLIER -83.57 -50.3 8.37 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 122.163 -0.336 . . . . 0.0 111.587 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.56 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.5 OUTLIER -55.62 -41.94 74.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -179.153 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.75 ' SD ' HG11 ' B' ' 128' ' ' VAL . 0.0 OUTLIER -60.73 -46.72 89.32 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.333 178.912 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.712 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.6 OUTLIER -49.26 -35.87 18.9 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.179 0.445 . . . . 0.0 110.526 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -70.71 -49.22 49.29 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.513 179.279 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.44 ' HB2' HD21 ' A' ' 17' ' ' LEU . 30.3 mm-40 -77.92 -13.67 59.8 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.964 0.411 . . . . 0.0 110.612 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.632 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -83.55 -34.64 25.18 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.371 0.669 . . . . 0.0 110.074 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.81 -50.89 8.18 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.985 0.898 . . . . 0.0 109.933 178.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . 0.467 ' HB2' ' O ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.685 0 CA-C-N 113.849 -1.523 . . . . 0.0 114.143 -177.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.07 0.462 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.557 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 2.0 tt0 -108.8 112.38 24.62 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.531 0.681 . . . . 0.0 111.535 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.794 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 8.3 ttm-85 -79.57 99.98 7.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.171 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.681 HG23 ' CD1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -101.87 130.3 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.969 0 N-CA-C 106.787 -1.561 . . . . 0.0 106.787 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.68 ' HB ' ' CG2' ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.09 134.23 50.28 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.344 -0.942 . . . . 0.0 112.765 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.615 ' O ' HG22 ' B' ' 105' ' ' ILE . 0.9 OUTLIER -99.53 81.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.493 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 69.7 p -68.89 71.3 0.22 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.162 -0.961 . . . . 0.0 110.85 -178.191 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.768 HG22 ' HB3' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -77.89 -102.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.729 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.712 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 27.3 t0 113.88 14.09 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.363 0.665 . . . . 0.0 110.719 -178.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 177.73 -23.09 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.624 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 2.4 m-20 -72.27 56.01 0.34 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 -176.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.515 ' O ' ' HB3' ' B' ' 132' ' ' MET . 61.6 m 57.91 0.91 0.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.821 ' CD1' HG21 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -68.02 -49.31 62.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.502 ' HG3' ' CD2' ' A' ' 14' ' ' TYR . 4.5 mt-30 -49.41 -36.94 23.66 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -176.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.438 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -63.16 -56.37 17.35 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.724 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -46.47 -47.17 19.27 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 112.169 -178.159 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 1.4 pttt -79.57 -29.67 41.36 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.818 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.46 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -74.82 -25.35 58.96 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.019 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.512 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -87.9 -38.13 15.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.234 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 158.28 12.97 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 177.255 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.424 ' CG1' HD11 ' A' ' 17' ' ' LEU . 75.8 t -134.34 79.91 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.584 -0.697 . . . . 0.0 111.716 -178.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.532 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.7 OUTLIER -66.66 52.92 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.945 0.403 . . . . 0.0 111.349 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.778 ' CG2' ' HE1' ' B' ' 132' ' ' MET . 0.5 OUTLIER 41.6 -8.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 118.375 2.731 . . . . 0.0 118.375 178.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.623 ' HA ' ' CG2' ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.73 -62.48 0.61 Allowed 'General case' 0 C--O 1.245 0.837 0 CA-C-N 120.13 1.332 . . . . 0.0 109.852 -178.464 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.85 -24.89 57.31 Favored Glycine 0 CA--C 1.522 0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.621 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.705 ' HB3' HG22 ' A' ' 24' ' ' ILE . 7.8 tp -67.49 -61.5 1.87 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 117.207 0.503 . . . . 0.0 111.471 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.627 ' O ' ' HG2' ' A' ' 32' ' ' MET . 33.5 t -45.0 -63.0 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.61 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.722 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 7.4 p -48.78 -47.32 41.97 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.988 1.315 . . . . 0.0 113.091 177.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.6 m -61.5 -51.26 69.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.407 ' OG1' HG23 ' B' ' 131' ' ' THR . 7.1 m -59.11 -41.84 89.12 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.27 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.849 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -52.64 -52.23 56.54 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.174 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.474 ' HB2' ' CB ' ' B' ' 113' ' ' SER . 2.3 tt0 -62.79 -51.71 66.01 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.269 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -56.28 -51.35 68.47 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.8 -29.07 69.5 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.204 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.544 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -70.48 -44.31 67.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.116 0.484 . . . . 0.0 110.257 178.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -56.28 7.19 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.38 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.789 0 CA-C-N 114.704 -1.134 . . . . 0.0 113.646 -176.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 102' ' ' LYS . . . . . 0.712 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 121.069 0.461 . . . . 0.0 110.351 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 103' ' ' GLN . . . . . 0.458 ' CG ' ' HE2' ' A' ' 14' ' ' TYR . 57.6 tp60 -121.95 117.5 26.57 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.938 0.875 . . . . 0.0 110.553 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 104' ' ' ARG . . . . . 0.673 ' NH1' HG22 ' A' ' 6' ' ' THR . 39.6 ttt85 -79.26 109.43 13.59 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.095 -1.412 . . . . 0.0 112.899 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 105' ' ' ILE . . . . . 0.821 HG21 ' CD1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -96.58 116.87 39.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.892 0 N-CA-C 103.739 -2.689 . . . . 0.0 103.739 174.4 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.68 ' CG2' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -118.52 112.18 19.57 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.593 -174.917 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 107' ' ' VAL . . . . . 0.657 HG13 ' CD1' ' A' ' 5' ' ' ILE . 1.0 OUTLIER -102.44 106.17 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.525 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 108' ' ' THR . . . . . 0.794 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 25.6 p -72.07 90.38 1.18 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . 0.706 ' HB ' ' HB3' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.68 -146.75 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 118.882 -0.58 . . . . 0.0 111.832 -178.38 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 110' ' ' ASP . . . . . 0.591 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 8.7 t70 105.13 5.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 24.6 t -150.23 -41.18 0.13 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 113.66 -1.609 . . . . 0.0 110.414 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 112' ' ' ASP . . . . . 0.722 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.3 OUTLIER -74.71 33.78 0.1 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.501 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.474 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.2 OUTLIER 72.21 3.86 4.82 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 177.383 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 114' ' ' TYR . . . . . 0.849 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 1.9 t80 -57.75 -55.63 32.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.203 0.456 . . . . 0.0 111.507 179.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 115' ' ' GLN . . . . . 0.546 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 15.2 mt-30 -49.68 -42.7 46.27 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -177.414 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 116' ' ' LEU . . . . . 0.544 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -49.19 -30.66 7.21 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.692 0.282 . . . . 0.0 111.726 179.774 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 117' ' ' LEU . . . . . 0.56 HD12 ' CD1' ' B' ' 127' ' ' LEU . 0.4 OUTLIER -78.56 -57.55 3.71 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.372 0.606 . . . . 0.0 111.574 178.314 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 118' ' ' LYS . . . . . 0.61 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -65.09 -25.48 67.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.995 -179.909 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 119' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.95 -27.98 47.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.079 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 120' ' ' TYR . . . . . 0.566 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.1 m-30 -88.21 -47.41 8.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.667 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.566 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 5.0 m-20 143.45 41.51 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.193 0.933 . . . . 0.0 110.52 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 122' ' ' VAL . . . . . 0.522 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 6.1 p -160.25 87.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-O 121.661 0.743 . . . . 0.0 111.592 -177.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 123' ' ' ASN . . . . . 0.624 ' O ' ' HE3' ' A' ' 32' ' ' MET . 1.2 m120 -63.22 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 124' ' ' ILE . . . . . 0.716 HG13 ' HE3' ' A' ' 32' ' ' MET . 0.1 OUTLIER -146.86 4.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 125' ' ' SER . . . . . 0.501 ' HA ' ' CG2' ' A' ' 7' ' ' VAL . 1.2 t -39.51 -64.63 0.46 Allowed 'General case' 0 C--O 1.244 0.814 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.011 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.94 -21.53 45.98 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . 0.622 HD11 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -64.43 -56.72 12.38 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 122.73 0.412 . . . . 0.0 110.911 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 128' ' ' VAL . . . . . 0.704 ' O ' ' HG2' ' B' ' 132' ' ' MET . 2.2 t -56.67 -60.99 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 129' ' ' SER . . . . . 0.624 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.2 p -47.15 -38.8 12.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.147 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 93.1 m -70.96 -48.58 52.59 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 131' ' ' THR . . . . . 0.407 HG23 ' OG1' ' A' ' 31' ' ' THR . 0.5 OUTLIER -66.62 -31.86 72.81 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.124 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 132' ' ' MET . . . . . 0.778 ' HE1' ' CG2' ' A' ' 24' ' ' ILE . 4.7 mmt -65.39 -57.04 9.33 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 133' ' ' GLN . . . . . 0.49 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -48.79 -37.13 18.28 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 -75.05 -41.41 59.14 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.997 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -84.25 -12.75 54.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.81 0.338 . . . . 0.0 110.832 177.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 136' ' ' ALA . . . . . 0.622 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -87.34 -29.61 21.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.42 0.688 . . . . 0.0 109.313 178.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 137' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 2.1 mmt180 -81.45 -48.25 12.13 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.763 0.792 . . . . 0.0 110.102 178.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 113.958 -1.474 . . . . 0.0 112.969 -177.688 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.1 ttp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 120.303 0.096 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.532 ' HD3' ' HB3' ' B' ' 110' ' ' ASP . 8.8 mmtm -78.46 179.89 6.76 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.739 -0.209 . . . . 0.0 110.84 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.458 ' O ' ' HA ' ' B' ' 108' ' ' THR . 7.5 tt0 -130.26 120.74 24.9 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.916 0.389 . . . . 0.0 111.795 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.817 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -81.95 116.99 21.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.75 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.5 OUTLIER -113.78 122.22 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.105 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.671 ' OG1' ' H73' ' C' ' 178' ' ' ' DT' . 0.5 OUTLIER -131.59 129.85 41.44 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.025 -1.07 . . . . 0.0 112.954 -177.888 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.605 ' CG2' ' HB ' ' A' ' 9' ' ' VAL . 0.2 OUTLIER -100.22 103.54 14.93 Favored 'Isoleucine or valine' 0 C--N 1.346 0.421 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 175.381 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.772 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.1 OUTLIER -69.77 67.17 0.25 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 122.009 0.909 . . . . 0.0 109.774 -178.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.616 ' CG2' ' HB2' ' A' ' 12' ' ' ASP . 9.4 p -106.09 -132.32 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.389 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.596 ' N ' HG13 ' A' ' 9' ' ' VAL . 3.2 t70 148.34 -87.16 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 70.7 m -74.65 -5.67 44.34 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.616 ' HB2' ' CG2' ' A' ' 9' ' ' VAL . 4.2 t0 -79.68 56.76 2.32 Favored 'General case' 0 C--N 1.353 0.727 0 CA-C-N 120.437 1.471 . . . . 0.0 109.936 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.467 ' O ' ' HB3' ' B' ' 132' ' ' MET . 13.2 m 65.25 -18.5 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.747 ' CD1' HG21 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -50.63 -56.03 13.71 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 118.347 0.521 . . . . 0.0 110.777 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.739 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -50.75 -43.84 58.36 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.641 -0.708 . . . . 0.0 112.763 -177.906 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.436 ' HA ' ' HB1' ' A' ' 19' ' ' ALA . 1.6 mt -54.43 -40.59 68.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.886 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.93 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.665 0.745 . . . . 0.0 110.634 179.782 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.739 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 13.9 pttt -69.06 -25.78 64.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.655 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.436 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -59.17 -22.04 60.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 178.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 15.1 m-30 -87.84 -54.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.668 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 12.4 p-10 163.92 35.15 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.764 0.665 . . . . 0.0 112.117 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.573 ' C ' ' H ' ' A' ' 24' ' ' ILE . 9.6 p -154.39 99.12 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.524 0.678 . . . . 0.0 112.622 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.655 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 16.0 m-20 -60.71 13.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.962 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.761 HG12 ' CE ' ' B' ' 132' ' ' MET . 1.7 pp 65.12 -5.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 N-CA-C 117.484 2.401 . . . . 0.0 117.484 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.742 ' HA ' ' HB ' ' B' ' 107' ' ' VAL . 9.8 p -38.49 -62.35 0.6 Allowed 'General case' 0 C--N 1.308 -1.233 0 O-C-N 123.243 0.339 . . . . 0.0 111.734 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.555 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -67.05 -38.72 92.74 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.663 -0.779 . . . . 0.0 113.059 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.554 HD21 ' CG2' ' A' ' 24' ' ' ILE . 3.5 tp -63.5 -61.44 2.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 117.208 0.504 . . . . 0.0 112.299 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.682 HG23 ' HB ' ' A' ' 24' ' ' ILE . 53.6 t -40.1 -73.4 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -178.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.733 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -57.71 -32.55 67.5 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.555 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.9 OUTLIER -66.54 -54.09 27.53 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 177.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.404 HG21 ' OG1' ' B' ' 131' ' ' THR . 9.4 m -51.78 -47.83 64.03 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.317 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.712 ' SD ' ' HA ' ' A' ' 29' ' ' SER . 5.3 mtt -49.07 -48.99 43.68 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.242 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.15 -36.33 18.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.446 0.566 . . . . 0.0 110.394 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -67.8 -51.42 48.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.467 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.493 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 2.4 tp10 -75.34 -17.23 60.29 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.625 0.25 . . . . 0.0 110.84 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.577 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -86.28 -25.74 25.33 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 123.193 0.597 . . . . 0.0 109.691 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.22 -47.83 12.0 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 121.858 0.837 . . . . 0.0 109.756 177.916 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.472 ' O ' ' C ' ' A' ' 39' ' ' LEU . 5.7 mtt85 -83.15 -36.06 25.06 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.414 -177.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER 12.29 82.15 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -177.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.61 -50.93 5.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.768 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 168.39 138.33 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.245 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -72.06 149.15 45.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.956 0.408 . . . . 0.0 110.99 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mmm180 -88.36 94.18 9.76 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.125 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -47.5 115.13 1.03 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.051 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -80.52 112.6 18.02 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.003 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.1 p -85.57 157.88 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.09 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.13 -170.89 1.9 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.973 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.75 47.62 0.44 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.043 0.449 . . . . 0.0 111.29 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -96.71 134.16 40.34 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.171 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.25 163.83 23.69 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.169 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -147.62 49.13 0.62 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.981 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.1 mtm -122.89 153.38 39.72 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.784 0.326 . . . . 0.0 111.316 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.4 p -159.0 157.12 3.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.304 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.79 -178.8 3.68 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.823 0.344 . . . . 0.0 111.481 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 84.0 t -132.42 -79.74 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-O 121.441 0.639 . . . . 0.0 111.529 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.429 ' O ' ' HD2' ' A' ' 57' ' ' ARG . . . 56.67 94.97 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.961 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.429 ' HD2' ' O ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -140.74 150.32 43.26 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.551 179.891 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.514 ' N ' ' CD1' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -170.46 97.15 0.25 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.153 0.501 . . . . 0.0 111.519 -179.698 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -92.89 -130.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.947 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.41 173.27 15.87 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.823 0.283 . . . . 0.0 111.308 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.67 100.41 2.97 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.006 0.432 . . . . 0.0 111.291 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -111.74 148.45 33.46 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.39 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.41 171.07 23.89 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.84 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 53.3 p -112.08 -175.5 2.7 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.784 0.326 . . . . 0.0 111.196 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -134.02 169.92 16.42 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.147 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -136.7 152.79 50.78 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.418 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.08 -76.25 0.51 Allowed 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.961 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 65.43 -176.02 0.18 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.806 0.336 . . . . 0.0 111.751 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -178.19 -99.11 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.024 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.72 -33.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.8 80.37 0.23 Allowed 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.46 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.071 -0.966 . . . . 0.0 111.086 -179.393 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.758 0 N-CA-C 110.877 -0.046 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.37 112.35 24.05 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 110.242 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.521 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 52.9 tp60 -105.58 113.32 26.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.772 0.796 . . . . 0.0 110.31 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.686 ' HB3' ' NH1' ' B' ' 104' ' ' ARG . 7.9 ttp-105 -79.31 103.55 9.31 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.712 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.747 HG21 ' CD1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.66 129.03 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.342 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.608 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -128.61 115.6 18.32 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.859 -177.868 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.742 ' HB ' ' HA ' ' A' ' 25' ' ' SER . 0.1 OUTLIER -101.14 98.72 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.701 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.817 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 41.6 p -68.13 84.3 0.24 Allowed 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.731 HG22 ' CB ' ' B' ' 114' ' ' TYR . 6.4 t -72.56 -116.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.413 -177.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.623 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 4.9 t70 75.63 -7.48 1.78 Allowed 'General case' 0 C--N 1.351 0.649 0 CA-C-O 121.443 0.64 . . . . 0.0 109.597 -176.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' SER . . . . . 0.42 ' OG ' ' NZ ' ' A' ' 2' ' ' LYS . 2.4 m -127.18 -69.43 0.75 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.46 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.733 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 0.6 OUTLIER -42.36 -78.28 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.68 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.456 ' H ' ' HB2' ' A' ' 29' ' ' SER . 1.7 m 169.0 46.78 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.55 0.691 . . . . 0.0 110.662 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.75 ' CG ' HG23 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -83.89 -52.55 6.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.831 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -48.69 -35.31 13.66 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -175.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.565 ' HB3' ' HB2' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -62.47 -57.03 12.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.632 0.651 . . . . 0.0 111.658 179.582 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.568 ' HB2' ' HB3' ' A' ' 32' ' ' MET . 0.2 OUTLIER -46.37 -48.76 18.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.506 0.67 . . . . 0.0 111.411 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.712 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 5.2 pttt -79.35 -27.88 42.03 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.004 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.45 -28.06 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.573 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.2 OUTLIER -88.42 -45.81 9.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.254 177.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.573 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 157.04 22.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 175.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 49.5 t -138.93 82.57 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.542 ' O ' HD13 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -64.54 56.74 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.006 0.431 . . . . 0.0 111.489 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.689 ' CG2' ' HE1' ' A' ' 32' ' ' MET . 0.6 OUTLIER 44.66 -11.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.474 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.1 OUTLIER -38.19 -60.64 0.75 Allowed 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.362 1.437 . . . . 0.0 110.542 -178.523 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -81.11 -27.84 47.73 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.608 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.538 ' CD1' ' HG ' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -66.95 -62.35 1.48 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.701 0.4 . . . . 0.0 111.101 -179.901 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.67 ' O ' ' HG2' ' B' ' 132' ' ' MET . 3.0 t -47.08 -66.6 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-O 121.144 0.497 . . . . 0.0 109.877 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.529 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 13.7 p -47.99 -34.97 10.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.267 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.7 m -73.77 -56.24 5.23 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.404 ' OG1' HG21 ' A' ' 31' ' ' THR . 0.7 OUTLIER -51.74 -39.16 58.0 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.365 -0.834 . . . . 0.0 108.914 178.668 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.886 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 19.0 mmt -52.91 -54.08 39.86 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.042 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.2 -46.85 79.29 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.34 -54.57 30.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.882 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.528 ' HB2' HD22 ' A' ' 17' ' ' LEU . 21.7 mm-40 -62.76 -27.14 69.08 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.282 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.556 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -72.31 -46.45 55.58 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.571 0.348 . . . . 0.0 110.72 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -56.59 5.77 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.213 0.53 . . . . 0.0 111.545 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.483 ' HD2' ' HG3' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -83.75 -34.35 24.85 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -176.635 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.583 ' CD1' ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 37.16 70.68 0.17 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -179.133 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.424 ' HG2' ' O ' ' B' ' 138' ' ' ARG . 3.6 ptp180 171.34 -71.89 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 177.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 179.45 148.15 0.24 Allowed 'General case' 0 C--O 1.239 0.551 0 CA-C-O 120.764 0.316 . . . . 0.0 111.67 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.483 ' HG3' ' HD2' ' B' ' 138' ' ' ARG . 1.4 mp0 -137.92 177.31 7.97 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.514 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.93 137.66 16.13 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.08 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -125.54 -151.43 0.48 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.715 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -130.53 -163.78 1.35 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 21.2 m -47.17 142.63 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-O 120.936 0.398 . . . . 0.0 111.878 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -53.37 -41.08 65.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.85 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 55.15 30.69 14.91 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.693 0.282 . . . . 0.0 111.604 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -143.27 141.43 31.03 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.735 0.302 . . . . 0.0 111.077 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -82.46 139.22 34.08 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.387 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -102.13 84.46 0.5 Allowed Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.966 -0.635 . . . . 0.0 113.228 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.1 tpt -115.1 67.01 0.69 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.859 0.361 . . . . 0.0 111.399 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 19.4 t -129.87 143.91 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.164 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.6 -175.06 2.8 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.932 0.396 . . . . 0.0 111.903 -179.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 12.0 t -114.7 -122.38 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.213 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 71.69 34.73 1.54 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.805 0.442 . . . . 0.0 111.383 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 126.69 13.58 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.124 0.488 . . . . 0.0 112.007 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -151.32 80.94 1.3 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.263 0.554 . . . . 0.0 111.701 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 16.8 mt -148.92 -56.88 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.582 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -78.28 125.88 29.99 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.895 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' MET . . . . . 0.459 ' CE ' ' HA ' ' B' ' 161' ' ' MET . 2.4 mmt -163.21 107.74 1.07 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.851 0.357 . . . . 0.0 111.748 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . 0.442 ' HB3' " H4'" ' C' ' 178' ' ' ' DT' . 2.7 t-20 -176.53 -175.95 0.7 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 127.26 136.92 4.4 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.028 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.5 t -166.55 171.87 11.32 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.549 0.214 . . . . 0.0 111.203 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -179.81 129.95 0.09 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.39 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -139.02 106.91 5.66 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.293 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -76.78 121.78 23.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.032 0.444 . . . . 0.0 111.324 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -145.69 28.33 1.17 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.547 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 5.7 p30 176.26 -116.38 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.48 ' O ' ' CB ' ' B' ' 171' ' ' ASP . 0.0 OUTLIER 168.29 -33.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.072 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.48 ' CB ' ' O ' ' B' ' 170' ' ' LYS . 3.7 t0 98.05 88.87 0.01 OUTLIER 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.584 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.332 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.838 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.886 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C1'-C2' 107.152 0.956 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.876 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.748 0 P-O3'-C3' 120.93 1.025 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.584 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 C4'-C3'-C2' 104.092 0.892 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.772 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.846 0 C1'-O4'-C4' 106.908 -1.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.543 ' OP2' ' HA ' ' A' ' 7' ' ' VAL . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C4'-C3'-C2' 104.619 1.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.671 ' H73' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.882 0 C3'-C2'-C1' 105.397 1.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.517 ' C8 ' H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.522 0 C3'-C2'-C1' 105.146 1.747 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.821 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 C3'-C2'-C1' 100.65 -1.465 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.821 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 O4'-C1'-C2' 107.024 0.84 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.577 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -0.964 0 C4'-C3'-C2' 104.674 1.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.578 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 106.923 0.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.578 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C4'-C3'-C2' 103.791 0.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C4'-C3'-C2' 100.882 -2.318 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.887 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C4'-C3'-C2' 102.379 -0.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.432 ' H42' ' HB3' ' B' ' 171' ' ' ASP . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C1'-C2' 106.826 0.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.627 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.636 0 O4'-C4'-C3' 106.13 0.53 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.627 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 O4'-C1'-C2' 106.991 0.81 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.576 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.0 0 C3'-C2'-C1' 105.416 1.94 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.563 ' C4 ' ' C5 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 104.807 1.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.595 " O5'" ' H8 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C3'-C2'-C1' 106.318 2.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.491 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 N19-C1'-C2' 115.033 0.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.491 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.411 -0.728 0 C4'-C3'-C2' 104.464 1.264 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.416 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.078 0 C1'-O4'-C4' 106.756 -2.103 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.448 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C1'-O4'-C4' 111.075 0.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.751 0 C4'-C3'-C2' 103.987 0.787 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.584 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 102.077 -0.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.424 ' O ' ' C ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 110.84 -0.059 . . . . 0.0 110.84 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 7.4 mmmm -27.82 112.92 0.06 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' B' ' 109' ' ' VAL . 25.1 tt0 -95.31 115.97 28.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.24 0.543 . . . . 0.0 111.556 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.732 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 7.9 ttm-85 -79.55 100.01 7.56 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.677 HG22 ' CE2' ' B' ' 114' ' ' TYR . 0.7 OUTLIER -103.28 130.54 53.37 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.842 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.367 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.762 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -130.05 127.66 40.36 Favored 'General case' 0 C--N 1.311 -1.083 0 C-N-CA 118.73 -1.188 . . . . 0.0 113.893 -177.1 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.598 HG21 ' HA ' ' B' ' 125' ' ' SER . 1.1 t -101.02 112.54 34.26 Favored 'Isoleucine or valine' 0 C--N 1.347 0.49 0 C-N-CA 124.39 1.076 . . . . 0.0 108.789 176.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.417 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 2.0 p -70.92 85.17 0.69 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.826 0.739 . . . . 0.0 110.386 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.752 HG11 ' CG ' ' A' ' 14' ' ' TYR . 10.3 m -72.26 -162.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.981 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.547 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.6 t70 84.7 -23.59 0.17 Allowed 'General case' 0 C--N 1.351 0.636 0 C-N-CA 123.396 0.679 . . . . 0.0 109.365 -177.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.36 -75.52 0.53 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.294 177.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.887 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 1.0 OUTLIER -51.46 -87.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.506 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 5.2 t -176.85 41.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.256 0.935 . . . . 0.0 112.259 -178.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.814 ' CE2' HG13 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -83.2 -43.8 15.74 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.657 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 16.8 mt-30 -47.84 -37.8 14.66 Favored 'General case' 0 C--O 1.221 -0.418 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -174.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.684 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -58.42 -56.22 24.93 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.473 1.033 . . . . 0.0 111.693 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.779 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -48.05 -47.89 33.47 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.454 0.645 . . . . 0.0 111.63 -178.214 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.657 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -76.74 -27.16 55.27 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.41 178.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.448 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . . . -66.03 -27.61 68.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.855 178.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.643 ' CD2' ' CG ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.8 -40.48 14.01 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.57 178.482 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.8 OUTLIER 151.21 21.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.267 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.476 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 68.4 t -155.9 89.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.515 0 C-N-CA 120.886 -0.326 . . . . 0.0 111.833 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.466 ' O ' ' CE ' ' B' ' 132' ' ' MET . 1.1 m120 -61.2 -100.28 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.77 HG13 ' HE1' ' B' ' 132' ' ' MET . 0.2 OUTLIER -146.26 4.79 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.426 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 89.5 p -44.38 -64.82 0.61 Allowed 'General case' 0 C--O 1.244 0.794 0 C-N-CA 119.395 -0.922 . . . . 0.0 108.826 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.4 -28.65 29.58 Favored Glycine 0 CA--C 1.519 0.319 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.593 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.686 HD13 ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -58.74 -59.6 5.16 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 122.198 0.199 . . . . 0.0 110.858 179.489 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.697 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.1 t -52.31 -61.65 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.805 ' HB3' ' CB ' ' B' ' 112' ' ' ASP . 12.1 p -50.55 -42.73 55.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 89.3 m -71.34 -53.29 14.68 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.47 -41.46 89.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.129 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.89 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.5 OUTLIER -56.0 -52.99 62.24 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.446 178.433 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.426 ' O ' ' HB1' ' A' ' 36' ' ' ALA . 53.2 mt-30 -53.68 -56.68 15.17 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.35 -53.27 56.11 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.441 ' HB3' ' CD2' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -66.83 -23.33 66.02 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.145 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.569 ' HB2' ' HB3' ' B' ' 116' ' ' LEU . . . -72.19 -47.57 49.66 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.408 ' CG ' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.79 -51.58 66.52 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -60.73 -52.14 66.36 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.151 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.771 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 34.59 81.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.953 0.901 . . . . 0.0 113.008 178.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.8 mtt180 69.58 50.02 0.53 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.398 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.52 -57.92 1.72 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.0 158.86 10.2 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.015 0.436 . . . . 0.0 111.963 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -99.57 -58.67 1.88 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.962 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.9 t-105 -171.15 173.69 4.9 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.5 0.19 . . . . 0.0 110.827 -179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.552 ' HB3' ' HB2' ' B' ' 142' ' ' GLU . 1.8 mtmp? -147.25 164.46 33.14 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.539 0.209 . . . . 0.0 111.143 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.43 ' HB ' ' O ' ' B' ' 143' ' ' ARG . 21.8 t -129.06 -102.66 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.601 ' HG2' ' HB2' ' B' ' 138' ' ' ARG . 18.2 mt-10 -149.07 90.95 1.8 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -178.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.751 ' HB3' ' HB3' ' B' ' 144' ' ' TRP . 10.0 t-20 134.36 -125.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.47 1.108 . . . . 0.0 112.077 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.598 ' O ' ' HB2' ' B' ' 144' ' ' TRP . 23.7 mt-30 -122.76 -176.07 3.31 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-O 120.983 0.421 . . . . 0.0 111.87 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.93 138.97 44.59 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.978 0.418 . . . . 0.0 111.603 -179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.569 ' HA3' ' CZ3' ' B' ' 144' ' ' TRP . . . 174.66 -147.88 9.4 Favored Glycine 0 C--N 1.336 0.563 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.059 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 4.8 ttt -72.26 -39.99 67.98 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.489 ' HA ' ' CD1' ' B' ' 144' ' ' TRP . 2.8 p 50.9 24.26 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -93.01 135.04 34.53 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.761 0.315 . . . . 0.0 111.365 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.4 t -137.12 -125.66 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.376 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -174.23 -101.28 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 39.6 mmt-85 -156.74 170.64 21.96 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.96 0.41 . . . . 0.0 111.862 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -177.97 103.47 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.374 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 32.2 mm -140.9 106.8 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.038 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -101.62 156.75 17.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.435 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 12.9 mtm -137.12 109.32 7.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.148 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -141.33 149.0 40.62 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.291 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -138.39 -162.73 9.31 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.123 -0.56 . . . . 0.0 112.833 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.5 t -161.74 177.76 9.62 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.861 0.362 . . . . 0.0 111.411 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -136.9 164.23 28.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.336 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -147.5 151.33 36.19 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.136 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -128.4 -79.09 0.57 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.355 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.83 -163.07 0.83 Allowed 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.661 0.267 . . . . 0.0 111.461 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -154.4 -71.27 0.13 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.987 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.413 ' NZ ' ' O ' ' A' ' 71' ' ' ASP . 0.1 OUTLIER -179.92 -37.0 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.413 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.1 t70 86.28 179.89 0.03 OUTLIER 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.131 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.141 -0.933 . . . . 0.0 111.566 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.414 ' O ' ' C ' ' B' ' 102' ' ' LYS . 4.7 mpp? . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 120.276 0.084 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.483 ' HE2' " H3'" ' C' ' 175' ' ' ' DA' . 12.3 mptt -29.11 114.7 0.09 Allowed 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.445 0.466 . . . . 0.0 111.997 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.641 ' HB3' HG23 ' A' ' 9' ' ' VAL . 3.5 tp60 -99.36 125.06 44.96 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.976 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.472 ' NE ' ' O4 ' ' C' ' 178' ' ' ' DT' . 0.3 OUTLIER -77.91 114.61 16.94 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.279 -177.911 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.814 HG13 ' CE2' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -102.89 108.98 25.48 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.949 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 177.899 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.88 ' OG1' ' H71' ' D' ' 191' ' ' ' DT' . 0.5 OUTLIER -115.25 114.02 24.65 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.986 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.592 ' HA ' ' OP2' ' D' ' 190' ' ' ' DG' . 0.1 OUTLIER -101.21 101.35 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 176.849 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.732 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 77.0 p -68.61 95.2 0.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.692 HG21 ' CG ' ' B' ' 114' ' ' TYR . 16.5 m -91.29 -148.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.613 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.412 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 15.9 t70 88.84 -13.33 0.39 Allowed 'General case' 0 C--N 1.346 0.445 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 -176.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.4 t -114.46 -62.48 1.59 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.805 ' CB ' ' HB3' ' A' ' 29' ' ' SER . 0.6 OUTLIER -48.66 -89.34 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 O-C-N 123.591 0.557 . . . . 0.0 111.865 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.405 ' HB3' ' HG3' ' A' ' 33' ' ' GLN . 1.3 m 176.04 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.865 0.757 . . . . 0.0 111.438 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.861 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -82.37 -44.36 16.23 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.312 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.581 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 4.4 mt-30 -48.78 -42.63 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.569 ' HB3' ' HB2' ' A' ' 36' ' ' ALA . 0.8 OUTLIER -52.32 -30.19 27.11 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.89 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -77.5 -53.62 7.41 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 121.599 0.714 . . . . 0.0 111.204 179.534 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.619 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -70.43 -28.83 65.35 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.556 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -60.57 -28.13 68.23 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.864 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.771 ' CD2' ' HG ' ' A' ' 39' ' ' LEU . 0.1 OUTLIER -89.16 -36.81 15.48 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.022 179.097 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.684 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 33.2 t70 146.83 25.36 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 176.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.587 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 61.8 t -159.67 101.13 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 O-C-N 121.841 -0.537 . . . . 0.0 112.396 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.503 ' HB3' HD11 ' B' ' 124' ' ' ILE . 67.8 m-80 -58.9 -92.51 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 177.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.721 ' CG2' ' HB3' ' B' ' 127' ' ' LEU . 0.1 OUTLIER -154.84 6.76 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.727 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.598 ' HA ' HG21 ' A' ' 7' ' ' VAL . 54.0 p -38.6 -64.27 0.45 Allowed 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.076 -177.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.52 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.25 -20.25 46.41 Favored Glycine 0 CA--C 1.522 0.471 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.834 177.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.721 ' HB3' ' CG2' ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.82 -61.21 2.56 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.061 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.67 HG22 ' HB ' ' B' ' 124' ' ' ILE . 26.0 t -55.15 -65.16 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 CA-C-O 121.687 0.755 . . . . 0.0 109.136 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.887 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 3.0 p -49.44 -47.96 47.8 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.52 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -81.14 -48.53 12.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.441 1.019 . . . . 0.0 111.198 -178.404 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.664 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.98 -37.91 69.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.102 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.779 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 1.6 mmt -64.21 -48.19 76.83 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.389 178.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.506 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 14.6 tt0 -48.79 -42.13 34.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.096 0.407 . . . . 0.0 110.659 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . 0.705 ' HB3' ' HG2' ' B' ' 142' ' ' GLU . 1.5 m-20 -63.51 -55.68 22.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.177 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.645 ' O ' ' HA ' ' B' ' 139' ' ' LEU . 23.9 tp10 -71.31 -9.76 58.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.102 178.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.684 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -88.19 -46.93 8.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.985 0.421 . . . . 0.0 109.925 178.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -63.3 -56.17 18.65 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.623 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.601 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 2.8 tpt85 -83.06 -41.35 18.72 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.236 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.645 ' HA ' ' O ' ' B' ' 135' ' ' GLU . 0.2 OUTLIER 57.21 58.38 3.95 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.445 0.64 . . . . 0.0 112.417 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.51 ' HG2' ' C ' ' B' ' 139' ' ' LEU . 2.0 ptt-85 167.45 -50.64 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.241 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . 0.457 ' O ' ' HG2' ' B' ' 138' ' ' ARG . . . -170.46 130.44 0.89 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 122.47 0.308 . . . . 0.0 110.542 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.705 ' HG2' ' HB3' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -105.07 131.81 52.11 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.247 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.593 ' HB3' ' O ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 171.36 -64.03 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.751 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 2.1 t90 -88.3 -128.7 0.06 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.142 0.177 . . . . 0.0 111.296 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.424 ' HD3' ' HA ' ' B' ' 145' ' ' LYS . 0.0 OUTLIER -134.73 -174.32 3.55 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.813 0.34 . . . . 0.0 111.194 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 5.9 p -82.33 139.3 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 120.914 0.388 . . . . 0.0 111.849 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -162.75 162.09 26.57 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.063 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -90.11 133.69 34.71 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.13 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.08 58.03 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.12 -174.79 3.03 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.892 0.377 . . . . 0.0 111.511 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 147.76 35.86 0.05 OUTLIER Glycine 0 CA--C 1.523 0.571 0 CA-C-N 115.977 -0.556 . . . . 0.0 113.71 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 2.6 ttp -86.26 48.63 1.65 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.45 0.625 . . . . 0.0 111.626 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -157.35 130.2 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.709 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.3 151.68 19.5 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.856 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.2 t -125.5 -4.49 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 54.62 56.13 7.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.209 0.528 . . . . 0.0 111.364 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.84 97.01 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.906 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.88 82.63 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.072 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 67.4 mt -141.5 -61.14 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.002 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.05 122.09 32.04 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.756 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 5.0 ttt -113.92 -13.2 12.57 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.077 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 70.46 179.72 0.24 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.0 0.429 . . . . 0.0 111.755 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 175.06 -150.48 11.15 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 121.048 -0.596 . . . . 0.0 112.716 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 20.9 t -164.49 172.81 12.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.599 0.238 . . . . 0.0 111.365 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -175.66 119.92 0.17 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.459 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -160.09 139.66 11.17 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.095 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -120.05 92.58 3.81 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.21 0.529 . . . . 0.0 111.765 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -143.17 71.56 1.34 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.593 0.711 . . . . 0.0 109.947 179.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -115.04 171.36 7.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.744 -179.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.16 -34.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 71.33 -59.98 0.53 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.798 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 8.4 m95 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.852 179.502 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.875 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.513 -0.568 0 O4'-C1'-N19 108.264 0.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.524 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 C3'-C2'-C1' 100.726 -1.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.572 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 O4'-C1'-C2' 107.326 1.115 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.579 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.406 -1.082 0 C1'-O4'-C4' 107.134 -1.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.579 " O5'" H2'' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.891 0 C3'-C2'-C1' 104.54 1.314 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.539 ' H73' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.847 0 C4'-C3'-C2' 104.616 1.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.566 ' C8 ' ' H72' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.552 0 C3'-C2'-C1' 104.468 1.263 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.566 ' H72' ' C8 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.514 -0.532 0 C3'-C2'-C1' 101.296 -1.003 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C1'-O4'-C4' 110.913 0.866 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.521 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.931 0 C4'-C3'-C2' 104.748 1.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.521 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.704 0 C4'-C3'-C2' 104.193 0.993 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.424 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 101.651 -0.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 C4'-C3'-C2' 100.856 -2.344 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.868 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 N19-C1'-C2' 115.598 0.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.578 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 C3'-C2'-C1' 102.131 -0.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.578 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C1'-O4'-C4' 110.783 0.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.482 H2'' " O5'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.795 0 C1'-O4'-C4' 106.952 -1.963 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.592 ' OP2' ' HA ' ' B' ' 107' ' ' VAL . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C4'-C3'-C2' 104.797 1.597 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.88 ' H71' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.509 -0.828 0 C4'-C3'-C2' 103.92 0.72 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.443 " H2'" ' C7 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 C3'-C2'-C1' 106.386 2.633 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.522 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.656 0 N19-C1'-C2' 115.868 1.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.522 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C3'-C2'-C1' 105.762 2.187 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.511 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.811 0 C4'-C3'-C2' 104.382 1.182 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.451 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 C4'-C3'-C2' 104.139 0.939 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.428 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 N19-C1'-C2' 115.472 0.795 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.572 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C4'-C3'-C2' 103.713 0.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.406 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 62.2 mtm . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 120.805 0.336 . . . . 0.0 110.999 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 3.5 mptt 70.02 111.54 0.05 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.986 -178.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.415 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 29.7 tp60 -104.64 109.62 21.61 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.13 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.867 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 2.3 ttm105 -78.91 104.6 9.65 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.331 -179.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.613 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -104.08 130.21 55.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 177.786 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.663 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.36 128.41 39.6 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 119.117 -1.033 . . . . 0.0 112.901 -177.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.566 ' O ' HG22 ' B' ' 105' ' ' ILE . 1.2 t -100.1 107.64 21.33 Favored 'Isoleucine or valine' 0 C--N 1.35 0.598 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.2 p -71.23 98.34 1.71 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.94 -0.475 . . . . 0.0 110.442 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.727 HG23 ' CG ' ' A' ' 14' ' ' TYR . 3.8 t -92.35 -130.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 119.094 -0.479 . . . . 0.0 112.077 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.521 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 31.4 t70 85.18 -9.23 0.84 Allowed 'General case' 0 C--N 1.351 0.641 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.4 m -132.23 -56.54 0.97 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.856 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.787 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 2.8 m-20 -49.86 -98.36 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -177.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.447 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 41.3 t -178.41 36.78 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.376 -0.828 . . . . 0.0 110.606 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.727 ' CG ' HG23 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.79 -45.71 14.0 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.794 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.694 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.1 -39.24 27.4 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -176.014 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -59.14 -56.84 17.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.439 0.563 . . . . 0.0 112.284 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.778 ' CD1' ' HA ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -59.61 -39.46 84.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 120.027 -0.669 . . . . 0.0 112.744 -177.471 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.694 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -80.14 -35.47 36.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.041 0.448 . . . . 0.0 112.123 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.592 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -73.66 -21.57 60.23 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.896 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.589 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -87.79 -40.08 14.36 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 118.913 -0.565 . . . . 0.0 109.642 178.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.589 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 7.0 t70 171.52 -5.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.699 ' CG1' ' HB2' ' A' ' 27' ' ' LEU . 74.4 t -121.57 82.0 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -177.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.548 ' O ' HD11 ' A' ' 24' ' ' ILE . 45.5 p30 -67.19 51.44 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 111.068 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.763 ' CG2' ' HE2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 46.11 -15.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.556 ' HA ' HG21 ' B' ' 107' ' ' VAL . 0.3 OUTLIER -37.99 -63.01 0.51 Allowed 'General case' 0 C--O 1.238 0.486 0 CA-C-N 120.166 1.348 . . . . 0.0 110.838 -177.688 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.52 -29.16 30.69 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.473 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.699 ' HB2' ' CG1' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -58.0 -62.33 1.9 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.463 179.511 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.626 ' O ' ' HG2' ' A' ' 32' ' ' MET . 2.8 t -48.48 -63.48 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.382 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.809 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 94.2 p -49.55 -38.73 32.05 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 81.3 m -67.31 -54.41 20.96 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.43 HG22 ' HG ' ' B' ' 127' ' ' LEU . 93.0 m -58.15 -40.85 82.45 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.257 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.738 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 8.1 mmt -53.52 -54.27 39.63 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.974 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? -62.73 -45.11 94.22 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.935 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.47 -50.72 71.62 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.555 ' HG2' ' CD1' ' B' ' 127' ' ' LEU . 5.6 tp10 -64.57 -37.93 89.24 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.468 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -56.11 -43.5 78.18 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 177.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -53.24 19.86 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -37.04 71.3 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.187 -1.369 . . . . 0.0 113.224 -177.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.455 HD23 ' O ' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -26.29 -48.25 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 113.912 1.079 . . . . 0.0 113.912 -178.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.403 ' O ' ' NH1' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -70.46 60.74 0.22 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.228 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.56 125.65 2.88 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.749 0.309 . . . . 0.0 111.493 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -74.56 59.3 0.82 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 112.31 13.14 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.988 0.423 . . . . 0.0 110.754 178.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -129.72 -174.94 3.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.541 -179.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.6 mtmm -130.44 162.65 28.69 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.626 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.7 m -138.47 45.58 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.034 0.445 . . . . 0.0 111.066 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -138.57 60.29 1.61 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.218 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.465 ' HB3' ' OE1' ' A' ' 49' ' ' GLN . 4.2 m120 -120.48 -94.75 0.5 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.542 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.465 ' OE1' ' HB3' ' A' ' 48' ' ' ASN . 2.2 pm0 -131.87 56.09 1.84 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.284 0.564 . . . . 0.0 110.806 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.04 -163.27 0.85 Allowed 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.294 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -175.8 121.64 0.82 Allowed Glycine 0 C--N 1.334 0.443 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.782 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 87.8 mtp -73.69 70.23 1.35 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.971 0.415 . . . . 0.0 110.895 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.5 p -58.93 131.99 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.878 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -107.1 -172.72 2.13 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.337 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.1 t -99.26 -3.59 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 71.21 -57.99 0.59 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.234 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -128.6 138.33 52.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.282 179.481 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -142.31 75.59 1.5 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.666 0.746 . . . . 0.0 112.245 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 38.4 mm -112.84 91.81 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.767 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -76.44 132.91 39.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.864 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -129.27 -54.97 1.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.4 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -134.08 -160.4 1.05 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.976 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.51 -112.08 0.46 Allowed Glycine 0 C--N 1.338 0.664 0 C-N-CA 120.873 -0.68 . . . . 0.0 113.152 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 65' ' ' PHE . 48.4 t 60.89 -149.91 0.41 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.643 0.259 . . . . 0.0 110.772 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.419 ' N ' ' OG ' ' A' ' 64' ' ' SER . 0.4 OUTLIER -111.01 -53.54 2.69 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.536 0.207 . . . . 0.0 111.219 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.27 40.3 3.75 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 36.11 73.11 0.09 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.221 0.534 . . . . 0.0 112.387 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -67.61 124.8 24.25 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.876 0.37 . . . . 0.0 110.616 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -82.94 -52.93 6.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.643 -179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.524 ' HD3' ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER 174.27 -29.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.524 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 4.5 t70 84.57 122.47 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.553 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.837 -1.078 . . . . 0.0 110.633 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 mmm . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 111.218 0.081 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.512 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 12.0 mmmt -148.31 174.59 11.87 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.505 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 33.8 tp60 -121.15 112.53 18.78 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.535 0.683 . . . . 0.0 112.121 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.468 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 5.5 ttm105 -79.55 111.91 16.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.895 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.707 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.8 OUTLIER -101.47 130.06 51.61 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.758 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.255 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.636 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.96 116.56 17.3 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.281 -177.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.556 HG21 ' HA ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -101.66 104.54 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 174.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.867 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 8.9 p -70.02 95.29 0.94 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.697 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 0.9 OUTLIER -93.2 -145.3 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.992 -178.632 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.466 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 28.2 t0 92.69 -10.62 0.18 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -175.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.46 -64.35 1.26 Allowed 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.354 177.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.809 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -44.0 -94.44 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.436 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -177.59 42.33 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.699 -0.625 . . . . 0.0 110.94 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.697 ' HB3' ' CG1' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.13 -45.52 15.05 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.055 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.532 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 3.9 mt-30 -49.86 -43.67 49.26 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.43 -33.82 22.29 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.738 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.1 -53.94 6.83 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.894 -0.722 . . . . 0.0 111.771 178.594 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.549 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -63.44 -25.49 68.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.995 178.621 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.62 -26.18 31.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.775 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.641 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 97.4 m-85 -87.64 -49.11 7.37 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.295 178.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.641 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 25.0 p-10 136.46 34.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 124.844 1.34 . . . . 0.0 112.078 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 5.5 p -120.76 -39.7 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.456 ' O ' HD13 ' B' ' 117' ' ' LEU . 36.8 m-80 59.95 -119.64 0.92 Allowed 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.681 HG13 ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -139.21 4.02 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 179.477 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.494 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.4 OUTLIER -40.53 -64.96 0.46 Allowed 'General case' 0 C--O 1.243 0.744 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.466 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -84.5 -23.13 51.95 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.128 178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.699 HD23 ' SD ' ' A' ' 32' ' ' MET . 7.0 tp -63.99 -61.27 2.38 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-N 116.843 0.322 . . . . 0.0 111.187 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.66 HG22 ' CG2' ' B' ' 124' ' ' ILE . 24.8 t -51.83 -61.19 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.787 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.8 p -48.41 -49.08 36.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.04 -43.73 33.45 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.61 0.641 . . . . 0.0 110.496 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.507 HG21 ' N ' ' B' ' 132' ' ' MET . 0.6 OUTLIER -63.14 -39.89 96.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.647 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.778 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 4.8 mmt -63.48 -57.05 11.45 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.62 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.447 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 5.3 tp60 -48.82 -37.52 19.55 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.962 0.164 . . . . 0.0 111.225 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -65.18 -57.47 8.45 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.769 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.627 ' HB2' HD11 ' A' ' 17' ' ' LEU . 1.3 mm-40 -75.81 -8.56 57.17 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.569 0.223 . . . . 0.0 111.053 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.531 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -87.23 -32.48 19.75 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.39 -46.77 13.11 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.898 0.856 . . . . 0.0 110.326 178.245 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 11.4 mtt180 -78.39 -17.47 56.39 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 113.617 -1.629 . . . . 0.0 114.614 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.521 ' CD2' ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -36.32 124.24 0.78 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 118.678 0.672 . . . . 0.0 111.841 -178.458 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 81.79 143.76 0.07 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.022 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.39 113.05 1.6 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.777 0.322 . . . . 0.0 110.833 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -142.64 167.9 20.99 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.148 0.499 . . . . 0.0 112.1 -179.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.51 41.46 0.7 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.364 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -92.87 175.88 6.64 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.088 0.47 . . . . 0.0 111.83 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.99 -69.6 0.6 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.444 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 13.5 p -172.99 154.98 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.119 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -99.41 109.58 22.15 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.105 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -178.7 -51.16 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.174 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.14 123.8 0.72 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.881 0.372 . . . . 0.0 111.204 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -92.85 45.36 1.18 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.044 0.45 . . . . 0.0 111.19 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -105.07 85.22 0.45 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 121.238 -0.506 . . . . 0.0 112.709 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 1.1 ttt -69.96 86.95 0.54 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.954 0.407 . . . . 0.0 111.153 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 15.3 t -122.19 137.06 57.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.115 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -102.2 171.84 7.25 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.057 0.456 . . . . 0.0 111.419 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.4 t -133.37 -125.53 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.082 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 60.84 93.01 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.005 0.431 . . . . 0.0 112.14 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 5.0 ptt180 -81.7 153.56 26.51 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.917 0.389 . . . . 0.0 111.302 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -103.96 56.86 0.73 Allowed 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.641 0.734 . . . . 0.0 110.544 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 7.8 mm -123.93 88.74 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.493 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -149.16 163.96 36.09 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.852 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 77.9 mtp 49.34 59.35 4.54 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.068 0.461 . . . . 0.0 111.302 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -133.6 170.1 16.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.616 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 101.86 -164.15 17.34 Favored Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.017 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 34.0 t -153.78 165.77 34.98 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.963 0.411 . . . . 0.0 111.519 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.97 24.64 0.5 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.616 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -179.26 80.68 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.91 0.386 . . . . 0.0 111.198 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -94.26 -52.98 4.12 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.384 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 65.28 -151.55 0.26 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.413 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 70.2 -107.08 0.06 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 122.283 0.233 . . . . 0.0 110.825 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.466 ' NZ ' ' O ' ' B' ' 171' ' ' ASP . 0.4 OUTLIER 175.42 -32.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.466 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 2.0 t0 86.24 177.82 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.381 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.493 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.279 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.405 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.887 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.643 0 C1'-O4'-C4' 110.487 0.562 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.476 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 101.593 -0.79 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.576 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-C2' 107.392 1.175 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.02 0 C1'-O4'-C4' 106.427 -2.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.566 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.912 0 C4'-C3'-C2' 104.755 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.566 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.408 -0.941 0 C4'-C3'-C2' 104.619 1.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.546 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.566 0 C3'-C2'-C1' 105.209 1.792 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.895 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C3'-C2'-C1' 100.703 -1.426 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.895 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 C1'-O4'-C4' 110.61 0.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.402 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.527 0.865 0 C3'-C2'-C1' 105.327 1.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.422 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-C2' 106.877 0.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.422 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 C4'-C3'-C2' 104.41 1.21 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 C4'-C3'-C2' 100.937 -2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.89 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.872 0 O4'-C1'-N19 109.12 1.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.586 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 P--O3' 1.614 0.553 0 C4'-C3'-C2' 104.337 1.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.73 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C3'-C2'-C1' 102.101 -0.428 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.747 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C4'-C3'-C2' 102.362 -0.838 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.747 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -1.013 0 C4'-C3'-C2' 104.752 1.552 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.617 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C5'-C4'-O4' 108.492 -0.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.586 ' N7 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C3'-C2'-C1' 104.252 1.108 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.512 -0.623 0 C4'-C3'-C2' 104.006 0.806 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.494 ' C5 ' ' C5 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.811 0 C4'-C3'-C2' 104.66 1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.494 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.967 0 C1'-O4'-C4' 107.306 -1.71 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.636 0 C4'-C3'-C2' 104.07 0.87 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 O4'-C1'-C2' 105.218 -0.802 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.576 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 O4'-C4'-C3' 105.968 0.368 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.473 ' O ' ' HD2' ' A' ' 2' ' ' LYS . 30.7 mtt . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 120.038 -0.029 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.547 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 1.7 mmmt -143.35 174.84 10.38 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 123.425 0.453 . . . . 0.0 110.598 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.708 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -119.28 107.64 13.64 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.312 0.577 . . . . 0.0 111.796 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.885 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.94 109.79 14.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.534 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.709 HD11 ' CD1' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -121.28 112.93 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 177.396 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.764 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.0 OUTLIER -123.46 132.92 54.08 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.84 -177.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.594 ' O ' HG23 ' A' ' 9' ' ' VAL . 0.5 OUTLIER -100.41 112.27 32.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 176.928 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.442 HG22 ' NH1' ' B' ' 104' ' ' ARG . 6.5 p -67.06 92.76 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.623 -0.673 . . . . 0.0 110.07 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.612 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -97.64 -155.13 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.404 -178.235 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 24.7 t0 113.22 5.27 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.597 1.159 . . . . 0.0 108.837 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.7 t -152.18 -38.8 0.11 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.756 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.693 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -73.3 32.64 0.07 Allowed 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -177.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.498 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER 70.71 1.71 3.83 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 120.692 -1.255 . . . . 0.0 113.856 178.202 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.854 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.7 OUTLIER -55.92 -53.6 54.88 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.919 0.39 . . . . 0.0 110.919 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.609 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 3.0 mp0 -49.91 -41.55 46.21 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -177.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.562 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -51.08 -29.71 13.88 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.918 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.65 -59.8 2.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.466 0.651 . . . . 0.0 110.919 178.2 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.609 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 4.4 pttt -63.63 -25.91 68.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.799 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.464 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.25 -25.64 34.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.098 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.579 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 21.0 m-85 -88.32 -50.24 6.46 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.565 178.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 19.7 t0 143.34 50.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.216 0.947 . . . . 0.0 110.166 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.556 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 1.4 p -176.05 96.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.738 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.51 ' HB3' HD11 ' A' ' 24' ' ' ILE . 68.4 m-80 -60.83 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.109 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.669 ' HB ' ' CG2' ' A' ' 28' ' ' VAL . 0.2 OUTLIER -146.38 5.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 24' ' ' ILE . 36.2 p -39.11 -62.99 0.58 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.455 -177.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.18 -30.04 32.12 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.098 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.567 ' HB3' ' CG2' ' A' ' 24' ' ' ILE . 22.0 tp -60.56 -56.3 22.95 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.193 0.197 . . . . 0.0 111.28 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.669 ' CG2' ' HB ' ' A' ' 24' ' ' ILE . 3.1 t -53.96 -64.43 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.439 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.687 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.701 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 10.8 p -49.73 -42.19 45.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.411 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.11 -46.15 52.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.436 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.549 HG23 ' HB ' ' B' ' 131' ' ' THR . 22.9 m -63.21 -36.13 82.63 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.981 179.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.878 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -54.57 -47.86 72.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.184 179.071 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.5 -36.85 76.84 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 120.475 0.179 . . . . 0.0 111.182 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.427 ' ND2' HG21 ' A' ' 31' ' ' THR . 0.0 OUTLIER -74.43 -44.8 50.21 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.32 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.603 ' HB3' HD22 ' B' ' 117' ' ' LEU . 1.2 tp10 -69.86 -26.63 64.3 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.045 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.593 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.34 -44.72 64.54 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -55.55 11.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.509 0.671 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -82.08 -40.84 21.38 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 114.668 -1.151 . . . . 0.0 114.046 -176.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.493 ' CD1' ' CD2' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 48.58 -174.8 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -178.772 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.05 177.25 0.06 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.79 -179.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -76.71 164.6 25.72 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.004 0.43 . . . . 0.0 112.033 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.458 ' O ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -105.97 -176.04 2.96 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.132 0.492 . . . . 0.0 112.154 -179.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -134.91 -164.67 1.55 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.361 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -137.97 163.88 30.42 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 120.751 0.31 . . . . 0.0 111.554 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -170.37 165.97 8.66 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.395 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.439 ' C ' ' HG2' ' A' ' 47' ' ' GLU . 2.0 p -109.6 170.66 2.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.169 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.783 ' OE2' ' H71' ' C' ' 176' ' ' ' DT' . 0.0 OUTLIER -159.94 159.58 32.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.135 0.493 . . . . 0.0 112.116 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.495 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 23.7 t-20 170.41 154.37 0.05 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.89 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 176.02 151.08 0.14 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.107 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -124.4 148.92 47.25 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.812 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -164.92 128.31 1.77 Allowed Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.436 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.12 59.08 0.52 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.26 0.553 . . . . 0.0 110.827 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.4 p -69.81 120.7 17.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.881 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.3 77.35 1.85 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.273 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.447 ' CG1' ' H ' ' A' ' 56' ' ' ALA . 7.5 p -86.27 -117.28 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.051 -179.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.447 ' H ' ' CG1' ' A' ' 55' ' ' VAL . . . 69.93 52.44 0.4 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.121 0.486 . . . . 0.0 111.415 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.11 166.25 16.48 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.558 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -178.98 97.55 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.489 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 22.8 mm -149.8 -89.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.409 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -160.55 166.18 29.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.505 0.322 . . . . 0.0 110.411 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.5 -84.92 0.2 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 176.94 -175.37 0.13 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.932 0.396 . . . . 0.0 111.788 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -100.51 119.16 6.41 Favored Glycine 0 C--N 1.336 0.537 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.414 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 73.7 m -62.73 80.6 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.929 0.395 . . . . 0.0 112.026 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -140.63 98.27 3.37 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.873 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -146.13 101.92 3.57 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.681 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -76.43 -56.29 4.76 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.664 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 57.02 72.27 0.52 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.08 0.467 . . . . 0.0 111.465 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -85.98 -104.17 0.06 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.32 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.35 -36.57 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 74.81 -78.19 0.05 OUTLIER 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 114.452 -1.249 . . . . 0.0 111.52 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 34.2 m0 . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.666 179.539 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 120.729 0.3 . . . . 0.0 111.751 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.659 ' CG ' ' HB3' ' A' ' 47' ' ' GLU . 1.8 mmtp -152.86 123.96 7.51 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.007 0.432 . . . . 0.0 111.982 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.416 ' HG2' ' CG2' ' B' ' 105' ' ' ILE . 2.0 tt0 -113.54 110.6 20.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.965 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.678 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 11.8 ttm-85 -79.23 99.14 6.91 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.183 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.677 ' CG2' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -104.82 112.29 37.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.587 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.764 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -107.33 125.1 50.75 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.447 -175.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.558 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -99.33 93.3 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.576 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.885 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.3 p -66.31 67.64 0.05 Allowed 'General case' 0 CA--C 1.523 -0.079 0 CA-C-O 122.276 1.036 . . . . 0.0 109.526 -177.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.709 ' CG1' ' HB3' ' B' ' 114' ' ' TYR . 7.1 p -69.92 -127.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.848 -178.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.708 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 3.6 t70 83.44 -3.35 1.19 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.914 0.864 . . . . 0.0 109.082 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 38.0 m -127.06 -64.66 0.99 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.358 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.701 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.64 -85.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.712 0 O-C-N 123.696 0.623 . . . . 0.0 112.258 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.491 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.6 t 174.64 43.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.364 0.602 . . . . 0.0 110.881 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.853 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -84.06 -42.27 16.31 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.55 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.42 -42.24 21.86 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -175.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -49.79 64.18 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.996 0.816 . . . . 0.0 111.362 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.878 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.41 -48.98 78.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.819 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.569 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -71.27 -26.13 62.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.238 0.542 . . . . 0.0 110.529 179.534 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.16 -24.04 62.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.82 178.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.609 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 10.4 m-30 -87.98 -43.64 11.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.609 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 1.9 p-10 121.72 19.36 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.137 0 O-C-N 125.007 1.442 . . . . 0.0 111.81 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 79.2 t -101.7 -40.64 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.25 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 61.54 -124.96 0.84 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.775 ' HB ' HG21 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -131.51 3.59 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.425 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.5 OUTLIER -39.43 -64.33 0.48 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.253 -178.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.23 -25.39 33.92 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.387 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.574 ' CD1' ' HG ' ' B' ' 117' ' ' LEU . 6.1 tt -59.38 -61.44 2.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.188 0.518 . . . . 0.0 110.222 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.775 HG21 ' HB ' ' B' ' 124' ' ' ILE . 3.4 t -50.67 -63.54 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.443 178.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.693 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 92.4 p -48.58 -46.9 39.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.438 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.6 OUTLIER -70.17 -48.01 59.14 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.549 ' HB ' HG23 ' A' ' 31' ' ' THR . 0.6 OUTLIER -65.02 -33.72 76.72 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.817 179.949 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.918 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 mmt -56.13 -52.92 62.62 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.187 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.454 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -58.16 -36.86 73.64 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.622 0.231 . . . . 0.0 111.622 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . 0.454 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.44 -51.05 13.95 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.568 ' HG3' HD23 ' B' ' 139' ' ' LEU . 12.0 tp10 -67.47 -24.46 65.6 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.965 -0.384 . . . . 0.0 109.965 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.562 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -69.41 -46.28 67.2 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -53.45 12.96 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.853 178.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.47 ' O ' ' C ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER -82.43 -17.8 44.11 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -175.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.57 ' CD1' ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -2.85 95.9 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -179.218 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.49 151.74 19.12 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.205 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.17 63.29 0.7 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.892 0.377 . . . . 0.0 111.517 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 59.35 168.86 0.07 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.63 94.09 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.389 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 43.5 p-90 -170.1 170.21 7.56 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.774 0.321 . . . . 0.0 111.811 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.92 145.54 1.89 Allowed 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.734 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.8 p -125.18 144.2 36.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 120.847 0.356 . . . . 0.0 111.834 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -129.09 130.57 46.66 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -132.3 154.83 49.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.182 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -93.12 131.23 38.35 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.034 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -84.71 150.92 24.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.276 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -143.72 139.56 8.87 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.698 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 26.9 mmt -92.39 162.75 14.12 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.791 0.329 . . . . 0.0 111.269 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -133.89 -77.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.831 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.16 -159.71 0.73 Allowed 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 111.544 0.202 . . . . 0.0 111.544 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 4.5 t -108.43 -122.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.027 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -143.03 -49.52 0.33 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.93 128.54 33.59 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.63 0.253 . . . . 0.0 110.801 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.491 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -162.83 93.72 0.82 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.299 0.571 . . . . 0.0 111.668 -179.587 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 4.1 mt -91.26 -131.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.736 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -135.94 164.27 28.36 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.029 0.443 . . . . 0.0 111.386 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 2.1 ttp -150.77 -60.82 0.19 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.123 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.92 152.23 7.68 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.027 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 102.89 82.3 1.62 Allowed Glycine 0 C--N 1.333 0.386 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.568 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' SER . . . . . 0.468 ' O ' ' HB2' ' B' ' 165' ' ' PHE . 6.3 p -67.17 -48.49 67.81 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' B' ' 164' ' ' SER . 39.8 m-85 71.04 172.61 0.31 Allowed 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.365 0.416 . . . . 0.0 111.541 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -157.02 173.94 16.26 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.51 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.78 77.1 0.86 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.219 0.533 . . . . 0.0 111.374 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.52 -174.8 5.37 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.76 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -153.62 168.3 26.65 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.87 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 7.7 mtpp -161.29 27.63 0.13 Allowed 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 25.42 83.98 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.81 -1.086 . . . . 0.0 112.952 -178.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.167 0 CA-C-O 118.546 -0.74 . . . . 0.0 111.134 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.88 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.709 0 C5'-C4'-O4' 108.649 -0.469 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.672 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C3'-C2'-C1' 101.685 -0.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.672 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C3'-C2'-C1' 104.47 1.264 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.783 ' H71' ' OE2' ' A' ' 47' ' ' GLU . . . . . . . . 0 C3'--C2' 1.528 0.985 0 C1'-O4'-C4' 107.331 -1.692 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.477 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.404 -1.245 0 C3'-C2'-C1' 105.151 1.751 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.49 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.54 0 C4'-C3'-C2' 103.94 0.74 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.516 ' C5 ' ' C4 ' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 C3'-C2'-C1' 105.06 1.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.516 ' C4 ' ' C5 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 C3'-C2'-C1' 101.474 -0.876 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 C1'-O4'-C4' 110.48 0.557 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.547 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -1.009 0 C4'-C3'-C2' 104.689 1.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.547 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 C1'-O4'-C4' 110.421 0.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C1'-O4'-C4' 110.493 0.567 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C4'-C3'-C2' 100.97 -2.23 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.867 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 N19-C1'-C2' 115.639 0.9 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.402 " O5'" " C2'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C4'-C3'-C2' 104.676 1.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.456 ' P ' ' HD3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 O4'-C1'-C2' 107.411 1.192 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.476 H2'' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.411 -0.724 0 C4'-C3'-C2' 104.736 1.536 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.565 ' C8 ' ' C7 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.937 0 C1'-O4'-C4' 107.456 -1.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.565 ' C7 ' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.773 0 C1'-O4'-C4' 106.933 -1.976 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.588 H2'' " O5'" ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 106.856 2.968 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.588 " O5'" H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 104.281 1.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.475 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 C1'-O4'-C4' 110.711 0.722 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.441 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.954 0 C1'-O4'-C4' 107.251 -1.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.628 0 O4'-C1'-C2' 107.26 1.055 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.5 0.813 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C5'-C4'-O4' 108.809 -0.369 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.407 ' CG ' ' H ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.037 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.498 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -143.52 140.53 30.32 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.861 0.362 . . . . 0.0 110.45 178.862 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.617 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 43.2 tp60 -124.96 116.28 21.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.148 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.736 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 2.0 ttm105 -79.11 114.3 17.94 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.668 0.747 . . . . 0.0 111.667 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.592 HD11 ' CD1' ' B' ' 114' ' ' TYR . 4.4 pt -114.62 128.91 71.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.69 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.56 131.73 41.82 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.285 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.677 ' CG2' ' HB ' ' A' ' 9' ' ' VAL . 0.2 OUTLIER -101.22 103.45 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 106.914 -1.514 . . . . 0.0 106.914 174.208 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.655 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 9.7 p -70.36 69.08 0.37 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.715 0.769 . . . . 0.0 109.837 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.677 ' HB ' ' CG2' ' A' ' 7' ' ' VAL . 14.3 p -85.89 -135.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.384 -1.28 . . . . 0.0 111.468 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.705 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 20.4 t70 108.39 20.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.171 0.986 . . . . 0.0 109.607 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.3 t -160.7 -45.69 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.5 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.718 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -79.05 61.39 3.2 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 119.61 -0.836 . . . . 0.0 113.165 -177.317 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.511 ' HB2' ' O ' ' B' ' 129' ' ' SER . 3.7 m 68.19 -7.78 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 177.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.898 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 1.1 t80 -50.29 -57.61 7.48 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.674 1.125 . . . . 0.0 110.348 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.563 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 39.5 mt-30 -49.77 -38.81 35.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.878 -178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.463 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 1.5 mt -51.32 -33.09 27.62 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.917 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.67 -52.55 8.79 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.245 0.545 . . . . 0.0 111.317 178.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.686 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -66.28 -25.5 66.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.388 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 -28.21 62.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.411 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.706 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 6.8 m-30 -88.29 -40.78 13.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.888 178.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.706 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 120.39 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 125.203 1.565 . . . . 0.0 109.496 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.8 t -141.71 -48.15 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.04 0 CA-C-N 114.421 -1.263 . . . . 0.0 111.068 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 67.39 -113.71 0.17 Allowed 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.73 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -143.04 -1.27 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 178.628 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.625 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 63.0 p -39.52 -64.9 0.43 Allowed 'General case' 0 C--O 1.245 0.853 0 CA-C-N 118.901 0.773 . . . . 0.0 110.468 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.552 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -79.0 -29.11 52.65 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.432 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.541 HD23 ' HG ' ' A' ' 17' ' ' LEU . 16.7 tp -62.41 -58.41 7.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.73 HG23 ' HB ' ' A' ' 24' ' ' ILE . 4.0 t -52.17 -71.39 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.396 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.763 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 93.7 p -47.37 -39.36 15.0 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.552 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.3 m -69.67 -48.0 61.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.251 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.3 m -65.34 -32.13 73.62 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.694 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.78 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 11.5 mmt -59.43 -57.42 13.04 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.959 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -55.56 -34.99 65.25 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.547 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -49.38 21.26 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.658 ' HB3' ' CD2' ' B' ' 117' ' ' LEU . 3.4 tp10 -72.15 -21.75 61.41 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.083 0.468 . . . . 0.0 109.776 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.612 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -70.38 -45.35 66.18 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.244 0.545 . . . . 0.0 109.628 178.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -55.02 5.12 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.883 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.17 -35.98 58.9 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.895 -1.048 . . . . 0.0 113.747 -176.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.595 HD22 ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER 28.6 50.56 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.599 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 171.39 107.17 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.622 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -133.37 148.81 51.85 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.181 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -74.84 -159.92 0.1 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.683 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -149.26 81.27 1.42 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.427 ' CE3' ' HA ' ' A' ' 44' ' ' TRP . 1.3 t-105 -112.18 162.78 15.08 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.852 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -88.57 -68.88 0.74 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.874 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.4 p 32.1 76.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.14 0.576 . . . . 0.0 112.403 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -157.7 110.75 2.46 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.437 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 169.18 59.89 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.123 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -140.4 154.25 46.63 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.11 0.481 . . . . 0.0 111.79 -179.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.68 87.49 2.46 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.741 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.68 -131.67 4.26 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.749 -0.738 . . . . 0.0 113.283 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.499 ' HA ' ' O ' ' B' ' 142' ' ' GLU . 0.9 OUTLIER -151.19 141.78 22.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.486 0.184 . . . . 0.0 110.908 -179.759 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.512 ' O ' ' HB3' ' B' ' 143' ' ' ARG . 0.6 OUTLIER 58.99 -157.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.71 -179.703 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -167.16 138.99 3.28 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 122.178 -0.326 . . . . 0.0 111.374 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.404 HG23 ' O ' ' B' ' 145' ' ' LYS . 6.7 t -110.0 -6.04 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 66.22 101.51 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.28 133.92 50.23 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.822 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -177.94 104.38 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.133 0.492 . . . . 0.0 111.779 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.1 mt -91.96 -36.81 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.669 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 56.62 -102.21 0.15 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.77 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 76.06 150.57 0.11 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.072 0.463 . . . . 0.0 111.604 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -138.16 145.62 41.76 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.443 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -90.35 -107.78 1.33 Allowed Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.627 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.0 m -179.81 166.86 1.34 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.699 0.285 . . . . 0.0 111.405 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.2 t80 77.54 153.1 0.14 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.958 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -161.47 131.52 4.9 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.099 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -111.63 69.08 0.68 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.039 0.447 . . . . 0.0 111.821 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.24 -173.99 0.13 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.385 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.07 144.67 47.35 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.151 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.34 39.75 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.562 0.696 . . . . 0.0 109.165 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 35.59 67.4 0.28 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.112 -1.403 . . . . 0.0 112.823 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.0 m95 . . . . . 0 C--O 1.252 1.214 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.863 179.113 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 N-CA-C 111.401 0.148 . . . . 0.0 111.401 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -97.23 160.82 14.11 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.733 0.302 . . . . 0.0 110.937 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.705 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 7.7 tt0 -97.22 108.87 21.69 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.237 0.542 . . . . 0.0 110.942 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.612 ' CZ ' HG22 ' B' ' 106' ' ' THR . 0.3 OUTLIER -78.34 99.09 6.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.428 0.632 . . . . 0.0 110.163 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.634 HG22 ' CD1' ' A' ' 14' ' ' TYR . 3.9 pt -100.34 126.93 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.69 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -131.75 122.85 26.53 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -175.669 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.538 ' HA ' ' P ' ' D' ' 190' ' ' ' DG' . 0.1 OUTLIER -101.01 106.73 19.94 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.499 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.736 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 76.8 p -70.07 98.7 1.35 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.744 HG23 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.73 -124.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.85 -178.22 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.617 ' HB2' ' N ' ' A' ' 3' ' ' GLN . 26.0 t0 95.84 9.99 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 122.098 0.952 . . . . 0.0 108.845 -175.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.4 t -164.51 -43.13 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.985 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.763 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.1 OUTLIER -68.47 52.58 0.08 Allowed 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.153 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.61 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.1 m 56.03 7.97 0.34 Allowed 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.78 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.9 OUTLIER -63.99 -54.6 31.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.973 0.416 . . . . 0.0 111.491 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.555 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.95 -34.17 12.39 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.609 -176.421 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.481 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -52.15 -56.19 16.12 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.145 0.498 . . . . 0.0 110.781 178.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.742 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -55.11 -50.85 68.18 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.031 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.598 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -71.85 -25.6 62.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.36 -179.386 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -58.1 -26.03 62.09 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.063 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.679 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 4.6 m-30 -88.27 -44.43 10.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.65 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.679 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.8 m-20 129.68 38.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.884 1.365 . . . . 0.0 111.284 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 91.0 t -122.74 -44.11 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.011 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.431 ' OD1' ' HE1' ' B' ' 114' ' ' TYR . 0.6 OUTLIER 61.55 -132.61 0.65 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 -178.253 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.697 ' HB ' HG22 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -134.07 8.48 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.744 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.527 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.9 OUTLIER -39.72 -63.99 0.53 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 120.235 -0.586 . . . . 0.0 109.944 -178.023 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.46 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.0 -30.78 13.4 Favored Glycine 0 C--O 1.225 -0.439 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.712 177.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.574 ' HB3' ' CG2' ' B' ' 124' ' ' ILE . 0.0 OUTLIER -52.57 -61.11 2.49 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.638 0.375 . . . . 0.0 110.61 179.038 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.697 HG22 ' HB ' ' B' ' 124' ' ' ILE . 2.4 t -54.27 -64.35 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.544 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.718 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 4.9 p -49.22 -44.8 43.71 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.75 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.46 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -69.91 -53.72 16.67 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 121.767 -0.583 . . . . 0.0 109.843 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.9 -37.81 74.7 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.52 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.917 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -49.19 -46.46 45.58 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.328 179.138 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -48.37 80.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.584 0.23 . . . . 0.0 111.35 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -58.14 -56.54 20.73 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.485 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' B' ' 139' ' ' LEU . 1.7 mm-40 -59.98 -40.13 88.06 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.463 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -60.04 -44.33 94.73 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.605 178.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -56.51 7.7 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.315 0.579 . . . . 0.0 111.339 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' B' ' 140' ' ' ARG . 0.0 OUTLIER -68.05 -18.02 64.56 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.125 -177.39 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.562 HD12 ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -54.8 75.6 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -179.548 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' B' ' 138' ' ' ARG . 0.2 OUTLIER -174.84 -59.29 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.417 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -179.68 154.87 0.62 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.966 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.499 ' O ' ' HA ' ' A' ' 52' ' ' MET . 0.4 OUTLIER -108.06 111.04 22.88 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.865 0.364 . . . . 0.0 111.22 -179.964 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 53' ' ' VAL . 0.0 OUTLIER 77.7 -161.6 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.37 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.458 ' CD1' ' HG2' ' B' ' 145' ' ' LYS . 0.1 OUTLIER -168.4 140.2 2.79 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -178.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.458 ' HG2' ' CD1' ' B' ' 144' ' ' TRP . 3.6 mmtp 73.01 96.1 0.07 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.995 179.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.7 p -102.94 127.43 56.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.052 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -155.13 155.0 33.2 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.201 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 178.39 101.63 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.703 0.287 . . . . 0.0 111.68 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -135.37 107.76 7.32 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.898 0.38 . . . . 0.0 111.162 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.16 170.81 15.96 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.756 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 167.86 158.61 12.21 Favored Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.425 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 1.6 mtm -145.89 166.07 27.05 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.734 0.302 . . . . 0.0 111.227 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 9.6 p -152.5 153.46 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.635 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -116.24 -171.5 2.01 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.09 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 2.9 t -117.47 -125.59 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.631 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -179.88 102.38 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.871 0.367 . . . . 0.0 111.454 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -98.21 130.07 44.95 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.212 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -178.05 105.35 0.05 OUTLIER 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.09 0.471 . . . . 0.0 110.735 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -105.73 -132.35 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.805 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -147.74 167.18 25.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 32.2 ttp -128.19 -48.22 1.33 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.331 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.3 -167.65 0.19 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.711 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 175.83 -176.79 47.6 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 120.692 -0.765 . . . . 0.0 113.129 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.2 m -178.17 162.45 1.58 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.624 0.25 . . . . 0.0 111.358 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -154.9 170.39 21.8 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.262 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -145.16 172.53 12.98 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.989 0.424 . . . . 0.0 111.595 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -97.73 -125.43 0.14 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.437 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -147.16 24.98 1.13 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' B' ' 170' ' ' LYS . 0.1 OUTLIER 56.01 -93.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 122.615 0.366 . . . . 0.0 111.962 179.533 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 0.1 OUTLIER 169.16 -30.28 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.423 0.63 . . . . 0.0 109.352 -179.654 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.487 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 15.7 m-20 76.66 -87.58 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.016 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 2.8 t-105 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.594 -0.717 . . . . 0.0 111.052 179.196 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.876 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-N19 108.193 0.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.656 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.494 0 C4'-C3'-C2' 102.52 -0.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.656 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.433 -0.443 0 C3'-C2'-C1' 104.512 1.294 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.655 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.742 0 C4'-C3'-C2' 104.293 1.093 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.527 ' OP1' ' HB2' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.427 -0.792 0 C3'-C2'-C1' 104.218 1.084 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.472 ' C7 ' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.804 0 C4'-C3'-C2' 104.721 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.627 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.559 0 C3'-C2'-C1' 104.704 1.432 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.745 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 C3'-C2'-C1' 101.007 -1.209 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.745 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C1'-O4'-C4' 110.649 0.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.623 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.826 0 C3'-C2'-C1' 104.951 1.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.623 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 O4'-C1'-C2' 106.799 0.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.44 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.709 0 N19-C1'-C2' 115.065 0.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 C4'-C3'-C2' 100.896 -2.304 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.874 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 N19-C1'-C2' 115.347 0.717 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 C3'-C2'-C1' 105.227 1.805 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.486 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 C4'-C3'-C2' 102.637 -0.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.62 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C4'-C3' 103.822 -1.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.625 ' OP1' ' HA ' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.409 -0.852 0 C4'-C3'-C2' 104.607 1.407 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.631 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 C2'--C1' 1.512 -0.657 0 C5'-C4'-O4' 108.316 -0.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.433 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.703 0 C3'-C2'-C1' 105.184 1.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.482 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 N19-C1'-C2' 115.525 0.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.877 0 C3'-C2'-C1' 105.148 1.748 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.894 0 C4'-C3'-C2' 104.552 1.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.404 ' C8 ' ' H72' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 O4'-C1'-C2' 107.037 0.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.404 ' H72' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 N19-C1'-C2' 115.459 0.787 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 102.143 -0.398 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.828 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.439 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 11.1 mmtm -36.79 129.6 0.81 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.254 0.346 . . . . 0.0 111.509 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.4 tp60 -101.75 118.46 36.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.631 0.729 . . . . 0.0 112.087 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.803 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.39 101.03 7.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.94 -179.532 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.586 ' CD1' ' CD2' ' B' ' 114' ' ' TYR . 8.3 pt -104.52 128.79 57.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.683 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -131.56 124.59 30.35 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.882 -177.273 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.536 HG23 ' HA ' ' B' ' 125' ' ' SER . 0.2 OUTLIER -101.25 105.0 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 174.792 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.469 ' OG1' ' C6 ' ' C' ' 176' ' ' ' DT' . 9.9 p -69.14 87.77 0.41 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -178.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.635 ' CB ' ' HB3' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -86.78 -139.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.16 -178.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.663 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 2.4 t70 87.22 -5.15 0.64 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -175.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.53 -67.7 0.94 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.117 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.787 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 1.1 m-20 -49.55 -87.45 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m -177.43 42.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.174 0.897 . . . . 0.0 111.751 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.855 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -82.53 -44.56 15.76 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.636 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.1 mp0 -49.67 -40.39 39.71 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -176.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.635 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -57.09 -54.0 51.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.736 0.698 . . . . 0.0 111.995 -179.503 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.863 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -49.54 -48.06 48.6 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.282 0.563 . . . . 0.0 111.387 -178.871 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.636 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.13 -30.41 43.68 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.045 179.274 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -63.78 -27.43 69.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.175 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.612 ' HB2' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.69 -44.77 10.93 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-O 118.765 -0.636 . . . . 0.0 109.399 178.816 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.599 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 157.28 16.46 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 177.028 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.496 ' HB ' ' CZ ' ' A' ' 20' ' ' TYR . 70.9 t -156.85 90.37 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 118.265 0.484 . . . . 0.0 111.973 -177.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 0.1 OUTLIER -56.78 -100.1 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.338 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.72 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -139.97 1.26 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.543 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 88.0 p -41.89 -65.26 0.47 Allowed 'General case' 0 C--O 1.239 0.519 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.866 -178.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.93 -25.88 43.54 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.813 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.579 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -62.17 -59.41 5.08 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.72 HG23 ' HB ' ' A' ' 24' ' ' ILE . 2.2 t -52.77 -66.25 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.713 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.743 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 18.1 p -48.74 -35.59 14.51 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.5 m -72.88 -56.26 5.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.541 HG21 ' HA ' ' A' ' 28' ' ' VAL . 3.1 t -58.74 -36.64 74.67 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.126 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.789 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -55.53 -55.37 32.65 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.641 178.775 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -56.19 -53.49 56.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.589 0.233 . . . . 0.0 110.782 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -57.69 -46.91 83.69 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.437 ' O ' ' CA ' ' A' ' 39' ' ' LEU . 3.2 tp10 -70.23 -19.89 63.12 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.353 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -77.38 -44.48 29.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -54.74 7.61 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.564 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.33 -36.46 24.39 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.741 -176.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.529 HD22 HG12 ' B' ' 122' ' ' VAL . 0.3 OUTLIER 36.46 46.92 0.46 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.812 0.445 . . . . 0.0 112.178 -178.366 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -177.69 48.86 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.046 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -77.8 153.16 33.09 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.055 0.455 . . . . 0.0 112.018 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -93.37 173.32 7.77 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.686 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.73 122.66 48.41 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.657 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -99.94 164.57 11.95 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.803 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.88 135.58 26.18 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.888 0.375 . . . . 0.0 111.654 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.423 ' H ' ' HG3' ' B' ' 137' ' ' ARG . 12.5 t -153.79 154.35 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.551 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -61.91 151.93 33.38 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.593 0.235 . . . . 0.0 110.658 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -74.62 -80.1 0.08 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.46 -179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.428 ' O ' ' HB1' ' B' ' 141' ' ' ALA . 0.0 OUTLIER 56.3 86.94 0.06 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -100.17 128.76 46.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.189 0.518 . . . . 0.0 111.652 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.53 -167.12 24.88 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.859 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.562 ' O ' ' HB ' ' A' ' 53' ' ' VAL . 0.7 OUTLIER -125.66 -72.82 0.65 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.557 0.178 . . . . 0.0 111.156 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.562 ' HB ' ' O ' ' A' ' 52' ' ' MET . 14.6 p 165.3 151.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 120.964 0.411 . . . . 0.0 111.622 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.405 ' HB3' ' CE3' ' B' ' 144' ' ' TRP . 8.7 pt-20 -122.77 139.32 54.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.662 178.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.0 t -135.16 -122.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 121.227 -0.189 . . . . 0.0 111.466 -178.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 67.85 73.57 0.31 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.109 0.48 . . . . 0.0 111.645 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.52 139.93 33.36 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.173 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -159.11 97.84 1.41 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.6 0.714 . . . . 0.0 110.818 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 27.8 mm -141.81 82.83 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.106 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -135.52 65.92 1.53 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.833 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 12.4 ptm -159.77 167.63 27.79 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.504 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 76.9 165.96 0.25 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.693 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -148.72 -134.54 2.41 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.819 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.5 t -173.43 -161.73 0.14 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.659 0.229 . . . . 0.0 111.44 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 71.07 -179.49 0.23 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.725 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -132.26 36.7 3.6 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.792 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.39 72.53 10.22 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.085 0.469 . . . . 0.0 110.181 179.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 64.87 -171.05 0.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.348 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -175.12 -87.33 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.438 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER 176.43 -31.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.196 0.522 . . . . 0.0 109.896 -179.33 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 85.2 -53.9 0.09 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.572 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.6 m0 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.262 179.767 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.483 ' O ' ' C ' ' B' ' 102' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 111.381 0.141 . . . . 0.0 111.381 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.483 ' C ' ' O ' ' B' ' 101' ' ' MET . 0.0 OUTLIER -7.56 100.22 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -179.502 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.663 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 17.1 tt0 -98.41 115.18 27.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.799 178.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.701 ' NE ' ' H62' ' C' ' 179' ' ' ' DA' . 28.7 ttt-85 -77.52 101.93 6.7 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.226 -0.589 . . . . 0.0 110.461 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.595 HG23 ' CG ' ' A' ' 14' ' ' TYR . 1.8 pt -102.62 130.21 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.657 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.683 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.4 OUTLIER -131.26 121.59 25.04 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.056 -0.657 . . . . 0.0 111.823 -176.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.552 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.8 OUTLIER -101.28 91.59 2.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.085 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 176.127 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.803 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 31.9 p -60.85 90.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.505 0.669 . . . . 0.0 110.385 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.654 ' CG2' ' CD1' ' B' ' 114' ' ' TYR . 31.6 m -87.5 -148.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.885 -177.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.486 ' HA ' ' CD ' ' B' ' 115' ' ' GLN . 23.7 t70 96.04 -10.33 0.09 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.371 1.069 . . . . 0.0 108.342 -176.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 58.4 m -118.15 -62.9 1.49 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 176.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.743 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.4 OUTLIER -42.03 -92.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.662 0.601 . . . . 0.0 112.34 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.474 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.2 m -180.0 41.18 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.724 -0.61 . . . . 0.0 110.765 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.789 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.2 OUTLIER -83.04 -45.2 14.32 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.584 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.7 mp0 -49.18 -45.27 43.83 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.8 -28.02 14.22 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.759 0.709 . . . . 0.0 112.356 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.628 ' CD1' HD13 ' B' ' 127' ' ' LEU . 0.6 OUTLIER -78.33 -57.25 3.88 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 120.113 -0.635 . . . . 0.0 111.329 178.111 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -62.36 -25.43 67.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.337 178.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.39 -27.06 34.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.004 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.626 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.5 m-30 -88.18 -49.56 6.93 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.644 178.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.626 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.9 m-20 139.4 46.14 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 O-C-N 124.407 1.067 . . . . 0.0 110.675 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.544 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 4.0 p -163.14 89.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.725 0.774 . . . . 0.0 110.783 -178.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.491 ' HB3' HD11 ' B' ' 124' ' ' ILE . 74.6 m-80 -58.41 -98.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.722 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.759 HG13 ' HE3' ' A' ' 32' ' ' MET . 0.2 OUTLIER -152.55 9.73 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.544 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 2.1 p -39.59 -64.7 0.45 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.144 -177.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.557 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.13 -28.5 20.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.628 HD13 ' CD1' ' B' ' 117' ' ' LEU . 0.1 OUTLIER -55.48 -61.43 2.35 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.485 0.314 . . . . 0.0 110.783 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.704 HG22 HG21 ' A' ' 24' ' ' ILE . 2.1 t -53.59 -62.7 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.602 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.808 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.787 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 2.3 p -50.13 -43.69 51.99 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.557 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.5 OUTLIER -70.16 -50.27 42.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.457 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.442 ' N ' ' CG2' ' B' ' 130' ' ' THR . 54.8 m -55.9 -43.46 77.29 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.51 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.863 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 4.6 mtt -61.08 -57.63 11.74 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.897 178.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -40.39 37.21 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.067 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -56.04 12.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.242 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.541 ' HB2' HD22 ' A' ' 17' ' ' LEU . 14.0 mm-40 -69.41 -13.45 62.37 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.544 0.211 . . . . 0.0 111.293 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.635 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -86.49 -38.18 17.52 Favored 'General case' 0 C--O 1.227 -0.1 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.423 ' HG3' ' H ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -72.75 -47.61 45.4 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.506 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.3 ttp85 -55.83 -29.47 59.87 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.075 -1.42 . . . . 0.0 110.613 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.612 HD11 ' HB2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -35.81 96.06 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.8 0.84 . . . . 0.0 111.521 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.2 123.68 24.14 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -178.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' A' ' 49' ' ' GLN . . . -164.5 -174.14 3.33 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.41 ' HA ' ' NE2' ' A' ' 49' ' ' GLN . 0.4 OUTLIER -135.99 -98.92 0.22 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -179.407 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.409 ' NE ' ' OE1' ' A' ' 49' ' ' GLN . 9.1 mtm180 -162.19 126.28 3.17 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.493 0.187 . . . . 0.0 111.366 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.405 ' CE3' ' HB3' ' A' ' 54' ' ' GLU . 2.5 t90 69.7 132.3 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.704 179.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.463 ' HG3' ' HB2' ' A' ' 52' ' ' MET . 0.2 OUTLIER -161.31 116.58 2.09 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -152.34 154.79 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.804 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.54 173.9 14.14 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.969 0.414 . . . . 0.0 112.041 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.5 105.71 1.28 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.689 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.8 pm0 -102.95 138.29 40.02 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.683 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -149.6 164.8 34.15 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.185 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 152.57 126.55 1.2 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 120.838 -0.696 . . . . 0.0 113.104 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.7 ttt -153.28 134.12 13.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.512 0.196 . . . . 0.0 111.096 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 32.7 t -141.94 140.22 30.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.784 0.326 . . . . 0.0 111.505 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -153.91 154.35 33.7 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.971 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.3 t -131.4 -125.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 116.741 -0.209 . . . . 0.0 110.764 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 168.68 105.99 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 122.73 0.412 . . . . 0.0 111.253 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -90.56 153.65 20.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.221 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -164.22 98.42 0.82 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.29 0.567 . . . . 0.0 111.271 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 9.9 mm -120.87 95.31 3.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.428 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -134.71 167.06 21.53 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.072 0.463 . . . . 0.0 111.985 -179.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 20.1 ttp -148.8 -53.63 0.18 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.026 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 70.92 -178.65 0.22 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.915 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 156.74 165.06 14.22 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.574 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.4 t -155.19 148.36 24.79 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.812 0.339 . . . . 0.0 111.684 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -171.85 143.5 1.64 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.876 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -153.07 117.95 5.08 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.347 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -72.6 -53.13 12.72 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.344 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 55.32 36.31 26.79 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.038 0.447 . . . . 0.0 111.565 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -115.12 121.66 43.73 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.483 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -167.34 -39.12 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 9.1 t70 79.74 -68.69 0.12 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.326 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.267 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.008 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.888 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 C5'-C4'-O4' 108.701 -0.437 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.559 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C3'-C2'-C1' 101.346 -0.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.571 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 C3'-C2'-C1' 104.232 1.094 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.47 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.802 0 C3'-C2'-C1' 104.914 1.582 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.594 ' N7 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 C3'-C2'-C1' 105.11 1.721 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.594 ' H72' ' N7 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.776 0 C4'-C3'-C2' 104.69 1.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.701 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 C3'-C2'-C1' 104.221 1.086 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.543 " O5'" H2'' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 C3'-C2'-C1' 100.826 -1.339 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.407 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C1'-O4'-C4' 110.903 0.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.528 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 105.488 1.991 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.528 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-C2' 107.2 1.0 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.503 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C1'-O4'-C4' 110.388 0.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C4'-C3'-C2' 100.878 -2.322 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.885 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 O4'-C1'-C2' 107.289 1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.459 ' OP1' H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 OP1-P-O3' 110.545 0.983 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.498 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.755 0 C4'-C3'-C2' 102.119 -1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.763 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.43 0.79 0 O4'-C4'-C3' 103.99 -1.61 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.763 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.408 -0.921 0 C1'-O4'-C4' 107.727 -1.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.673 ' H71' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C4'-C3'-C2' 103.989 0.789 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.462 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 106.358 2.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.494 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 C1'-O4'-C4' 110.345 0.461 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.472 ' C5 ' ' C5 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 C4'-C3'-C2' 104.301 1.101 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.472 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.99 0 C1'-O4'-C4' 107.108 -1.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.484 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 104.412 1.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.882 0 O4'-C1'-C2' 104.749 -1.229 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.571 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C1'-O4'-C4' 110.333 0.452 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.59 ' HG3' ' HG2' ' A' ' 2' ' ' LYS . 9.6 ptm . . . . . 0 N--CA 1.498 1.93 0 CA-C-O 119.685 -0.198 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.59 ' HG2' ' HG3' ' A' ' 1' ' ' MET . 36.3 mmtt 79.88 174.41 0.14 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.485 0.314 . . . . 0.0 110.5 -179.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.607 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 0.5 OUTLIER -102.72 101.8 11.93 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.711 0.767 . . . . 0.0 112.07 -179.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.892 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.2 ttp-105 -79.68 98.85 7.13 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.919 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.652 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -107.42 108.77 26.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.727 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.264 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.567 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -103.77 123.9 47.91 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.068 -176.33 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.469 HG13 HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.63 105.83 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.397 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.2 p -70.23 90.63 0.69 Allowed 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.013 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.593 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 2.7 t -83.28 -134.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.494 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.506 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 26.8 t70 90.56 -5.79 0.3 Allowed 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.23 -58.56 0.59 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.27 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.727 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -43.65 -92.08 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.491 ' N ' ' HB3' ' B' ' 129' ' ' SER . 0.6 OUTLIER -179.02 37.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.388 0.995 . . . . 0.0 112.034 -179.396 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.758 ' CE1' ' HG2' ' B' ' 103' ' ' GLN . 0.0 OUTLIER -82.76 -43.75 16.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.083 0.953 . . . . 0.0 112.56 179.472 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.603 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 38.6 mt-30 -50.05 -44.12 51.4 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.619 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 1.2 mt -48.1 -30.4 4.46 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.267 0.485 . . . . 0.0 112.291 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.769 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -78.26 -57.35 3.83 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.408 177.518 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.603 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -63.18 -25.49 68.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.842 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -26.31 33.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.335 178.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.564 ' CD2' HD21 ' B' ' 139' ' ' LEU . 9.6 m-30 -87.85 -40.62 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.557 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.3 t0 120.91 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 122.34 1.067 . . . . 0.0 111.086 177.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.495 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 8.1 p -151.49 92.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.852 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.537 ' O ' HD13 ' A' ' 24' ' ' ILE . 1.7 m120 -65.75 48.8 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.46 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.761 HG12 ' CE ' ' B' ' 132' ' ' MET . 1.3 pp 31.68 9.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.591 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 67.2 m -36.47 -63.06 0.42 Allowed 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.036 0.446 . . . . 0.0 111.252 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -17.38 70.27 Favored Glycine 0 C--N 1.335 0.493 0 CA-C-N 115.848 -0.614 . . . . 0.0 112.62 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.567 ' CB ' HG21 ' A' ' 24' ' ' ILE . 2.3 tm? -67.54 -61.21 2.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.67 ' O ' ' HG2' ' A' ' 32' ' ' MET . 87.2 t -45.02 -67.67 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.361 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.516 ' HA ' ' HG2' ' A' ' 32' ' ' MET . 1.2 p -48.43 -36.92 15.81 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.581 0.752 . . . . 0.0 112.396 178.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.6 m -68.54 -52.75 28.55 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.7 m -55.95 -35.71 66.98 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.756 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.843 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 1.3 mmt -56.94 -55.03 39.91 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.983 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.513 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -56.09 -49.91 72.5 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.745 0.307 . . . . 0.0 111.259 179.844 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -59.6 -51.44 69.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.871 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.7 ' HB3' HD13 ' B' ' 117' ' ' LEU . 5.2 tp10 -74.13 -14.89 61.03 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.392 178.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.776 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -84.26 -32.7 24.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -52.03 13.31 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.772 0.796 . . . . 0.0 109.475 178.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.41 ' NE ' ' HB3' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -82.96 -40.21 20.36 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.506 -178.147 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.532 HD22 ' CD2' ' B' ' 120' ' ' TYR . 1.2 mp 46.46 61.49 2.74 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.233 0.613 . . . . 0.0 110.933 -178.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 0.1 OUTLIER 173.61 76.39 0.0 OUTLIER 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.88 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -142.56 130.39 21.65 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 112.039 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -143.93 132.17 21.91 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.173 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -172.08 115.56 0.35 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.554 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -146.63 125.53 12.73 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.883 0.373 . . . . 0.0 111.509 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.22 127.35 0.56 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.31 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.3 t 77.67 150.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 121.248 0.547 . . . . 0.0 111.904 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -142.42 -175.62 4.52 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.73 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.474 ' OD1' ' HG ' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -152.5 140.15 19.83 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 120.789 0.328 . . . . 0.0 111.325 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.564 ' O ' ' HB3' ' A' ' 50' ' ' GLU . 0.3 OUTLIER -95.16 -174.38 3.21 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.41 179.042 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.564 ' HB3' ' O ' ' A' ' 49' ' ' GLN . 1.1 pp20? 113.9 164.29 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.896 1.279 . . . . 0.0 112.008 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 170.9 154.59 9.75 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.951 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.68 -175.89 3.26 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.344 0.257 . . . . 0.0 110.907 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.7 m -134.32 134.02 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 120.795 0.331 . . . . 0.0 111.723 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -120.61 144.39 48.15 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.061 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.8 t -128.13 -123.87 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.017 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 75.06 103.99 0.07 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.011 0.434 . . . . 0.0 111.449 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -101.6 138.4 38.64 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.88 0.371 . . . . 0.0 111.795 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -178.38 106.86 0.05 OUTLIER 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.763 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 35.1 mm -131.5 102.79 6.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.494 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.495 ' HB3' ' OP1' ' C' ' 182' ' ' ' DC' . 1.5 tt0 -139.66 122.17 16.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.715 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.53 156.66 46.41 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.372 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -102.34 177.04 4.98 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.38 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -94.51 -147.0 21.7 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.968 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 82.9 p -165.12 174.77 9.99 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.719 0.295 . . . . 0.0 111.028 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.34 151.76 35.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.035 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.9 145.74 44.42 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.414 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.79 -72.53 0.71 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 53.19 70.39 0.59 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.011 0.434 . . . . 0.0 111.727 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -104.71 179.4 4.28 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.194 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -162.1 -42.07 0.04 OUTLIER 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 69.73 -65.89 0.29 Allowed 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 113.92 -1.491 . . . . 0.0 112.015 178.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 2.4 m0 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.891 179.883 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.46 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' B' ' 101' ' ' MET . 1.4 mmpt? 74.18 127.97 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 122.678 0.391 . . . . 0.0 110.868 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.758 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 4.5 tp60 -115.27 116.52 28.45 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.208 0.528 . . . . 0.0 110.648 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.43 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.02 111.08 14.86 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.083 -178.607 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.708 HG23 ' CD2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -115.31 118.84 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 175.844 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.652 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -123.98 131.19 53.53 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 120.285 -0.566 . . . . 0.0 111.722 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.64 HG23 ' HB ' ' A' ' 28' ' ' VAL . 0.9 OUTLIER -101.23 86.45 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.892 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 68.2 p -64.88 77.1 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 -179.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.66 HG12 ' HB2' ' B' ' 114' ' ' TYR . 7.2 p -108.92 -120.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.893 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.607 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 1.1 t70 94.47 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.963 1.363 . . . . 0.0 109.506 -176.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 45.7 t -154.46 -52.45 0.09 Allowed 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 112.507 -2.133 . . . . 0.0 111.845 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' A' ' 29' ' ' SER . 55.1 m-20 -75.33 54.14 0.7 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -177.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.513 ' OG ' ' HB2' ' A' ' 33' ' ' GLN . 2.4 m 70.48 -3.31 1.92 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.843 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 0.3 OUTLIER -55.1 -53.92 49.75 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.482 0.583 . . . . 0.0 111.204 179.491 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.555 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 14.3 mt-30 -49.85 -42.79 48.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -177.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.776 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -52.09 -31.38 30.32 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.428 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.755 ' CD1' ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -77.75 -53.69 7.23 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.603 179.403 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.555 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.6 -28.11 68.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -58.57 -29.87 66.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.213 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.606 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.9 OUTLIER -88.5 -43.02 11.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.372 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.606 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 151.39 31.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 176.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.445 ' CG2' ' O ' ' B' ' 121' ' ' ASP . 74.5 t -162.37 97.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.407 0.146 . . . . 0.0 111.08 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.507 ' O ' ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.1 -83.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 178.09 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.746 HG13 ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -165.2 3.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 178.543 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.688 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 7.0 p -38.24 -63.74 0.47 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.39 0.995 . . . . 0.0 111.19 -177.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -84.81 -29.47 29.0 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.195 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.682 HD21 HD13 ' B' ' 117' ' ' LEU . 14.2 tp -59.72 -59.87 4.75 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.692 HG21 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -50.97 -59.69 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.727 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.1 m -50.03 -40.32 44.53 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 17.7 m -71.07 -53.01 16.18 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.493 HG23 ' O ' ' B' ' 128' ' ' VAL . 4.9 t -59.6 -36.97 77.34 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.857 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.769 ' SD ' ' HG ' ' A' ' 17' ' ' LEU . 3.5 mmt -60.6 -58.3 9.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.892 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.467 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 1.8 tt0 -55.67 -39.99 71.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.445 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -49.63 55.74 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.311 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.448 ' HA ' ' OE1' ' B' ' 135' ' ' GLU . 3.7 mm-40 -69.87 -26.99 64.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.619 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -63.93 -48.17 77.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 176.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -53.92 49.0 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.276 -0.875 . . . . 0.0 108.833 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -38.5 60.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.289 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.564 HD21 ' CD2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -51.67 -22.32 3.35 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.286 178.908 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.549 ' HB2' ' O ' ' B' ' 139' ' ' LEU . 24.8 mmt85 86.85 111.92 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.595 0.758 . . . . 0.0 112.118 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -145.15 90.73 2.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.77 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -149.52 -69.09 0.21 Allowed 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.654 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.515 ' C ' ' HD3' ' B' ' 143' ' ' ARG . 0.0 OUTLIER 69.65 -59.85 0.49 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.499 -179.246 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.482 ' HB2' ' HD3' ' B' ' 143' ' ' ARG . 0.3 OUTLIER 173.99 -177.4 0.08 Allowed 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.679 0.276 . . . . 0.0 111.212 -179.48 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 79.98 139.95 0.07 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.132 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -154.83 -56.53 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.335 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.03 -152.46 0.16 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.75 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -125.74 145.81 50.03 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.617 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -66.9 169.47 8.1 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 120.923 0.392 . . . . 0.0 111.268 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . 0.434 ' HG2' ' N ' ' B' ' 151' ' ' GLY . 1.7 pm0 -64.98 -39.08 92.94 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.532 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . 0.434 ' N ' ' HG2' ' B' ' 150' ' ' GLU . . . 94.59 -93.66 1.68 Allowed Glycine 0 C--N 1.335 0.483 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.117 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.43 166.31 31.28 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.661 0.267 . . . . 0.0 111.318 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 66.6 t -142.06 120.22 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.486 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -62.18 122.02 14.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.59 -3.69 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 70.8 29.57 3.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.653 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.86 112.08 13.08 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.08 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -118.5 28.62 8.22 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 111.663 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 55.7 mt -145.02 -109.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.606 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -168.2 159.98 11.29 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.917 0.389 . . . . 0.0 111.197 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 3.5 mtm -126.91 -52.56 1.43 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.32 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 174.9 70.73 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.75 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -114.54 70.3 0.25 Allowed Glycine 0 C--N 1.333 0.374 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.936 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 23.3 t -145.12 -164.45 1.94 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.771 0.319 . . . . 0.0 111.32 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -125.53 101.4 6.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.266 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -168.89 -78.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.889 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 62.1 -71.71 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 69.26 169.44 0.29 Allowed 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.185 0.517 . . . . 0.0 111.292 -179.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . 0.592 ' O ' ' HB2' ' B' ' 170' ' ' LYS . 44.0 m-80 -131.51 -98.36 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.6 ' HE2' ' CA ' ' B' ' 170' ' ' LYS . 0.0 OUTLIER 163.35 -26.88 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.296 0.638 . . . . 0.0 109.424 178.69 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 13.7 t70 85.4 -58.21 0.08 Allowed 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.917 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.107 -0.949 . . . . 0.0 111.183 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.883 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C4'-C3' 106.148 0.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.514 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 C3'-C2'-C1' 101.539 -0.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.461 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 O4'-C1'-C2' 107.421 1.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.589 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.969 0 C1'-O4'-C4' 106.448 -2.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.688 ' P ' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O4'--C1' 1.406 -1.045 0 C3'-C2'-C1' 105.108 1.72 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.598 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C4'-C3'-C2' 104.401 1.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.78 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 106.845 2.961 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.78 " O5'" H2'' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 C4'-C3'-C2' 102.471 -0.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.635 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-C2' 107.183 0.984 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.495 ' OP1' ' HB3' ' A' ' 60' ' ' GLU . . . . . . . . 0 O4'--C1' 1.409 -0.878 0 C3'-C2'-C1' 105.372 1.908 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.617 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O4'-C1'-C2' 107.274 1.067 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.617 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 C4'-C3'-C2' 104.073 0.873 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 C4'-C3'-C2' 100.929 -2.271 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.878 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 C1'-O4'-C4' 110.896 0.854 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.433 ' C6 ' ' C7 ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 C4'-C3'-C2' 102.689 -0.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.64 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 O4'-C1'-C2' 107.291 1.083 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.64 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.594 0 C1'-O4'-C4' 110.428 0.52 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.591 ' OP2' ' HA ' ' B' ' 107' ' ' VAL . . . . . . . . 0 O4'--C1' 1.406 -1.056 0 C3'-C2'-C1' 104.868 1.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.541 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-C2' 107.25 1.045 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.477 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 107.372 1.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.434 ' C4 ' ' C5 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 O4'-C4'-C3' 106.285 0.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.457 ' C5 ' ' C5 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.802 0 C4'-C3'-C2' 104.715 1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.457 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.995 0 C1'-O4'-C4' 107.463 -1.598 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 C1'-O4'-C4' 110.874 0.839 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.796 0 C4'-C3'-C2' 104.26 1.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.418 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C1'-O4'-C4' 110.339 0.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 120.451 0.167 . . . . 0.0 111.396 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 10.0 mmtt -96.27 -173.7 2.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.857 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.467 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -110.41 106.38 15.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.858 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.1 ttm105 -78.62 102.32 7.91 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.247 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.629 ' O ' ' HA ' ' B' ' 106' ' ' THR . 4.5 pt -104.0 130.12 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.742 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.06 126.07 34.88 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.052 0.453 . . . . 0.0 111.681 -176.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.553 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -99.67 106.7 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.62 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.461 ' O ' ' HD3' ' B' ' 102' ' ' LYS . 1.8 p -70.21 73.93 0.49 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.418 0.628 . . . . 0.0 109.388 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.709 ' CG2' ' HB3' ' A' ' 14' ' ' TYR . 7.3 p -76.85 -135.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.411 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.67 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 16.0 t70 89.07 -7.31 0.44 Allowed 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.064 1.302 . . . . 0.0 108.964 -176.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 67.8 m -132.13 -54.77 0.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.404 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.747 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 0.6 OUTLIER -46.14 -93.39 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.432 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.2 OUTLIER -178.32 38.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 118.964 0.802 . . . . 0.0 111.288 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.709 ' HB3' ' CG2' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.2 -41.85 17.95 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.318 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.663 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.6 mm100 -48.79 -40.6 29.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -173.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.709 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -57.58 -52.12 66.69 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 119.031 0.832 . . . . 0.0 112.141 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.816 HD21 ' SD ' ' B' ' 132' ' ' MET . 1.5 tp -61.66 -36.48 80.95 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 119.805 -0.758 . . . . 0.0 112.971 -177.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.663 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -79.89 -29.3 39.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.509 0.671 . . . . 0.0 110.737 177.71 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.538 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -75.19 -32.16 61.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.851 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.753 ' CE1' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -87.63 -41.92 13.06 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.655 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.614 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 165.42 12.36 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 176.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.6 t -155.79 86.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 118.377 0.535 . . . . 0.0 111.354 -177.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.515 ' HB2' HD13 ' A' ' 24' ' ' ILE . 4.9 p30 -58.9 -95.1 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.725 ' HB ' HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.81 -0.31 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 177.825 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.58 ' HB3' ' P ' ' D' ' 190' ' ' ' DG' . 73.7 p -41.38 -64.36 0.57 Allowed 'General case' 0 C--O 1.244 0.796 0 C-N-CA 119.126 -1.029 . . . . 0.0 109.22 -179.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.439 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.06 -29.0 24.11 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.121 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.626 HD13 ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -56.06 -61.86 2.1 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 116.812 0.306 . . . . 0.0 110.81 179.518 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.725 HG22 ' HB ' ' A' ' 24' ' ' ILE . 2.5 t -52.33 -61.6 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.163 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.693 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.5 p -50.25 -48.62 54.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.439 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.11 -51.3 25.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.476 ' HB ' ' O ' ' A' ' 27' ' ' LEU . 2.6 m -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.311 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.855 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 16.7 mtt -61.65 -49.95 74.47 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.986 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.478 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.69 -43.58 80.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.334 0.515 . . . . 0.0 109.862 178.731 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.478 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -66.07 -48.06 72.21 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.644 ' HB3' ' CD2' ' B' ' 117' ' ' LEU . 3.9 tp10 -64.37 -30.05 71.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.887 177.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.557 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -69.47 -49.52 54.1 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 177.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.39 -51.47 66.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.736 0.779 . . . . 0.0 109.004 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.524 ' O ' ' HG3' ' A' ' 40' ' ' ARG . 2.0 mtm-85 -63.01 -58.35 7.6 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 113.918 -1.492 . . . . 0.0 111.406 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.669 HD13 ' CB ' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 15.1 64.87 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.555 1.142 . . . . 0.0 113.798 179.918 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.558 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER 158.43 60.88 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.898 0.879 . . . . 0.0 110.699 178.825 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.08 135.14 53.96 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.01 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -124.03 134.56 53.4 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.207 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.43 165.41 3.24 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.819 0.342 . . . . 0.0 111.638 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.486 ' CE3' ' HA ' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -104.39 -163.17 0.95 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.98 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.16 137.35 32.43 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.79 0.328 . . . . 0.0 111.472 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.0 p -167.07 142.12 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.517 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.12 162.89 0.18 Allowed 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.685 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -175.53 -68.69 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.459 ' HB3' ' NH1' ' B' ' 137' ' ' ARG . 5.5 mt-30 68.74 168.21 0.28 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.152 0.501 . . . . 0.0 111.575 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.19 177.1 7.93 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.806 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.442 ' O ' ' NH2' ' B' ' 137' ' ' ARG . . . 69.36 -168.74 45.07 Favored Glycine 0 C--N 1.335 0.503 0 CA-C-N 115.83 -0.623 . . . . 0.0 113.646 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.456 ' SD ' HD23 ' A' ' 16' ' ' LEU . 11.3 ttt -146.8 145.5 29.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.622 0.249 . . . . 0.0 110.793 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.481 ' CG1' ' HB2' ' B' ' 142' ' ' GLU . 48.5 t -123.27 146.77 28.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.335 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.5 -179.27 7.12 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.16 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.641 ' HA ' ' CB ' ' B' ' 141' ' ' ALA . 11.5 t -105.25 -120.5 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.876 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.572 ' HB1' ' CD1' ' B' ' 144' ' ' TRP . . . 79.81 -57.53 0.37 Allowed 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.0 0.52 . . . . 0.0 112.203 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.413 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -143.82 -152.86 0.44 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.089 -179.455 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.51 ' CD2' ' HA ' ' B' ' 141' ' ' ALA . 2.3 t80 179.45 56.62 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.384 0.611 . . . . 0.0 110.409 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 22.7 mm -130.32 52.81 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.628 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 55.28 156.95 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.001 1.111 . . . . 0.0 114.001 178.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 11.3 tpt 71.03 147.09 0.07 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.057 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.541 ' HA ' ' HG3' ' B' ' 142' ' ' GLU . 9.7 m120 -82.49 149.68 27.42 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.418 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -93.28 174.52 35.36 Favored Glycine 0 C--N 1.333 0.387 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.906 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 17.1 t -166.23 130.92 2.22 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.631 0.253 . . . . 0.0 111.157 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.522 ' O ' ' CB ' ' A' ' 66' ' ' ALA . 0.2 OUTLIER 67.36 -179.03 0.21 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.678 179.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.522 ' CB ' ' O ' ' A' ' 65' ' ' PHE . . . 98.54 127.86 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.416 0.686 . . . . 0.0 111.982 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.29 -59.19 0.17 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.094 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -143.45 -178.75 6.03 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.428 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -150.18 -75.22 0.16 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.936 -0.12 . . . . 0.0 111.27 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.425 ' HE2' ' O ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -177.37 -33.58 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.321 0.581 . . . . 0.0 109.7 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.422 ' HB3' ' O ' ' A' ' 70' ' ' LYS . 23.8 t70 74.26 -67.64 0.25 Allowed 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.154 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.972 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.723 0 N-CA-C 111.35 0.13 . . . . 0.0 111.35 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.556 ' HE3' ' HA ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -48.06 151.85 0.9 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.87 0.367 . . . . 0.0 111.122 179.52 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.556 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 4.9 tp60 -100.5 110.02 22.17 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.532 0.682 . . . . 0.0 111.111 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.613 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 0.1 OUTLIER -79.4 101.48 8.17 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.362 -178.897 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.601 HG23 ' CD2' ' A' ' 14' ' ' TYR . 5.5 pt -108.0 122.53 62.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.742 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.0 125.0 32.15 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.966 -178.176 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.594 HG12 ' CG1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -100.75 101.8 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.858 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.1 p -66.81 86.23 0.12 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.384 0.611 . . . . 0.0 110.83 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.671 ' O ' ' HB3' ' B' ' 110' ' ' ASP . 28.6 m -81.71 -141.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.849 -178.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.671 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.8 t70 93.1 -7.24 0.15 Allowed 'General case' 0 C--N 1.356 0.86 0 CA-C-O 121.97 0.89 . . . . 0.0 108.757 -176.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.04 -58.16 1.01 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.283 177.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.693 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.07 -89.69 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.395 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.8 m 179.91 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.266 0.939 . . . . 0.0 112.03 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.855 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -82.7 -40.8 20.12 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.742 0.817 . . . . 0.0 113.18 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.617 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 3.8 mt-30 -48.84 -42.03 34.98 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -175.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -58.42 -45.95 87.43 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.015 1.28 . . . . 0.0 112.091 -179.383 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.775 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -55.39 -45.63 76.61 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.532 0.682 . . . . 0.0 111.132 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.18 -34.37 43.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 179.98 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.541 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -60.3 -28.45 68.12 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.701 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.669 ' CB ' HD13 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.32 -45.34 10.1 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.52 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.626 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.5 m-20 147.63 41.82 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 176.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.452 HG21 ' O ' ' B' ' 121' ' ' ASP . 24.6 t -150.87 -37.92 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' B' ' 122' ' ' VAL . 17.0 m-80 64.26 -112.16 0.31 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.755 ' HB ' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -144.5 -0.99 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 179.169 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.449 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.1 OUTLIER -40.01 -64.39 0.5 Allowed 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.769 -178.706 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.22 -31.48 16.78 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.01 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.572 HD11 ' HG ' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.07 -61.18 2.39 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.562 0.345 . . . . 0.0 110.143 178.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.755 HG23 ' HB ' ' B' ' 124' ' ' ILE . 2.4 t -52.58 -61.31 0.82 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.121 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.747 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 28.8 t -48.92 -45.21 41.18 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -71.93 -51.42 22.23 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.41 ' OG1' HG22 ' A' ' 31' ' ' THR . 21.0 m -58.58 -47.81 83.03 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.027 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.816 ' SD ' HD21 ' A' ' 17' ' ' LEU . 5.5 mmt -56.25 -57.75 10.89 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.131 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.462 ' HA ' ' HB1' ' B' ' 136' ' ' ALA . 42.0 tt0 -51.66 -37.52 50.82 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.485 0.183 . . . . 0.0 111.301 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -55.38 14.43 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.646 ' HB3' HD11 ' A' ' 17' ' ' LEU . 3.2 mt-10 -74.92 -9.69 58.78 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.736 0.303 . . . . 0.0 110.72 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.709 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -87.33 -29.62 21.43 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.459 ' NH1' ' HB3' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -82.13 -48.34 11.45 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 122.153 0.977 . . . . 0.0 109.027 178.127 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -57.11 -28.42 62.66 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.103 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.678 ' CD2' ' CD2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -49.89 -21.0 1.02 Allowed 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.263 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 5.8 ppt_? -42.91 119.13 1.41 Allowed 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . 0.641 ' CB ' ' HA ' ' A' ' 55' ' ' VAL . . . -135.37 -55.35 0.8 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.139 178.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.587 ' O ' ' HB2' ' B' ' 143' ' ' ARG . 5.7 tp10 63.24 169.74 0.15 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 177.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.587 ' HB2' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER 85.65 120.76 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.666 178.57 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.572 ' CD1' ' HB1' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -168.26 134.24 1.9 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.806 178.945 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.39 145.99 11.68 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 120.676 0.274 . . . . 0.0 111.399 -179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.453 ' HB ' ' HB1' ' A' ' 66' ' ' ALA . 1.8 p -107.18 160.34 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.466 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -99.91 151.3 21.46 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.982 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -169.37 161.37 9.89 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 120.757 0.313 . . . . 0.0 111.613 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -143.65 -72.7 0.28 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.716 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 68.64 -176.54 0.2 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.864 0.364 . . . . 0.0 111.591 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 144.79 46.99 0.04 OUTLIER Glycine 0 CA--C 1.523 0.536 0 C-N-CA 121.264 -0.493 . . . . 0.0 113.262 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 2.2 ttt -84.59 146.67 27.39 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.859 0.33 . . . . 0.0 111.2 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 5.0 p -155.8 160.71 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.61 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.42 -175.01 2.59 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.85 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.3 t -102.65 -124.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.834 -0.166 . . . . 0.0 110.777 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 174.79 104.72 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.894 0.378 . . . . 0.0 111.486 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.52 163.11 23.98 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.031 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -159.0 96.45 1.34 Allowed 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 121.149 0.499 . . . . 0.0 110.707 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.406 HG22 HD11 ' B' ' 159' ' ' ILE . 30.9 mm -138.47 104.09 2.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.484 -179.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -93.26 160.36 14.86 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.18 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 7.2 ptt? -163.07 146.73 10.92 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.485 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -130.22 -63.31 0.9 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.317 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 103.58 -137.43 13.48 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.69 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 36.8 p -162.76 139.11 7.42 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.595 0.236 . . . . 0.0 111.069 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -122.05 124.04 43.03 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.2 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -161.45 128.8 4.06 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.397 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -162.7 115.51 1.64 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.167 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -130.61 150.49 51.78 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.029 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -166.6 176.47 7.24 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.898 0.38 . . . . 0.0 111.522 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' B' ' 170' ' ' LYS . 0.2 OUTLIER -166.94 -39.22 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' B' ' 172' ' ' TRP . 2.0 t70 89.72 102.23 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.007 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.441 ' HB2' ' O ' ' B' ' 171' ' ' ASP . 64.0 m95 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.655 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.889 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 C3'-C2'-C1' 105.498 1.999 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.78 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 C4'-C3'-C2' 102.055 -1.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.78 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.528 0.497 0 O4'-C4'-C3' 104.511 -1.089 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.535 ' C6 ' H2'' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 C3'-C2'-C1' 104.906 1.576 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.601 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.923 0 C4'-C3'-C2' 104.753 1.553 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.704 ' H73' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.914 0 C4'-C3'-C2' 104.551 1.351 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.582 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.511 0 C3'-C2'-C1' 105.089 1.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.582 " O5'" H2'' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.571 0 C3'-C2'-C1' 100.862 -1.313 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.554 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 O4'-C1'-C2' 107.245 1.041 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.653 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.754 0 C3'-C2'-C1' 105.265 1.832 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.653 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.559 0 O4'-C1'-C2' 107.104 0.912 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.489 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 N19-C1'-C2' 115.316 0.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 100.907 -2.293 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.882 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.065 0 O4'-C1'-N19 109.166 1.707 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.656 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 P--O3' 1.616 0.73 0 O4'-C1'-C2' 107.345 1.132 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.722 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.735 0 C3'-C2'-C1' 104.484 1.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.722 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 O4'-C1'-C2' 107.089 0.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.58 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O5'--C5' 1.426 -0.901 0 C1'-O4'-C4' 106.327 -2.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.562 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 C2'--C1' 1.531 0.711 0 C3'-C2'-C1' 104.837 1.526 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.49 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.647 0 C3'-C2'-C1' 106.382 2.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.613 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C1'-O4'-C4' 110.903 0.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.493 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 C1'-O4'-C4' 110.746 0.747 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.473 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 C1'-O4'-C4' 107.94 -1.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.452 ' C8 ' ' H72' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O4'-C1'-C2' 106.871 0.701 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.452 ' H72' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C5'-C4'-C3' 115.722 0.682 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 C1'-O4'-C4' 110.341 0.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.3 mtt . . . . . 0 N--CA 1.494 1.774 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.6 mtmm -105.0 177.16 4.93 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 123.065 0.228 . . . . 0.0 110.561 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.647 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -126.62 122.74 35.87 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.39 0.614 . . . . 0.0 112.488 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.832 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.72 111.46 14.85 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.669 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -111.75 122.91 66.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.435 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.65 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.04 128.8 41.02 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 119.99 -0.684 . . . . 0.0 112.641 -177.385 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.628 ' CG2' ' HB ' ' A' ' 9' ' ' VAL . 0.5 OUTLIER -100.86 109.91 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 175.614 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.55 HG23 ' H72' ' C' ' 176' ' ' ' DT' . 1.4 p -70.59 77.47 0.59 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.79 0.805 . . . . 0.0 109.392 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.767 HG21 ' HB3' ' A' ' 14' ' ' TYR . 9.9 p -92.51 -147.45 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-N 114.044 -1.435 . . . . 0.0 111.086 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.715 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 20.1 t70 106.7 13.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.477 1.132 . . . . 0.0 109.658 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -160.22 -40.3 0.05 Allowed 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.529 -1.668 . . . . 0.0 109.911 179.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.817 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 0.6 OUTLIER -69.81 35.11 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.504 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 28.7 m 72.18 4.08 4.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 177.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 1.003 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -58.0 -55.09 39.45 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.167 0.508 . . . . 0.0 111.959 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.565 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.6 mt-30 -49.74 -40.38 40.63 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -176.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.756 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -54.86 -32.49 60.8 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.726 ' CD1' ' HA ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -77.35 -51.78 10.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.645 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.64 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -68.16 -26.09 65.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.398 0.618 . . . . 0.0 109.788 178.478 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -60.63 -30.61 69.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.749 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.667 ' CE2' ' HG ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -88.35 -44.32 10.87 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 118.677 -0.677 . . . . 0.0 110.041 178.704 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.588 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 160.4 24.22 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.533 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.451 ' CG2' ' O ' ' A' ' 21' ' ' ASP . 68.1 t -160.65 101.22 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.64 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 1.5 m120 -58.77 -82.92 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 106.287 -1.745 . . . . 0.0 106.287 177.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.682 HG13 ' HE1' ' B' ' 132' ' ' MET . 0.2 OUTLIER -161.04 -1.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.647 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.573 ' HB2' ' P ' ' D' ' 190' ' ' ' DG' . 0.5 OUTLIER -38.81 -62.87 0.57 Allowed 'General case' 0 C--O 1.241 0.617 0 CA-C-N 118.872 0.76 . . . . 0.0 109.686 -178.483 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.34 -33.44 31.89 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.802 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 26.5 tp -59.13 -60.93 3.07 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.031 0.416 . . . . 0.0 111.21 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.662 HG23 HG22 ' A' ' 24' ' ' ILE . 3.2 t -48.91 -68.49 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 O-C-N 123.351 0.407 . . . . 0.0 109.995 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.661 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -47.16 -41.49 17.93 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.183 0.593 . . . . 0.0 112.561 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -69.94 -50.04 45.92 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.856 0.836 . . . . 0.0 108.981 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.1 m -63.77 -28.83 70.14 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.205 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.894 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 4.0 mmt -55.87 -47.42 77.39 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.649 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -56.42 -57.17 13.44 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.514 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 2.8 t-20 -50.65 -51.31 50.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.013 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.613 ' HB2' HD12 ' B' ' 127' ' ' LEU . 2.0 tp10 -68.57 -36.94 79.43 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.457 ' HB3' ' HB3' ' B' ' 116' ' ' LEU . . . -57.93 -42.95 85.92 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -52.13 18.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.17 178.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.514 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -52.93 -37.81 61.27 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.92 -177.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.517 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER -25.86 89.85 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.192 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.425 ' HG3' ' N ' ' A' ' 41' ' ' ALA . 0.5 OUTLIER -168.85 179.73 4.04 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.118 -179.477 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.425 ' N ' ' HG3' ' A' ' 40' ' ' ARG . . . -90.88 -128.22 0.09 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.344 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.1 -165.3 0.17 Allowed 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -160.43 -47.33 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 63.83 51.6 2.34 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.184 0.516 . . . . 0.0 111.046 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.46 66.01 1.8 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.346 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.3 p -140.16 107.23 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 120.99 0.424 . . . . 0.0 111.341 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -145.26 161.44 39.57 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.333 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.75 31.55 3.64 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.227 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -94.73 95.32 8.65 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.087 0.47 . . . . 0.0 111.335 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -135.82 -76.03 0.44 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.12 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -148.45 159.21 27.95 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 121.257 -0.496 . . . . 0.0 112.465 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.0 ttm -157.82 148.99 21.3 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.788 0.327 . . . . 0.0 111.411 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 6.3 p -69.99 144.89 13.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.871 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.43 93.7 0.35 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.204 0.526 . . . . 0.0 111.774 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.6 t -132.36 -124.53 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.736 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 39.7 79.05 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.3 mmm-85 -45.6 103.2 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.771 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.88 9.35 43.65 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.7 mm -81.92 67.17 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.17 0.509 . . . . 0.0 110.546 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -137.06 -151.56 0.4 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.962 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.421 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 1.6 mtp -133.38 147.35 51.78 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.816 0.341 . . . . 0.0 111.639 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' MET . 1.1 m120 74.86 149.91 0.11 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.406 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -150.63 57.37 0.45 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.919 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.503 ' O ' ' HB3' ' B' ' 143' ' ' ARG . 20.9 t -98.49 -163.2 1.02 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.805 0.336 . . . . 0.0 111.456 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -138.9 127.38 23.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.602 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.564 ' CB ' ' HB2' ' B' ' 149' ' ' GLN . . . -166.81 146.95 5.72 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.854 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -85.25 125.68 33.08 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.174 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -74.57 150.28 39.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.954 0.406 . . . . 0.0 111.326 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.424 ' O ' ' HB3' ' A' ' 70' ' ' LYS . 74.0 m-80 -65.76 -66.52 0.54 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.16 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 0.1 OUTLIER 172.26 -31.22 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 87.49 139.91 0.05 OUTLIER 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.636 -1.165 . . . . 0.0 111.297 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.146 -0.93 . . . . 0.0 111.38 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.471 ' O ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 110.606 -0.146 . . . . 0.0 110.606 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.401 ' HB3' ' OP2' ' C' ' 175' ' ' ' DA' . 0.0 OUTLIER -111.25 96.42 6.11 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.941 0.401 . . . . 0.0 111.413 179.518 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.715 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.0 tp60 -98.3 109.73 22.44 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.468 0.652 . . . . 0.0 109.815 178.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.582 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 0.1 OUTLIER -78.83 99.82 6.89 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.283 -178.304 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 6' ' ' THR . 7.2 pt -102.41 123.41 55.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.669 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.6 OUTLIER -131.24 123.35 28.23 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.914 -177.518 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.553 HG13 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.05 96.82 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 175.464 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.832 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 67.3 p -68.79 94.31 0.6 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.291 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.617 HG22 ' HB2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -116.49 -108.78 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.401 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.647 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 2.4 t0 81.95 25.51 0.2 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 123.211 1.481 . . . . 0.0 107.844 -174.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.8 p -151.21 -57.77 0.16 Allowed 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 112.005 -2.362 . . . . 0.0 111.196 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.661 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 65.3 m-20 -72.87 59.14 0.48 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.536 ' O ' ' HB3' ' A' ' 32' ' ' MET . 64.8 m 60.68 2.65 0.52 Allowed 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.843 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -59.97 -49.91 75.82 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.473 0.654 . . . . 0.0 109.584 178.715 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.702 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -49.46 -39.56 33.79 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.66 -177.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.457 ' HB3' ' HB3' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -54.99 -45.62 75.07 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.134 0.879 . . . . 0.0 110.238 179.578 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.894 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.3 OUTLIER -56.51 -53.89 52.2 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.843 179.208 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.702 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 17.8 pttt -68.92 -25.29 64.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.537 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.468 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.66 -28.0 53.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.3 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.568 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 87.6 m-85 -87.92 -42.75 12.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 177.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.568 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.6 t70 118.27 61.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.648 178.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.534 ' CG1' HD13 ' B' ' 117' ' ' LEU . 3.2 p -151.62 -33.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.46 -178.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.413 ' OD1' ' HB3' ' B' ' 118' ' ' LYS . 67.9 m-80 61.83 -123.38 0.78 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -178.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.645 ' HB ' HG21 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -137.28 9.93 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.598 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.529 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 91.9 p -38.84 -63.42 0.52 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.107 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.07 -34.64 14.19 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.681 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.613 HD12 ' HB2' ' A' ' 35' ' ' GLU . 34.0 tp -52.85 -61.64 2.16 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 117.33 0.565 . . . . 0.0 110.993 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.776 ' CG1' ' SD ' ' B' ' 132' ' ' MET . 2.6 t -50.05 -63.86 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.251 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.817 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.81 -47.0 42.58 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 123.773 0.829 . . . . 0.0 112.916 178.085 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -65.46 -56.83 10.28 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -55.49 -40.48 71.77 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.835 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 1.003 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 31.6 mtt -58.94 -53.76 54.77 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.816 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.504 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -53.32 -45.14 68.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.438 0.563 . . . . 0.0 110.843 178.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -65.41 -56.95 9.69 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.085 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -64.22 -24.14 67.56 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.756 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -71.76 -49.42 39.14 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.045 0.45 . . . . 0.0 109.863 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -52.23 64.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.706 0.765 . . . . 0.0 109.83 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.547 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -62.25 -47.1 85.87 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.905 -178.373 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.587 ' HG ' ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 17.29 82.92 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.029 0.831 . . . . 0.0 112.347 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.494 ' HD2' ' O ' ' B' ' 140' ' ' ARG . 0.0 OUTLIER -149.17 159.9 43.84 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.026 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -145.63 46.49 1.28 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.715 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.533 ' HG2' ' N ' ' B' ' 143' ' ' ARG . 0.7 OUTLIER -150.19 152.16 34.22 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.746 -179.384 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.533 ' N ' ' HG2' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -142.17 -165.07 1.94 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.673 0.273 . . . . 0.0 111.326 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.462 ' O ' ' HG2' ' B' ' 145' ' ' LYS . 40.4 t90 -132.22 93.61 3.3 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 120.805 0.336 . . . . 0.0 111.682 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.506 ' HD2' ' HA ' ' B' ' 145' ' ' LYS . 3.5 mmmt -177.5 172.42 1.81 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.461 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -70.37 -94.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.6 171.06 7.53 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.976 0.417 . . . . 0.0 111.481 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -81.24 122.3 27.23 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.188 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . 0.564 ' HB2' ' CB ' ' A' ' 66' ' ' ALA . 13.1 mm100 -135.78 59.27 1.72 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.776 179.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -116.15 110.27 18.6 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.776 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -139.43 57.83 0.61 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.801 -0.714 . . . . 0.0 113.253 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.3 mtt -144.79 117.76 8.82 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 120.759 0.314 . . . . 0.0 111.088 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 12.2 t -112.39 134.03 56.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.423 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -90.03 146.62 24.21 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.073 0.464 . . . . 0.0 111.466 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 5.1 t -138.35 -122.17 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.155 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 77.49 106.81 0.08 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.291 0.567 . . . . 0.0 112.366 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -96.5 160.94 14.13 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.864 179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -143.75 86.97 1.89 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.379 0.609 . . . . 0.0 111.028 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 10.1 mm -132.34 102.43 5.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.398 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.11 137.17 50.02 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.103 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 1.1 mmt -156.57 53.26 0.53 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.132 0.491 . . . . 0.0 111.143 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.62 86.06 1.19 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.435 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -114.13 -178.86 19.1 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.137 -0.554 . . . . 0.0 112.936 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 13.6 t -160.88 -179.53 7.64 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.859 0.361 . . . . 0.0 111.525 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -168.88 142.09 2.87 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.265 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' B' ' 167' ' ' ASP . . . -159.63 -75.71 0.07 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.397 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' B' ' 166' ' ' ALA . 1.0 OUTLIER 70.36 132.17 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.633 0.583 . . . . 0.0 111.66 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.51 -175.32 4.03 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.548 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -69.85 159.95 32.68 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.314 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.467 ' HB2' ' HE3' ' B' ' 170' ' ' LYS . 0.3 OUTLIER -163.95 -43.07 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.806 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 6.2 t70 83.12 88.15 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 113.962 -1.472 . . . . 0.0 111.181 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.769 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.874 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.448 1.309 0 C2'-C3'-O3' 115.14 1.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.723 H5'' " C3'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.849 0 C3'-C2'-C1' 106.084 2.417 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.671 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 O4'-C1'-N19 107.238 -0.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.59 ' C7 ' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 C1'-O4'-C4' 107.386 -1.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.562 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C3'-C2'-C1' 105.005 1.646 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.562 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.762 0 C4'-C3'-C2' 104.385 1.185 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.471 ' C2 ' ' C2 ' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.58 0 C3'-C2'-C1' 105.123 1.731 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.471 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 C3'-C2'-C1' 100.924 -1.269 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.426 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 O4'-C1'-C2' 107.144 0.949 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.41 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.801 0 C4'-C3'-C2' 104.571 1.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.41 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 C3'-C2'-C1' 101.782 -0.656 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.593 0 C3'-C2'-C1' 102.091 -0.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C4'-C3'-C2' 100.983 -2.217 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.864 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C4'-C3'-C2' 101.761 -1.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.505 " C5'" " H4'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.687 0 C4'-C3'-C2' 104.16 0.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-C2' 107.037 0.852 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.408 ' C6 ' ' C6 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 101.792 -0.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.573 ' P ' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O5'--C5' 1.424 -0.997 0 C1'-O4'-C4' 106.797 -2.073 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.56 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C3'-C2'-C1' 104.734 1.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.417 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 C3'-C2'-C1' 106.433 2.666 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.582 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C1'-O4'-C4' 110.294 0.424 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.42 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C4'-C3'-C2' 104.39 1.19 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.878 0 C1'-O4'-C4' 106.996 -1.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.459 ' N7 ' ' H72' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 104.315 1.115 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.459 ' H72' ' N7 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C4'-C3'-C2' 104.086 0.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.4 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 N19-C1'-C2' 114.99 0.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.444 ' O ' ' C ' ' A' ' 2' ' ' LYS . 19.3 tpp . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 119.922 -0.085 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' A' ' 1' ' ' MET . 8.4 mtmm -28.6 119.01 0.12 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.359 0.412 . . . . 0.0 111.216 -179.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.545 ' O ' ' HA ' ' B' ' 108' ' ' THR . 44.4 tt0 -100.19 118.73 37.11 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.218 0.533 . . . . 0.0 111.833 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.741 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.12 103.12 7.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.67 0.748 . . . . 0.0 111.594 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.662 HG23 ' CG ' ' B' ' 114' ' ' TYR . 2.6 pt -108.08 122.83 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.648 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.39 125.97 32.07 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.859 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.618 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.69 109.83 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.393 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.405 HG23 ' HG3' ' B' ' 104' ' ' ARG . 3.3 p -70.34 85.93 0.59 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.37 0.605 . . . . 0.0 110.484 -179.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.697 ' CG2' ' CD1' ' A' ' 14' ' ' TYR . 26.6 m -77.98 -146.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.088 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.645 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 22.9 t0 91.95 -7.88 0.22 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.777 0.799 . . . . 0.0 109.153 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.5 t -130.91 -59.72 0.99 Allowed 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.053 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.734 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.7 OUTLIER -44.4 -94.26 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -178.443 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.519 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 3.1 m -179.8 38.15 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 118.978 0.808 . . . . 0.0 111.526 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.697 ' CD1' ' CG2' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.92 -44.29 15.53 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.634 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 3.4 mt-30 -48.78 -38.78 22.92 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.564 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 1.6 mt -53.74 -57.18 11.79 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.673 0.67 . . . . 0.0 112.331 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.692 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -54.25 -42.68 70.18 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 120.211 -0.596 . . . . 0.0 112.437 -178.05 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.634 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.7 -28.4 40.65 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.371 179.615 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -56.29 -24.86 45.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.587 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.821 ' CD2' HD21 ' B' ' 139' ' ' LEU . 2.8 m-85 -87.98 -49.15 7.25 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.146 -0.934 . . . . 0.0 108.82 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.571 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 3.8 m-20 143.46 37.15 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 O-C-N 124.443 1.089 . . . . 0.0 110.504 178.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 t -147.87 77.74 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.652 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.51 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 18.9 m-80 -59.0 -105.17 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.703 ' HB ' HG21 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -147.62 7.4 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.593 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 31.0 p -41.86 -64.42 0.58 Allowed 'General case' 0 C--O 1.24 0.594 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.335 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.8 -30.85 13.79 Favored Glycine 0 C--N 1.333 0.39 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.991 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.601 HD11 ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -52.3 -61.5 2.24 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 122.486 0.315 . . . . 0.0 110.226 178.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.703 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.2 t -51.23 -58.7 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.713 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 9.7 p -48.67 -42.4 34.56 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.403 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -79.59 -45.12 19.76 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.13 0.49 . . . . 0.0 110.256 179.826 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.403 ' N ' ' CG2' ' A' ' 30' ' ' THR . 3.2 m -59.3 -44.64 92.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.803 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.908 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.16 -48.52 61.84 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.436 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -61.38 -37.42 83.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.825 -0.17 . . . . 0.0 111.315 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -51.31 42.0 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.571 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 20.5 tp10 -65.77 -34.45 78.21 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.55 ' O ' HD11 ' A' ' 39' ' ' LEU . . . -62.45 -45.16 94.33 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -50.42 71.77 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 122.121 0.962 . . . . 0.0 108.785 177.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.452 ' NH1' ' O ' ' A' ' 40' ' ' ARG . 7.2 ttp85 -60.58 -56.36 22.21 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 113.322 -1.763 . . . . 0.0 113.673 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.745 ' CD1' ' CE2' ' B' ' 120' ' ' TYR . 15.0 mt 8.73 76.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.458 1.103 . . . . 0.0 113.523 -178.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.488 ' NH2' ' OD1' ' A' ' 62' ' ' ASN . 0.1 OUTLIER -178.87 154.31 0.71 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.694 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 75.06 131.31 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.398 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -129.05 -76.02 0.55 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.219 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -176.16 155.83 1.58 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.814 0.34 . . . . 0.0 111.668 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -151.91 177.29 10.59 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.181 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.18 144.61 51.0 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.402 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 3.7 p -157.82 157.5 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 120.774 0.321 . . . . 0.0 111.394 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -87.71 54.62 3.18 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.189 0.519 . . . . 0.0 111.585 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 42.5 t30 176.51 152.42 0.18 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.274 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.19 107.13 4.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.42 153.15 36.97 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.198 -179.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.28 90.05 0.25 Allowed Glycine 0 C--N 1.337 0.614 0 CA-C-N 115.844 -0.617 . . . . 0.0 113.025 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 4.3 tpt -116.2 136.68 52.79 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.5 m 50.64 -162.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.534 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -109.74 148.53 31.26 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.862 0.363 . . . . 0.0 111.147 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.87 -123.82 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.671 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -147.45 86.45 1.61 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.145 0.498 . . . . 0.0 111.434 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -111.16 125.44 53.79 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.442 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -158.65 44.29 0.28 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.19 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 16.8 mm -125.24 -91.59 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.752 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -112.91 173.09 6.55 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -178.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 63.3 ttp -168.95 89.79 0.22 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.821 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.488 ' OD1' ' NH2' ' A' ' 40' ' ' ARG . 78.6 m-20 -124.09 -91.51 0.54 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.576 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -178.74 49.26 0.09 OUTLIER Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.682 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.3 t 59.18 -148.77 0.46 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.596 0.236 . . . . 0.0 111.186 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -134.82 131.46 37.48 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.025 0.441 . . . . 0.0 111.459 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -169.25 102.36 0.36 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.689 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.13 -83.28 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.736 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -93.18 82.87 4.56 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.018 0.437 . . . . 0.0 110.796 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -125.8 -3.91 7.08 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.529 ' HD3' ' O ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER 177.86 -30.22 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.557 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.529 ' O ' ' HD3' ' A' ' 70' ' ' LYS . 2.5 m-20 78.76 155.22 0.15 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.108 0.963 . . . . 0.0 113.015 178.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.456 ' CZ2' ' HE3' ' A' ' 70' ' ' LYS . 19.2 m-90 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.898 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.467 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 1.8 mpt? . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 119.674 -0.203 . . . . 0.0 110.763 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.645 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER 78.14 134.5 0.06 Allowed 'General case' 0 C--N 1.343 0.29 0 CA-C-O 121.204 0.526 . . . . 0.0 111.122 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.478 ' HB3' HG22 ' A' ' 9' ' ' VAL . 13.9 tt0 -105.21 107.63 18.72 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.823 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.564 ' O ' " H3'" ' D' ' 191' ' ' ' DT' . 5.2 ttm105 -78.6 101.48 7.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.393 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.651 HG13 ' O ' ' B' ' 105' ' ' ILE . 20.0 pt -102.94 116.6 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.65 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.648 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.92 119.19 35.12 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.223 -177.844 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.618 HG12 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.63 92.21 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 176.03 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.741 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 81.7 p -62.08 90.87 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.089 0.471 . . . . 0.0 110.412 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.681 ' O ' ' HB3' ' B' ' 110' ' ' ASP . 2.1 t -84.12 -136.43 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.04 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.681 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 90.14 -12.26 0.32 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -175.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 39.5 t -122.31 -63.11 1.32 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.161 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.713 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -43.49 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.365 0.416 . . . . 0.0 112.071 -179.018 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.525 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER 176.24 44.24 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.744 0.702 . . . . 0.0 110.671 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.834 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.3 OUTLIER -83.1 -41.9 18.03 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.471 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.592 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.58 -43.62 36.06 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -176.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.83 -30.61 5.96 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.713 0.688 . . . . 0.0 112.163 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.908 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.34 -60.11 2.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.374 178.351 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.608 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -63.38 -25.8 68.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.241 179.754 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.447 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.93 -29.17 55.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.518 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.745 ' CE2' ' CD1' ' A' ' 39' ' ' LEU . 14.4 m-30 -94.23 -42.32 9.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.583 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 27.6 t70 125.15 54.7 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 122.343 1.068 . . . . 0.0 110.177 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.683 HG11 HD12 ' B' ' 117' ' ' LEU . 4.8 p -142.84 -38.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 CA-C-N 113.846 -1.525 . . . . 0.0 111.856 -177.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.429 ' O ' ' HE1' ' A' ' 32' ' ' MET . 21.9 m-80 54.65 -117.05 1.12 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.732 ' HB ' HG21 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.78 5.86 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -179.296 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.532 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.2 OUTLIER -39.18 -63.78 0.51 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.978 -178.471 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.98 -31.24 21.02 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.347 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.55 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 20.3 tp -55.5 -61.67 2.19 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 116.824 0.312 . . . . 0.0 110.664 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.732 HG21 ' HB ' ' B' ' 124' ' ' ILE . 3.2 t -52.76 -63.22 0.5 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.974 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.057 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.734 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 11.3 p -49.52 -46.78 48.91 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.418 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.6 OUTLIER -72.74 -47.4 47.21 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.418 ' N ' ' CG2' ' B' ' 130' ' ' THR . 16.7 m -57.78 -53.98 52.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.4 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.692 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 6.1 mmt -50.06 -52.65 32.78 Favored 'General case' 0 C--O 1.205 -1.246 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.118 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.519 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 3.6 tt0 -53.96 -49.1 69.5 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 117.735 0.243 . . . . 0.0 111.369 179.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -65.04 -43.42 92.43 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.551 ' O ' ' HG ' ' B' ' 139' ' ' LEU . 2.2 tt0 -76.19 -8.65 57.5 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.124 177.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.618 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -87.43 -47.21 8.95 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 123.158 0.583 . . . . 0.0 109.909 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -56.82 6.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.486 0.66 . . . . 0.0 109.867 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.62 ' HD2' ' HA ' ' B' ' 142' ' ' GLU . 0.5 OUTLIER -84.37 -37.62 21.32 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.579 -1.191 . . . . 0.0 114.126 -177.601 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.821 HD21 ' CD2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 42.79 41.18 2.39 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.256 0.623 . . . . 0.0 111.776 -177.124 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -168.15 -52.79 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . 0.473 ' O ' ' HD2' ' B' ' 138' ' ' ARG . . . -175.35 92.56 0.06 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.84 0.352 . . . . 0.0 111.939 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.62 ' HA ' ' HD2' ' B' ' 138' ' ' ARG . 5.1 tp10 -102.12 142.66 33.04 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.428 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.7 47.91 1.56 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.817 0.341 . . . . 0.0 110.874 179.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 39.5 p90 39.16 -140.98 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.551 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.45 137.11 53.99 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.836 0.351 . . . . 0.0 110.532 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 2.9 t -79.55 145.34 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-O 120.891 0.377 . . . . 0.0 111.708 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -117.07 -90.85 0.55 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.913 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -159.89 177.33 10.9 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.945 0.402 . . . . 0.0 111.427 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -160.49 152.35 19.97 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.873 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.31 165.84 13.23 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.726 0.298 . . . . 0.0 111.21 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -138.7 61.7 0.57 Allowed Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.637 -0.792 . . . . 0.0 113.466 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.15 161.74 15.27 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.848 0.356 . . . . 0.0 111.023 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 3.8 m -63.55 131.82 29.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 120.814 0.34 . . . . 0.0 111.458 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -67.17 85.08 0.14 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.31 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 11.6 t -94.99 -2.58 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 73.35 104.79 0.07 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.468 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . 0.452 ' O ' ' CB ' ' B' ' 158' ' ' PHE . 0.2 OUTLIER -119.48 -179.06 3.76 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.395 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.452 ' CB ' ' O ' ' B' ' 157' ' ' ARG . 1.2 t80 88.8 110.18 0.04 OUTLIER 'General case' 0 C--N 1.34 0.173 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.423 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 1.2 mp -98.56 -69.96 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.51 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -144.86 147.73 33.14 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.866 0.365 . . . . 0.0 111.269 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 10.8 ttp -158.33 55.32 0.45 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.065 0.46 . . . . 0.0 111.131 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -141.72 156.1 45.62 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.166 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -80.18 151.46 33.26 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.022 -0.609 . . . . 0.0 113.041 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 21.3 t -104.93 152.64 22.42 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.796 0.331 . . . . 0.0 111.301 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -169.68 -65.36 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.219 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -162.41 153.46 17.61 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.29 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -107.52 -67.6 0.95 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.088 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 60.72 65.22 1.06 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.023 0.44 . . . . 0.0 111.842 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -95.07 164.28 12.95 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.051 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -175.58 -33.56 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.953 0.406 . . . . 0.0 110.044 -179.804 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 32.7 m-20 80.47 102.13 0.06 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.707 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.6 t90 . . . . . 0 C--O 1.251 1.182 0 CA-C-O 118.165 -0.922 . . . . 0.0 111.297 179.932 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.883 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.271 0 C3'-C2'-C1' 106.188 2.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.861 ' H72' " O4'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.838 0 C3'-C2'-C1' 104.859 1.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.802 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 P--O3' 1.613 0.533 0 O4'-C1'-C2' 107.064 0.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.53 ' C6 ' H2'' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.768 0 C4'-C3'-C2' 104.604 1.404 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.576 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.405 -1.159 0 C3'-C2'-C1' 105.426 1.947 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.576 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C4'-C3'-C2' 104.192 0.992 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.457 ' H8 ' H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.555 0 C3'-C2'-C1' 105.714 2.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.434 ' C6 ' " C2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.711 0 C3'-C2'-C1' 100.242 -1.756 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.642 ' C2 ' ' C2 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 C3'-C2'-C1' 104.119 1.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.563 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.753 0 C3'-C2'-C1' 105.258 1.827 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.563 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 O4'-C1'-C2' 107.018 0.834 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.8 0 C3'-C2'-C1' 104.992 1.637 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.622 0 C4'-C3'-C2' 100.946 -2.254 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.867 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.563 0 N19-C1'-C2' 115.529 0.831 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.458 ' H6 ' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 O4'-C1'-C2' 107.187 0.988 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.636 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 O4'-C4'-C3' 106.209 0.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.636 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 O4'-C1'-C2' 107.003 0.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.593 ' OP1' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.023 0 C4'-C3'-C2' 104.669 1.469 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.623 ' H71' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.788 0 C1'-O4'-C4' 106.95 -1.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.642 ' C2 ' ' C2 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C3'-C2'-C1' 105.097 1.712 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.463 ' C4 ' ' N6 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 N19-C1'-C2' 115.844 1.028 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.519 H2'' " O5'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.845 0 C3'-C2'-C1' 105.243 1.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.519 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C1'-O4'-C4' 108.176 -1.089 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-C2' 106.937 0.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 C4'-C3'-C2' 104.113 0.913 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 N19-C1'-C2' 115.343 0.715 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.851 0 CA-C-O 120.204 0.049 . . . . 0.0 111.016 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.491 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.2 mmtm -141.85 103.49 4.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.114 0.483 . . . . 0.0 110.149 178.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.479 ' HG2' ' CG2' ' A' ' 5' ' ' ILE . 1.0 OUTLIER -88.88 114.62 25.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.489 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.84 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -78.94 98.57 6.46 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.936 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.655 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -114.67 109.8 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.526 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.725 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.3 OUTLIER -108.87 133.81 52.39 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.582 -177.252 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.573 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -99.44 101.18 11.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.0 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 25.9 p -62.39 88.46 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.632 0.73 . . . . 0.0 110.189 -178.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.716 ' CG2' ' CD2' ' A' ' 14' ' ' TYR . 28.7 m -80.05 -137.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 114.258 -1.337 . . . . 0.0 112.032 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.508 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 24.6 t0 81.82 -10.54 1.13 Allowed 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -177.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.0 m -120.49 -69.68 0.83 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.674 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.705 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 0.2 OUTLIER -51.32 -89.41 0.0 OUTLIER 'General case' 0 C--N 1.353 0.747 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.146 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.515 ' HB3' ' O ' ' B' ' 129' ' ' SER . 29.2 t -177.14 47.55 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.249 0.931 . . . . 0.0 111.529 -178.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.874 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -80.35 -46.8 15.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -179.796 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.625 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 2.3 mm100 -49.18 -39.78 30.65 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -176.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.511 ' HA ' ' HB3' ' A' ' 19' ' ' ALA . 0.7 OUTLIER -56.01 -56.15 24.26 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.588 ' HG ' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -45.5 -52.91 9.66 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.804 0.812 . . . . 0.0 111.508 -177.695 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.696 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 5.8 pttt -78.99 -26.58 43.35 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.772 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.511 ' HB3' ' HA ' ' A' ' 16' ' ' LEU . . . -62.2 -22.84 66.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.251 177.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.736 ' CD2' ' HG ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.83 -43.37 11.88 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 118.666 -0.683 . . . . 0.0 109.441 178.322 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.608 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 164.34 21.79 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 177.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.513 ' C ' ' H ' ' A' ' 24' ' ' ILE . 59.0 t -153.54 101.82 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.696 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 46.8 m-80 -66.25 52.37 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.141 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.695 HG23 ' HE3' ' B' ' 132' ' ' MET . 1.9 pp 35.61 -2.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 120.068 3.359 . . . . 0.0 120.068 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.541 ' HB2' ' OP2' ' D' ' 190' ' ' ' DG' . 0.0 OUTLIER -38.05 -57.66 1.03 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 118.917 0.78 . . . . 0.0 110.204 -179.537 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.61 -29.55 43.25 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.868 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 1.1 tm? -60.83 -56.13 24.82 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.603 HG21 HG23 ' B' ' 128' ' ' VAL . 90.7 t -45.52 -67.95 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 109.987 178.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.602 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.1 p -50.57 -42.24 55.28 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.577 0.751 . . . . 0.0 112.71 178.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.2 m -66.46 -57.44 7.36 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -52.85 -41.64 64.46 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.038 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.812 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -48.68 -49.59 37.0 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.389 178.713 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.68 -45.49 85.55 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.361 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -51.79 57.02 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.737 ' HG3' HD23 ' B' ' 127' ' ' LEU . 1.4 mm-40 -64.5 -28.31 69.57 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.576 178.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.569 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.61 -45.57 61.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.002 0.43 . . . . 0.0 110.491 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -73.23 -56.54 4.94 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.088 0.471 . . . . 0.0 111.233 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.42 -32.97 25.81 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -176.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.54 ' CD1' ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 36.86 36.85 0.06 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -178.238 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.2 93.65 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.799 0.333 . . . . 0.0 111.458 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -134.16 147.0 50.72 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.154 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -94.17 -114.89 0.1 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -165.51 -169.35 1.55 Allowed 'General case' 0 CA--C 1.537 0.464 0 O-C-N 122.226 -0.296 . . . . 0.0 111.315 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.469 ' O ' ' HE2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER 68.02 95.78 0.06 Allowed 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 179.44 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 44' ' ' TRP . 11.9 mmtt -150.43 145.93 26.36 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.444 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.438 HG13 ' N ' ' A' ' 47' ' ' GLU . 1.3 p -87.39 -158.79 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.145 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.666 ' HA ' ' NH1' ' B' ' 140' ' ' ARG . 0.3 OUTLIER -73.52 144.82 45.98 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.302 0.573 . . . . 0.0 112.38 -179.157 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -179.78 169.87 1.28 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.568 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.421 ' O ' ' HD2' ' B' ' 143' ' ' ARG . 18.2 pt20 -114.0 171.27 7.7 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.778 0.323 . . . . 0.0 111.513 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.413 ' HA ' ' HB2' ' B' ' 143' ' ' ARG . 1.3 pm0 -77.18 169.51 18.2 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.639 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 147.81 97.21 0.19 Allowed Glycine 0 C--N 1.336 0.54 0 C-N-CA 121.102 -0.57 . . . . 0.0 112.798 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.87 169.02 8.85 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.866 0.365 . . . . 0.0 111.44 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 42.3 t -129.64 138.7 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.991 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.49 129.24 38.73 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.938 0.399 . . . . 0.0 111.659 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 t -146.06 -120.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.517 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -171.24 -100.45 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.23 0.212 . . . . 0.0 110.947 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 70.89 141.22 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -173.51 78.37 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.421 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 22.7 mm -146.6 109.25 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.386 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -134.63 -67.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.83 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 68.09 -176.6 0.2 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.197 0.523 . . . . 0.0 112.071 179.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -149.46 166.0 30.43 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.878 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -151.1 150.84 22.86 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 120.525 -0.845 . . . . 0.0 113.749 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.2 m 179.16 -89.02 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.809 0.444 . . . . 0.0 110.581 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.8 t80 68.31 164.09 0.22 Allowed 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.28 0.562 . . . . 0.0 112.402 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -146.3 84.86 1.64 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.038 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.47 115.92 23.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.027 -178.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -129.85 119.68 23.72 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.961 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -178.73 163.42 1.45 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.962 0.41 . . . . 0.0 111.26 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.1 pttt 179.13 -32.4 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.437 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 81.67 -52.76 0.26 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.082 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 . . . . . 0 C--O 1.253 1.251 0 CA-C-O 118.492 -0.766 . . . . 0.0 110.992 179.559 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 2.9 mmt . . . . . 0 N--CA 1.496 1.853 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.508 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.6 OUTLIER -167.58 139.24 3.09 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.654 179.577 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.607 ' HB3' HG22 ' A' ' 9' ' ' VAL . 12.5 tp60 -114.62 116.98 29.61 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.324 0.583 . . . . 0.0 111.472 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.643 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.38 106.49 11.45 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.29 -0.868 . . . . 0.0 112.042 -179.124 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.724 HG13 ' O ' ' B' ' 105' ' ' ILE . 2.8 pt -115.03 115.65 50.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.725 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -124.46 132.12 53.5 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.612 -177.521 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.71 ' CG2' ' HB ' ' B' ' 109' ' ' VAL . 0.2 OUTLIER -100.37 99.28 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 174.676 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.84 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 71.8 p -69.15 71.92 0.27 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.71 ' HB ' ' CG2' ' B' ' 107' ' ' VAL . 14.4 p -101.81 -131.56 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.919 -176.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.586 ' O ' ' HG3' ' B' ' 115' ' ' GLN . 1.0 OUTLIER 155.38 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -178.335 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 8.3 t -80.43 -1.23 40.58 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.609 ' CB ' ' CG2' ' B' ' 109' ' ' VAL . 4.9 t0 -74.91 52.75 0.56 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 120.303 1.41 . . . . 0.0 109.534 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.469 ' O ' ' HB3' ' A' ' 32' ' ' MET . 2.8 m 65.17 -11.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.812 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.8 OUTLIER -53.53 -60.04 3.82 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 118.207 0.458 . . . . 0.0 110.326 179.719 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' B' ' 110' ' ' ASP . 85.8 mt-30 -49.56 -41.04 40.5 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.979 -177.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.502 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.93 -28.08 21.85 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.552 ' HG ' ' CD1' ' B' ' 127' ' ' LEU . 0.5 OUTLIER -77.52 -55.4 5.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.44 0.638 . . . . 0.0 110.885 178.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.689 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -64.01 -25.87 68.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.26 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.87 -27.8 45.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.379 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.573 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 13.0 m-30 -88.5 -42.53 12.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.078 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.573 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 18.7 t70 124.95 63.67 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 O-C-N 124.548 1.155 . . . . 0.0 110.469 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.538 ' CG1' ' CD1' ' B' ' 117' ' ' LEU . 3.7 p -159.7 -32.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.507 -178.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 6.7 p30 54.64 -102.91 0.16 Allowed 'General case' 0 C--N 1.343 0.29 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.775 ' CG2' ' HE2' ' A' ' 32' ' ' MET . 0.3 OUTLIER -158.4 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 179.3 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.556 ' O ' HG22 ' A' ' 7' ' ' VAL . 8.8 p -39.61 -64.63 0.46 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.436 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.674 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.04 -32.78 16.56 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.724 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.737 HD23 ' HG3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -56.57 -62.92 1.4 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.852 0.326 . . . . 0.0 111.12 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.74 HG11 ' SD ' ' B' ' 132' ' ' MET . 2.1 t -55.22 -69.16 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.729 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 1.1 t -51.38 -41.21 60.53 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.674 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -76.05 -50.08 15.75 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 118.754 0.706 . . . . 0.0 109.282 179.12 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 1.3 m -51.47 -35.96 42.23 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.874 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 2.4 mtt -55.4 -48.76 73.87 Favored 'General case' 0 C--O 1.201 -1.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.439 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -53.98 -36.44 62.92 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.216 0.916 . . . . 0.0 110.561 179.42 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . 0.463 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 1.3 m-20 -75.19 -48.49 23.27 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' B' ' 139' ' ' LEU . 2.7 tp10 -68.92 -21.94 64.19 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.834 177.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.64 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -76.71 -47.37 22.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.672 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -56.41 13.43 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.659 0.742 . . . . 0.0 109.549 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.46 -34.24 75.6 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.445 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.736 ' HG ' ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 32.76 56.02 0.41 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.76 0.791 . . . . 0.0 111.737 -179.422 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.666 ' NH1' ' HA ' ' A' ' 47' ' ' GLU . 8.2 ttp180 -177.24 141.43 0.32 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.067 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -59.16 121.26 10.89 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.957 0.408 . . . . 0.0 111.317 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.41 ' HA ' ' NH2' ' B' ' 140' ' ' ARG . 0.9 OUTLIER -78.12 -77.97 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.277 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.421 ' HD2' ' O ' ' A' ' 49' ' ' GLN . 2.9 ttt180 68.76 131.98 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.623 0.725 . . . . 0.0 112.799 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 31.6 p90 -111.36 155.98 22.27 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.902 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -115.41 163.64 15.43 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.198 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 14.6 p -121.53 143.04 35.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.943 0.402 . . . . 0.0 111.096 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -107.44 161.29 14.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.115 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -125.13 169.28 12.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.782 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.56 109.04 8.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.969 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.24 113.12 1.79 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.772 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -104.33 69.38 0.27 Allowed Glycine 0 C--N 1.334 0.423 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.267 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 19.5 mmm -87.37 105.87 17.56 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.971 0.415 . . . . 0.0 111.199 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 10.5 p -84.81 54.67 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.314 0.578 . . . . 0.0 111.792 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . 0.447 ' C ' ' H ' ' B' ' 156' ' ' ALA . 33.1 tt0 -168.35 164.5 12.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.291 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 70.25 -23.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 178.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' B' ' 154' ' ' GLU . . . -74.14 -86.04 0.04 OUTLIER 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.859 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 3.2 ttt180 63.88 128.1 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.225 0.535 . . . . 0.0 111.807 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.523 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -175.06 98.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.976 -179.386 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.436 ' O ' ' C ' ' B' ' 160' ' ' GLU . 16.8 mm -97.05 -121.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.677 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . 0.436 ' C ' ' O ' ' B' ' 159' ' ' ILE . 0.5 OUTLIER 17.8 76.21 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 179.392 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 17.1 mtp -118.48 133.67 55.69 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.418 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -78.39 159.66 28.21 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.986 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -70.96 54.26 1.0 Allowed Glycine 0 CA--C 1.522 0.495 0 C-N-CA 121.273 -0.489 . . . . 0.0 113.217 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.99 -69.49 0.08 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 122.658 0.383 . . . . 0.0 111.947 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 39.1 t80 69.51 152.94 0.1 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.012 0.434 . . . . 0.0 111.546 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -170.29 109.99 0.38 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.717 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -72.77 68.73 0.88 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.309 0.576 . . . . 0.0 110.619 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -66.53 66.45 0.05 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.065 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -88.08 147.25 25.04 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.885 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.489 ' NZ ' ' O ' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -162.28 -33.94 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.188 179.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.489 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 10.7 t0 96.09 161.39 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.516 1.127 . . . . 0.0 110.671 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 30.7 m0 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.679 -0.677 . . . . 0.0 111.618 179.969 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.883 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O4'-C1'-C2' 107.425 1.205 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.883 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.789 0 C3'-C2'-C1' 104.562 1.33 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.686 ' C8 ' " C2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 O4'-C1'-C2' 107.045 0.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.535 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 C1'-O4'-C4' 106.737 -2.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.617 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C4'-C3'-C2' 104.17 0.97 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.617 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.88 0 C4'-C3'-C2' 104.701 1.501 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.514 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 C3'-C2'-C1' 105.007 1.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.643 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.671 0 C3'-C2'-C1' 100.801 -1.357 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.643 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.656 0 O4'-C1'-C2' 107.245 1.041 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.693 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.881 0 C3'-C2'-C1' 105.27 1.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.693 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-C2' 106.992 0.811 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.556 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 N19-C1'-C2' 115.25 0.657 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C4'-C3'-C2' 100.861 -2.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.881 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C1'-C2' 106.918 0.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.774 0 N19-C1'-C2' 112.86 -0.837 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 C3'-C2'-C1' 101.651 -0.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.433 H2'' " O5'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 O4'-C1'-C2' 105.074 -0.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.541 ' OP2' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O5'--C5' 1.426 -0.861 0 C1'-O4'-C4' 107.19 -1.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.569 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 C2'--C1' 1.53 0.677 0 C3'-C2'-C1' 104.631 1.379 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.447 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C3'-C2'-C1' 106.694 2.853 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.592 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.584 0 N19-C1'-C2' 115.292 0.682 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.592 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C4'-C3'-C2' 104.546 1.346 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.49 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.909 0 C1'-O4'-C4' 107.295 -1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.562 ' C4 ' ' N2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.602 0 C3'-C2'-C1' 104.345 1.175 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.622 H2'' ' C8 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.862 0 C3'-C2'-C1' 105.115 1.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.622 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C1'-O4'-C4' 110.308 0.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 111.557 0.206 . . . . 0.0 111.557 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt 72.42 160.92 0.23 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.011 0.434 . . . . 0.0 111.67 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.533 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -98.76 106.78 19.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.454 0.645 . . . . 0.0 110.397 179.516 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.827 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.48 103.91 9.72 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.187 -179.221 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.707 HG22 ' CD1' ' B' ' 114' ' ' TYR . 9.0 pt -100.05 128.88 51.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.71 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.3 OUTLIER -132.52 124.37 28.36 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 117.992 -1.483 . . . . 0.0 113.997 -177.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.631 HG13 ' CG2' ' B' ' 105' ' ' ILE . 1.2 p -100.33 101.72 12.47 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 176.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 37.7 p -69.98 80.71 0.48 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.447 0.641 . . . . 0.0 110.471 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.687 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 4.0 t -72.93 -124.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.912 -178.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.681 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 0.4 OUTLIER 99.95 6.02 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.179 0.992 . . . . 0.0 109.88 -176.294 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.7 t -167.44 -42.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.876 -1.056 . . . . 0.0 112.161 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.64 ' O ' ' HA ' ' B' ' 129' ' ' SER . 0.5 OUTLIER -62.24 47.92 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -177.274 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' B' ' 132' ' ' MET . 1.0 OUTLIER 53.66 7.51 0.11 Allowed 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 177.181 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.764 ' CD1' HG13 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -66.59 -52.57 43.95 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.278 0.49 . . . . 0.0 111.141 179.181 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.745 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.54 -36.88 24.92 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 0.4 OUTLIER -55.5 -56.47 19.82 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.477 0.58 . . . . 0.0 111.224 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.791 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.5 -54.09 15.62 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.288 0.566 . . . . 0.0 111.355 -178.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 7.5 pttt -71.9 -25.74 62.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.153 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -58.5 -20.12 42.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.469 178.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.642 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 23.5 m-85 -87.69 -53.58 4.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.642 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.65 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 O-C-N 124.303 1.002 . . . . 0.0 111.821 178.57 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.487 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 9.7 p -147.03 80.61 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.522 0.677 . . . . 0.0 112.439 -178.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.534 ' O ' ' N ' ' A' ' 25' ' ' SER . 48.8 m-80 -65.42 63.44 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.883 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.783 ' CG2' ' HE3' ' B' ' 132' ' ' MET . 0.5 OUTLIER 39.53 -7.94 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 118.336 2.717 . . . . 0.0 118.336 179.176 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -37.71 -60.07 0.75 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 120.432 1.469 . . . . 0.0 110.318 -178.28 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.53 -28.27 40.05 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.143 -0.551 . . . . 0.0 112.279 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.679 ' HB3' HG21 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -65.09 -61.35 2.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 122.677 0.391 . . . . 0.0 111.202 179.961 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.723 HG21 ' HB ' ' A' ' 24' ' ' ILE . 15.4 t -47.89 -61.25 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.478 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.793 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 7.7 p -49.2 -44.8 43.46 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 124.814 1.246 . . . . 0.0 113.417 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 97.4 m -67.07 -51.09 58.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 m -60.37 -34.07 73.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.288 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.902 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 3.3 mmt -57.73 -57.28 13.45 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.933 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.436 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -57.98 -45.42 86.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.606 0.241 . . . . 0.0 110.866 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.436 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 2.4 t-20 -64.06 -55.49 21.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.615 179.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.605 ' HG2' ' CD1' ' B' ' 127' ' ' LEU . 1.7 tp10 -67.57 -22.1 65.4 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.734 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -72.1 -42.94 65.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.71 -56.63 5.0 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.783 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.43 ' HD3' ' HA ' ' A' ' 38' ' ' ARG . 22.3 mmt180 -84.22 -32.1 24.69 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -176.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.562 ' CD1' ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 34.11 73.45 0.08 Allowed 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.691 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.492 ' NH1' ' O ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -174.49 -14.38 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.492 ' O ' ' NH1' ' A' ' 40' ' ' ARG . . . 78.87 104.94 0.07 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.48 0.582 . . . . 0.0 110.775 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -134.72 173.03 12.13 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.804 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 79.8 145.6 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.589 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -101.83 -78.83 0.53 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.37 178.52 4.25 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -124.22 174.39 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.954 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -94.63 -90.99 0.21 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.43 -68.08 0.3 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.55 ' HB2' ' HA ' ' B' ' 146' ' ' VAL . 14.0 mm100 -145.02 170.48 16.1 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.885 0.374 . . . . 0.0 111.563 -179.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.68 134.36 40.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.754 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -152.66 144.33 11.35 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.972 -0.633 . . . . 0.0 113.004 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 59.5 mtp -104.38 -177.78 3.47 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.715 0.293 . . . . 0.0 111.49 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.1 p -159.04 124.62 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.027 0.441 . . . . 0.0 111.262 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.13 -165.53 1.11 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.085 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.3 t -119.08 -125.38 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.42 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 179.47 -72.08 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.527 0.203 . . . . 0.0 111.518 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.22 121.21 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.113 0.482 . . . . 0.0 112.035 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.5 t80 179.53 106.24 0.03 OUTLIER 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.63 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -125.93 -134.09 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.677 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.78 167.24 22.42 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.744 0.307 . . . . 0.0 111.106 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.1 ttt -157.41 52.39 0.47 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.981 0.419 . . . . 0.0 111.219 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -109.74 -177.42 3.27 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.427 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 133.12 72.26 0.09 OUTLIER Glycine 0 C--N 1.333 0.38 0 C-N-CA 121.076 -0.583 . . . . 0.0 112.617 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.3 t -123.35 124.69 43.51 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.696 0.284 . . . . 0.0 111.361 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -164.21 150.1 10.82 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.301 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -145.92 155.18 42.69 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.077 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.83 -86.95 0.45 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.429 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 52.64 74.12 0.3 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.096 0.474 . . . . 0.0 111.199 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -140.9 -162.06 1.3 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.416 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.49 -35.63 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.157 0.503 . . . . 0.0 109.718 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.431 ' HB3' ' HD1' ' A' ' 72' ' ' TRP . 6.2 t70 78.7 -58.44 0.43 Allowed 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.411 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.431 ' HD1' ' HB3' ' A' ' 71' ' ' ASP . 34.1 m95 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.606 -0.712 . . . . 0.0 110.905 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.461 ' O ' ' HD2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 120.712 0.291 . . . . 0.0 111.507 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.681 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -137.38 144.19 42.33 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.389 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.514 ' O ' ' HA ' ' A' ' 8' ' ' THR . 3.7 tt0 -122.79 125.65 45.88 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.612 ' CZ ' ' H62' ' D' ' 192' ' ' ' DA' . 4.3 ttt-85 -78.32 112.51 15.4 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.958 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.764 HG13 ' CD1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -95.45 122.47 46.95 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.542 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 175.069 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.718 HG21 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -131.89 109.83 10.36 Favored 'General case' 0 C--N 1.299 -1.589 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.889 -177.03 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.567 HG11 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -102.92 107.71 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.364 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.827 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 6.1 p -70.97 98.19 1.57 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.464 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.632 ' HB ' ' HB3' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.94 -148.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.888 -178.449 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.598 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 15.6 t70 106.55 6.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 122.197 0.998 . . . . 0.0 108.591 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.68 -41.68 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.6 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.793 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -78.57 42.32 0.43 Allowed 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -176.875 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.493 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 41.0 m 67.97 -2.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 177.087 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.892 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -54.23 -51.02 65.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.878 0.763 . . . . 0.0 110.604 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.591 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 6.2 mm-40 -50.0 -43.99 50.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.94 -176.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.734 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -53.55 -27.9 28.65 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.764 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.902 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -77.58 -55.46 5.34 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.622 0.725 . . . . 0.0 110.906 178.184 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.591 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.6 OUTLIER -65.87 -25.44 67.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.832 179.848 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.82 -28.35 48.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.007 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.563 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 16.0 m-30 -88.57 -42.56 11.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.897 178.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 25.3 t70 121.29 62.4 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 124.58 1.175 . . . . 0.0 109.775 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.462 ' HB ' HD12 ' B' ' 117' ' ' LEU . 51.3 t -144.21 -48.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.975 -178.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.405 ' HB3' HD13 ' B' ' 124' ' ' ILE . 53.4 m-80 64.54 -113.95 0.34 Allowed 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -178.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.668 HG21 ' HE2' ' A' ' 32' ' ' MET . 0.1 OUTLIER -146.93 4.28 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 114.66 1.355 . . . . 0.0 114.66 179.245 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.496 ' HB2' ' P ' ' C' ' 177' ' ' ' DG' . 27.6 t -40.58 -64.6 0.5 Allowed 'General case' 0 C--O 1.241 0.643 0 C-N-CA 120.139 -0.625 . . . . 0.0 109.905 -178.274 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.71 -25.41 35.36 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.787 177.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.605 ' CD1' ' HG2' ' A' ' 35' ' ' GLU . 4.3 tp -60.84 -61.41 2.61 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 179.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.726 ' O ' ' HG2' ' B' ' 132' ' ' MET . 3.1 t -52.48 -65.57 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.884 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.64 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 8.8 p -46.94 -44.23 19.75 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.24 -43.81 49.57 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 119.097 0.862 . . . . 0.0 109.392 178.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 18.9 m -59.58 -39.9 85.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.479 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.791 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 6.4 mmt -61.05 -57.5 12.34 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.341 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -34.24 56.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 118.152 0.433 . . . . 0.0 111.745 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -79.23 -47.86 15.2 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.182 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.411 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -72.87 -22.2 60.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.988 0.423 . . . . 0.0 109.925 177.855 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.57 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -71.71 -45.2 62.56 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.6 mmt85 -67.5 -56.05 11.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.104 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.434 ' HD2' ' N ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER -69.59 -43.0 73.71 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.052 -1.431 . . . . 0.0 114.287 -177.099 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.616 ' CD1' ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 15.91 -88.72 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -177.067 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.04 113.68 27.35 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.949 0.404 . . . . 0.0 111.902 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 177.3 161.89 0.48 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.682 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.431 ' HB3' ' H ' ' B' ' 143' ' ' ARG . 0.0 OUTLIER -154.38 -89.54 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.431 ' H ' ' HB3' ' B' ' 142' ' ' GLU . 0.7 OUTLIER -124.81 -168.16 1.78 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.238 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.443 ' O ' ' CB ' ' B' ' 145' ' ' LYS . 0.0 OUTLIER -84.36 145.36 28.27 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 179.409 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.443 ' CB ' ' O ' ' B' ' 144' ' ' TRP . 1.8 tttt 84.95 158.1 0.1 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.333 -0.394 . . . . 0.0 109.989 -179.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.55 ' HA ' ' HB2' ' A' ' 49' ' ' GLN . 6.5 t -125.08 -117.67 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.236 -179.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 53.69 -110.72 0.56 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 117.582 0.174 . . . . 0.0 110.975 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 58.16 -172.13 0.1 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.61 0.243 . . . . 0.0 111.132 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.39 158.67 2.34 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.942 0.401 . . . . 0.0 111.778 -179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.61 156.28 41.18 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.842 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -167.07 172.66 42.21 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.595 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 29.5 tpp -153.69 156.53 38.02 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.836 0.351 . . . . 0.0 111.283 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 7.2 p -159.41 103.53 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-O 121.141 0.496 . . . . 0.0 110.996 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -118.54 152.24 36.35 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.841 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 4.1 t -132.1 -123.84 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.492 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 75.17 105.81 0.07 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.116 0.484 . . . . 0.0 111.586 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -116.51 118.87 33.86 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.981 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 4.8 t80 177.64 106.48 0.02 OUTLIER 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.248 0.547 . . . . 0.0 110.826 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.91 19.87 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.392 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -97.61 107.15 19.59 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.831 0.348 . . . . 0.0 111.505 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 12.4 tpt -120.83 146.52 46.46 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -153.49 -176.22 5.71 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.349 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -104.58 -147.14 16.3 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 121.033 -0.603 . . . . 0.0 113.004 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 16.0 p -139.87 171.26 14.46 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.827 0.346 . . . . 0.0 111.298 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -162.93 92.94 0.79 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.141 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -156.53 138.01 13.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.369 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.54 70.56 3.93 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.084 0.469 . . . . 0.0 110.901 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -71.06 85.78 0.73 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.281 0.563 . . . . 0.0 111.496 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -65.7 143.96 57.22 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.965 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.551 ' HD3' ' N ' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -162.74 -38.46 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.512 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.556 ' O ' ' HB2' ' B' ' 172' ' ' TRP . 34.9 m-20 71.82 152.74 0.12 Allowed 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.287 179.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.556 ' HB2' ' O ' ' B' ' 171' ' ' ASP . 71.7 m95 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 123.183 0.593 . . . . 0.0 111.405 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.881 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.272 0 C4'-C3'-C2' 101.396 -1.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.64 H5'' " H2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.513 -0.607 0 C3'-C2'-C1' 106.409 2.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.609 ' C8 ' " C2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.554 0 O4'-C1'-C2' 107.138 0.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.491 ' C6 ' H2'' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.872 0 C4'-C3'-C2' 104.734 1.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.53 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.843 0 C4'-C3'-C2' 104.495 1.295 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.69 ' H73' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.87 0 C1'-O4'-C4' 107.309 -1.708 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.596 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 C3'-C2'-C1' 104.916 1.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.596 " O5'" H2'' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.601 0 C3'-C2'-C1' 101.104 -1.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.565 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 O4'-C1'-C2' 107.341 1.128 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.577 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.743 0 C3'-C2'-C1' 105.311 1.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.647 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.572 0 O4'-C1'-C2' 107.032 0.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.647 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.79 0 N19-C1'-C2' 115.19 0.619 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C4'-C3'-C2' 100.978 -2.222 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.875 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.215 1.014 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.761 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.54 0 O4'-C1'-C2' 106.95 0.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.761 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 C1'-O4'-C4' 110.268 0.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.463 ' C8 ' ' N7 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.49 0 O4'-C1'-C2' 107.078 0.889 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.612 ' C8 ' ' H73' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.935 0 C1'-O4'-C4' 106.885 -2.011 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.612 ' H73' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.531 0.72 0 O4'-C4'-C3' 103.876 -1.724 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.612 ' H62' ' CZ ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 C3'-C2'-C1' 105.434 1.953 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.492 " O5'" H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 N19-C1'-C2' 115.61 0.881 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.488 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.805 0 C4'-C3'-C2' 104.766 1.566 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.412 ' C2 ' ' N7 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.071 0 C1'-O4'-C4' 107.416 -1.631 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.412 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C4'-C3'-C2' 104.425 1.225 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 O4'-C1'-C2' 105.296 -0.731 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 C3'-C2'-C1' 101.991 -0.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 120.514 0.197 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.588 ' HA ' ' CB ' ' B' ' 110' ' ' ASP . 0.0 OUTLIER 68.82 150.09 0.08 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.193 0.52 . . . . 0.0 111.746 -179.663 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.593 ' O ' ' HA ' ' B' ' 108' ' ' THR . 15.8 tt0 -129.6 113.12 14.42 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 121.491 0.662 . . . . 0.0 110.997 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.735 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.3 ttm180 -78.77 109.8 13.35 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.598 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.652 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -102.54 109.82 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.059 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 176.153 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.834 ' CG2' ' HG2' ' B' ' 104' ' ' ARG . 1.5 m -117.25 118.55 32.59 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 120.264 -0.574 . . . . 0.0 111.463 -175.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.549 ' HA ' ' OP2' ' C' ' 177' ' ' ' DG' . 0.2 OUTLIER -101.75 106.22 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.24 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.552 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.6 OUTLIER -70.83 79.91 0.62 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.209 0.528 . . . . 0.0 110.375 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.695 HG22 ' CD1' ' A' ' 14' ' ' TYR . 6.2 m -72.84 -158.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.37 -178.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.581 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 10.9 t70 93.55 -22.66 0.06 Allowed 'General case' 0 C--N 1.351 0.643 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -176.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.473 ' OG ' ' HE3' ' B' ' 102' ' ' LYS . 0.4 OUTLIER -116.37 -1.58 12.27 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.896 177.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.723 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -110.7 -95.58 0.42 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.774 177.596 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.754 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.3 OUTLIER -173.85 30.34 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 118.481 0.582 . . . . 0.0 111.96 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.795 ' CD2' HG21 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -70.34 -39.11 74.89 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.533 0.733 . . . . 0.0 112.243 179.091 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.537 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.8 OUTLIER -49.79 -47.94 50.9 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -176.442 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.581 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -49.53 -28.96 6.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -179.468 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.574 HD21 ' CG1' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -78.26 -60.16 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.391 0.615 . . . . 0.0 111.057 178.101 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.538 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.67 -25.5 68.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.648 179.496 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.4 -27.11 34.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.647 179.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.699 ' CE2' HD13 ' B' ' 139' ' ' LEU . 14.8 m-30 -88.58 -52.32 5.22 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.862 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.686 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 16.6 p-10 147.02 40.86 0.0 OUTLIER 'General case' 0 C--N 1.357 0.924 0 O-C-N 124.638 1.211 . . . . 0.0 111.395 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.574 ' CG1' HD21 ' A' ' 17' ' ' LEU . 14.4 p -138.08 89.33 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.162 0.506 . . . . 0.0 112.317 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.532 ' O ' HD12 ' A' ' 24' ' ' ILE . 5.4 m-20 -76.78 50.89 0.73 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.161 0.505 . . . . 0.0 110.636 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.81 ' CG2' ' HE3' ' B' ' 132' ' ' MET . 1.4 pp 33.76 5.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.761 ' HA ' HG21 ' B' ' 107' ' ' VAL . 1.4 p -37.49 -63.55 0.44 Allowed 'General case' 0 C--O 1.247 0.961 0 CA-C-N 119.092 0.86 . . . . 0.0 110.743 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.445 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -76.44 -25.64 65.21 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.003 177.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.675 ' HB3' HG21 ' A' ' 24' ' ' ILE . 3.2 tm? -65.84 -60.21 3.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.51 -0.281 . . . . 0.0 110.791 179.369 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.542 HG21 ' HB ' ' A' ' 24' ' ' ILE . 61.8 t -42.14 -71.6 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 CA-C-N 117.586 0.175 . . . . 0.0 110.642 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.66 ' O ' ' HB2' ' B' ' 113' ' ' SER . 88.2 p -49.57 -34.17 16.95 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.1 m -75.2 -52.14 11.65 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 121.043 -1.036 . . . . 0.0 110.308 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -56.8 -28.45 61.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.403 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.865 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -54.2 -54.44 39.88 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.698 178.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.461 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.55 -33.14 65.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 111.633 -179.416 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.461 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.8 t-20 -76.33 -47.68 22.7 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.598 ' HG2' ' HG ' ' B' ' 127' ' ' LEU . 5.1 tp10 -67.41 -31.47 71.7 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.327 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.479 ' O ' ' HG ' ' A' ' 39' ' ' LEU . . . -72.41 -39.47 67.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.74 179.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.457 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -70.14 -56.2 7.45 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.57 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 38' ' ' ARG . 12.0 mmm180 -79.01 -37.12 39.97 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.823 -177.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.589 HD12 ' CD2' ' B' ' 120' ' ' TYR . 19.3 mt 37.5 66.17 0.47 Allowed 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 121.266 0.555 . . . . 0.0 111.595 -178.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -164.37 125.32 2.15 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.086 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.77 52.82 0.08 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.032 0.444 . . . . 0.0 112.112 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -112.9 127.14 56.12 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.134 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.1 mtm180 179.23 172.02 0.88 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.145 0.498 . . . . 0.0 111.493 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 1.6 p90 -165.68 162.71 18.95 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.53 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.51 139.23 19.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.804 0.335 . . . . 0.0 111.653 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.486 ' CG2' ' HG2' ' B' ' 142' ' ' GLU . 0.7 OUTLIER -141.26 125.23 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.691 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.596 ' HG3' ' HA ' ' B' ' 147' ' ' GLU . 5.2 pm0 -122.16 136.95 54.98 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.256 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.544 ' HB2' ' HB3' ' B' ' 144' ' ' TRP . 57.0 t30 -151.28 144.86 24.95 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.622 ' HB3' ' CB ' ' B' ' 148' ' ' ASN . 3.9 pt20 -155.95 142.14 18.33 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.584 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.77 -43.46 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.042 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -166.43 141.27 6.84 Favored Glycine 0 C--N 1.338 0.691 0 C-N-CA 120.908 -0.663 . . . . 0.0 113.077 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.02 136.46 1.09 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.662 0.268 . . . . 0.0 111.305 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -155.42 -62.26 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.541 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -80.52 156.04 26.71 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 111.333 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.7 t -87.53 -4.84 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 65.75 -49.81 0.39 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.5 mtt85 -65.35 97.16 0.26 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.852 0.358 . . . . 0.0 111.885 -179.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.6 t80 177.84 105.11 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.066 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.3 mm -118.71 -116.55 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.871 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -109.85 172.6 6.76 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.923 0.392 . . . . 0.0 111.249 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.97 151.91 31.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.05 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -61.48 -48.83 79.32 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.588 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 129.03 -122.72 3.99 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.962 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.9 t -164.56 -160.74 0.54 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.716 0.293 . . . . 0.0 111.232 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -130.99 154.66 47.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.948 0.404 . . . . 0.0 111.495 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.48 154.72 38.73 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.175 179.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.17 -67.55 0.47 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.478 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.99 101.15 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 70.22 -178.31 0.22 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.079 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.43 -33.92 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.02 0.438 . . . . 0.0 109.915 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 87.02 103.56 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.793 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.5 t90 . . . . . 0 C--O 1.253 1.281 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.643 -179.008 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.43 ' O ' ' NZ ' ' B' ' 102' ' ' LYS . 1.4 mpt? . . . . . 0 N--CA 1.493 1.681 0 N-CA-C 111.237 0.088 . . . . 0.0 111.237 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.581 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 5.7 mmtm -138.67 148.1 43.6 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 179.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.571 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -100.72 111.76 24.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.823 0.821 . . . . 0.0 112.627 -178.567 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.834 ' HG2' ' CG2' ' A' ' 6' ' ' THR . 0.1 OUTLIER -79.59 101.31 8.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.7 -178.602 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.795 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -107.3 128.52 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 176.101 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.652 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -132.09 129.12 39.54 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.659 -178.494 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.761 HG21 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.23 88.08 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 175.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.735 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 57.9 p -70.82 67.27 0.38 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.467 0.651 . . . . 0.0 109.691 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.707 HG21 ' HB3' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -63.77 -101.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 114.716 -1.129 . . . . 0.0 112.341 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.632 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.2 t70 75.75 -1.89 2.89 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 -173.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' SER . . . . . 0.462 ' H ' ' C ' ' B' ' 109' ' ' VAL . 54.9 p -94.26 -73.8 0.56 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.034 -1.439 . . . . 0.0 109.758 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' B' ' 114' ' ' TYR . 1.1 p-10 -144.83 156.1 43.84 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -175.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.66 ' HB2' ' O ' ' A' ' 29' ' ' SER . 1.0 OUTLIER 48.19 -27.3 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 175.539 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.865 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 1.7 t80 -54.6 -60.04 3.89 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.321 0.964 . . . . 0.0 109.393 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.638 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 48.0 mt-30 -49.75 -42.22 45.79 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.669 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.71 -55.7 15.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.468 0.651 . . . . 0.0 109.375 178.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.657 HD12 ' HB ' ' B' ' 122' ' ' VAL . 0.4 OUTLIER -46.72 -53.89 10.82 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.318 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.638 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -74.5 -25.47 59.38 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.085 179.666 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.501 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.82 -29.83 60.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.647 178.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.681 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 15.0 m-30 -87.94 -40.63 13.77 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.681 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 4.5 p-10 132.92 17.33 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 O-C-N 124.988 1.43 . . . . 0.0 111.751 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.657 ' HB ' HD12 ' B' ' 117' ' ' LEU . 26.1 t -105.34 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.177 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' B' ' 125' ' ' SER . 0.0 OUTLIER -67.43 45.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.092 0.472 . . . . 0.0 111.199 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.628 HG12 ' HE2' ' A' ' 32' ' ' MET . 1.8 pp 32.74 6.56 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 119.457 3.132 . . . . 0.0 119.457 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.558 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 3.7 p -37.93 -62.93 0.51 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 117.973 0.351 . . . . 0.0 111.347 -178.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.457 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -82.85 -24.36 53.15 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.058 178.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.598 ' HG ' ' HG2' ' A' ' 35' ' ' GLU . 2.3 tm? -66.81 -61.51 1.92 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.587 HG21 ' HB ' ' B' ' 124' ' ' ILE . 2.6 t -52.43 -60.64 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-O 121.007 0.432 . . . . 0.0 109.889 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.723 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 63.3 p -54.82 -33.25 61.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.075 -0.966 . . . . 0.0 113.397 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.457 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 3.4 m -79.57 -54.22 6.11 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 121.728 -0.607 . . . . 0.0 111.073 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.04 -36.64 40.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.915 -178.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.81 ' HE3' ' CG2' ' A' ' 24' ' ' ILE . 3.9 mtt -56.77 -53.23 60.18 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.36 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.754 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -56.26 -40.48 74.27 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.742 -179.777 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . 0.534 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 73.9 m-80 -67.98 -55.08 14.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.299 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -34.58 77.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.925 0.393 . . . . 0.0 110.248 178.369 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.581 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -66.38 -45.69 79.21 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.057 178.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.414 ' HD3' ' OE2' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -61.8 -52.17 65.27 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.814 0.816 . . . . 0.0 109.378 177.655 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.452 ' O ' ' N ' ' B' ' 140' ' ' ARG . 1.0 OUTLIER -63.59 -58.06 8.13 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.003 -1.453 . . . . 0.0 112.145 -178.546 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.699 HD13 ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 8.66 59.96 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.323 1.049 . . . . 0.0 113.404 -178.842 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.473 ' HD2' ' O ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER 174.71 -72.72 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.869 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . 0.582 ' HB3' ' HG3' ' B' ' 149' ' ' GLN . . . -175.61 -177.78 1.02 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.486 ' HG2' ' CG2' ' A' ' 46' ' ' VAL . 3.1 tt0 -120.07 142.68 48.65 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.533 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 0.0 OUTLIER -150.06 -79.55 0.13 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.544 ' HB3' ' HB2' ' A' ' 48' ' ' ASN . 17.6 t90 -151.15 -106.62 0.06 Allowed 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -179.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.557 ' O ' ' HB ' ' B' ' 146' ' ' VAL . 7.2 tmtt? -130.85 140.45 50.25 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.935 -0.478 . . . . 0.0 111.984 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' B' ' 145' ' ' LYS . 37.1 t 118.05 -88.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.674 1.19 . . . . 0.0 111.513 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.596 ' HA ' ' HG3' ' A' ' 47' ' ' GLU . 2.7 tt0 -170.49 162.82 8.32 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -179.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . 0.622 ' CB ' ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER 69.3 -161.27 0.18 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.255 179.237 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . 0.582 ' HG3' ' HB3' ' B' ' 141' ' ' ALA . 1.6 pm0 -146.01 59.54 1.24 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . 0.514 ' HB2' ' HA ' ' A' ' 49' ' ' GLN . 5.8 mm-40 -83.6 -78.64 0.22 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.989 -0.445 . . . . 0.0 110.866 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 116.8 61.84 0.32 Allowed Glycine 0 C--N 1.335 0.474 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.099 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -170.24 175.22 5.0 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 122.38 0.272 . . . . 0.0 110.77 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 6.0 p -171.3 116.37 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.199 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -100.9 154.17 18.89 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.953 0.406 . . . . 0.0 111.406 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 5.5 t -127.59 -122.03 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.512 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 67.16 93.26 0.07 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.119 0.485 . . . . 0.0 111.738 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.48 140.82 22.33 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.38 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -174.32 102.92 0.1 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.268 0.556 . . . . 0.0 110.86 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 1.1 mp -132.96 29.55 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.325 179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -100.12 126.1 46.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.432 -179.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 12.6 mtm -144.22 135.54 25.59 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.125 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -143.62 137.32 28.23 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.24 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 177.95 143.13 4.94 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.879 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 19.1 t -170.5 161.0 7.67 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.685 0.279 . . . . 0.0 111.239 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -175.3 154.31 1.69 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.545 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -144.55 67.54 1.26 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.08 0.466 . . . . 0.0 111.334 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.32 81.18 4.94 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.176 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.85 59.32 0.48 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-O 121.308 0.575 . . . . 0.0 110.916 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -110.73 139.13 46.29 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.013 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.51 ' HE2' ' HB2' ' B' ' 172' ' ' TRP . 8.2 ttpt -168.73 30.67 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.355 0.598 . . . . 0.0 109.733 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.7 t70 27.65 71.48 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 114.645 -1.162 . . . . 0.0 112.826 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.51 ' HB2' ' HE2' ' B' ' 170' ' ' LYS . 1.2 m95 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.243 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.883 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.229 0 C3'-C2'-C1' 100.316 -1.703 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.696 " C2'" ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.77 0 C3'-C2'-C1' 105.712 2.151 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.696 ' C8 ' " C2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.131 0.937 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.73 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.811 0 C1'-O4'-C4' 107.343 -1.684 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.73 " O5'" H2'' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 C3'-C2'-C1' 104.961 1.615 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.618 ' C7 ' ' HB ' ' A' ' 6' ' ' THR . . . . . . . . 0 C2'--C1' 1.51 -0.764 0 O4'-C1'-C2' 104.979 -1.019 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.531 ' C2 ' ' C2 ' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 C3'-C2'-C1' 104.87 1.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.531 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.841 0 C3'-C2'-C1' 100.779 -1.372 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.485 ' C2 ' ' C2 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C1'-O4'-C4' 110.552 0.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.435 ' C2 ' ' C2 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 C4'-C3'-C2' 104.428 1.228 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.757 0 C4'-C3'-C2' 104.575 1.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 O4'-C4'-C3' 106.176 0.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 C4'-C3'-C2' 100.873 -2.327 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.865 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O4'-C1'-C2' 107.044 0.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.433 ' OP1' " H4'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-C2' 107.389 1.172 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 O4'-C1'-C2' 107.575 1.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.426 ' OP2' ' HE3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.428 -0.781 0 C3'-C2'-C1' 101.081 -1.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.54 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C1'-O4'-C4' 106.372 -2.377 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.54 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C4'-C3' 104.499 -1.101 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.485 ' C2 ' ' C2 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.793 0 C1'-O4'-C4' 110.728 0.734 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.52 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 C4'-C3'-C2' 104.444 1.244 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.488 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.768 0 C3'-C2'-C1' 105.02 1.657 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.488 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.025 0 O4'-C1'-N19 108.819 1.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C4'-C3'-C2' 104.359 1.159 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -0.976 0 C4'-C3'-C2' 104.57 1.37 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C5'-C4'-O4' 108.672 -0.455 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.434 ' O ' ' C ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.797 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.531 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -23.6 116.93 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -179.053 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.597 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 33.6 tp60 -112.59 110.34 20.45 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.276 178.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.77 ' HG2' HG23 ' B' ' 106' ' ' THR . 5.4 ttm105 -80.0 117.03 20.47 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-O 121.641 0.734 . . . . 0.0 112.662 -178.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.806 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.96 131.95 55.59 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 177.036 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.709 ' HB ' ' CG2' ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.48 121.93 32.08 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.557 -177.422 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.591 ' CG1' ' O ' ' A' ' 7' ' ' VAL . 1.0 OUTLIER -102.72 96.94 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 174.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.594 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 69.7 p -70.92 87.35 0.72 Allowed 'General case' 0 C--N 1.317 -0.84 0 O-C-N 121.102 -0.999 . . . . 0.0 109.921 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.706 HG22 ' HB3' ' A' ' 14' ' ' TYR . 14.0 m -144.86 55.47 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 117.217 2.302 . . . . 0.0 117.217 -177.396 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.753 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 0.8 OUTLIER -73.98 54.33 0.51 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 123.761 1.743 . . . . 0.0 108.277 173.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.51 ' H ' ' C ' ' A' ' 9' ' ' VAL . 28.6 t -164.65 -47.78 0.03 OUTLIER 'General case' 0 C--N 1.27 -2.85 0 CA-C-N 111.463 -2.608 . . . . 0.0 110.905 -178.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.585 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 20.4 m-20 -73.4 47.25 0.22 Allowed 'General case' 0 C--N 1.348 0.502 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.717 -178.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.526 ' O ' ' HB3' ' B' ' 132' ' ' MET . 51.0 m 69.5 -3.07 1.71 Allowed 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.896 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -61.64 -45.23 94.96 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.556 0.693 . . . . 0.0 110.213 179.26 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.747 ' HG3' ' HA ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -48.17 -44.68 32.75 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.092 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.527 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.1 OUTLIER -60.36 -49.01 79.3 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -178.63 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.924 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.1 -44.78 52.22 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.393 0.616 . . . . 0.0 111.372 -179.66 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.737 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 21.2 pttt -79.63 -33.85 41.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.32 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.517 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -62.07 -28.99 70.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.362 178.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.61 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -88.15 -45.29 10.24 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 117.772 -1.109 . . . . 0.0 110.864 179.218 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.676 ' HA ' ' HG3' ' A' ' 52' ' ' MET . 0.4 OUTLIER 152.35 31.46 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.453 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.43 HG22 ' O ' ' A' ' 21' ' ' ASP . 27.1 t -145.52 -33.67 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.502 -0.879 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.562 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 9.9 p30 53.89 -104.42 0.21 Allowed 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -176.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.7 ' HB ' HG21 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -153.66 -0.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 178.456 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.572 ' HA ' HG23 ' B' ' 107' ' ' VAL . 51.8 p -39.01 -64.31 0.46 Allowed 'General case' 0 C--O 1.241 0.648 0 CA-C-N 119.265 0.938 . . . . 0.0 109.505 -178.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.45 -28.64 24.13 Favored Glycine 0 CA--C 1.522 0.475 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.208 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.554 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 2.9 tp -56.45 -58.29 8.67 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.815 0.308 . . . . 0.0 110.357 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.7 HG21 ' HB ' ' A' ' 24' ' ' ILE . 2.6 t -53.99 -62.6 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.669 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 59.9 p -49.43 -45.16 46.11 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.72 -46.07 26.89 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.861 0.362 . . . . 0.0 110.221 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.3 m -61.2 -38.52 86.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.399 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.817 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -51.3 -43.34 61.63 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.135 179.258 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.492 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -63.49 -46.2 87.21 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.558 0.218 . . . . 0.0 110.731 179.02 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.492 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.27 -48.17 79.29 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.746 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.578 ' O ' ' N ' ' A' ' 39' ' ' LEU . 2.5 mm-40 -66.26 -36.14 82.24 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.483 ' N ' HD23 ' B' ' 117' ' ' LEU . . . -59.38 -42.78 92.45 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.719 -0.613 . . . . 0.0 109.466 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -78.36 -56.46 4.43 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.922 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.66 -29.74 29.79 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -176.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.578 ' N ' ' O ' ' A' ' 35' ' ' GLU . 0.3 OUTLIER 26.69 79.54 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.589 0.756 . . . . 0.0 112.374 -178.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.417 ' NH1' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -169.62 88.3 0.16 Allowed 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.485 ' CB ' HG23 ' B' ' 130' ' ' THR . . . -174.92 141.92 0.63 Allowed 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -169.28 94.67 0.3 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.336 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -154.49 162.7 41.01 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -146.42 -179.37 6.71 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.431 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.539 ' HG3' ' CG2' ' A' ' 46' ' ' VAL . 0.9 OUTLIER -152.18 -61.84 0.16 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.539 ' CG2' ' HG3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -172.82 172.74 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 O-C-N 123.233 0.333 . . . . 0.0 110.775 -179.1 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 7.9 pt-20 -89.79 -167.29 1.81 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -172.2 -159.71 0.14 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -110.25 -141.64 0.38 Allowed 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.294 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.46 -159.47 0.96 Allowed 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.979 -0.451 . . . . 0.0 111.554 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.63 75.33 1.15 Allowed Glycine 0 C--N 1.339 0.732 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.402 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.676 ' HG3' ' HA ' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -158.31 146.81 18.77 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.981 0.419 . . . . 0.0 111.878 -179.208 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 14.3 p -172.63 124.65 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.913 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.51 -160.46 1.06 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.4 t -114.28 -124.68 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 122.25 0.22 . . . . 0.0 110.64 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -144.74 85.99 1.78 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.257 0.551 . . . . 0.0 111.374 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.44 106.01 16.34 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.501 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.501 ' N ' ' CD1' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -163.57 89.57 0.6 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.187 0.518 . . . . 0.0 111.734 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -113.74 -133.4 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.803 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.49 171.03 15.67 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.639 0.257 . . . . 0.0 111.073 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.1 ttt -142.86 124.1 14.6 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.909 0.385 . . . . 0.0 111.639 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -144.67 171.22 14.7 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.157 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 171.78 152.85 8.67 Favored Glycine 0 CA--C 1.522 0.471 0 C-N-CA 120.888 -0.672 . . . . 0.0 113.089 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.7 t -157.66 166.22 33.4 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 111.363 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -170.91 148.09 2.79 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.419 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -133.83 105.58 6.86 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.45 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -120.32 116.93 26.52 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.981 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -149.04 91.59 1.87 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.732 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -158.65 143.63 16.17 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.625 -179.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.444 ' NZ ' ' O ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -173.73 -34.63 0.01 OUTLIER 'General case' 0 C--O 1.237 0.442 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.286 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.444 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 2.3 t0 78.21 175.39 0.17 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.023 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.007 0 CA-C-O 117.879 -1.058 . . . . 0.0 111.818 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.477 ' SD ' ' HE2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 N-CA-C 111.216 0.08 . . . . 0.0 111.216 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.553 ' O ' ' HG2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -125.51 104.5 8.45 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.173 0.511 . . . . 0.0 111.927 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.753 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 1.4 tp60 -97.0 121.59 39.05 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.864 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.559 ' HG3' ' OG1' ' A' ' 6' ' ' THR . 2.7 ttm105 -77.8 105.99 9.34 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.734 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.684 HG21 ' CD1' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -99.8 108.69 23.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.022 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 178.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.77 HG23 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -119.35 112.74 19.81 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.416 -173.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.572 HG23 ' HA ' ' A' ' 25' ' ' SER . 1.2 p -100.59 112.13 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.45 177.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.759 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 3.3 p -70.93 87.51 0.73 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.697 HG21 ' CG ' ' B' ' 114' ' ' TYR . 13.2 m -89.37 -143.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.597 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 6.4 t70 87.95 -7.49 0.56 Allowed 'General case' 0 C--N 1.351 0.633 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -176.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.34 -65.52 1.1 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.244 -1.344 . . . . 0.0 107.839 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.669 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -43.53 -86.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.172 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 2.2 m 175.97 41.31 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 118.428 0.558 . . . . 0.0 111.454 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.806 ' CD1' HG21 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -83.6 -45.46 13.47 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.596 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -48.58 -40.68 28.19 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.048 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.81 -56.28 18.97 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.115 0.87 . . . . 0.0 111.705 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.817 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -55.67 -45.74 77.68 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.925 -178.534 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.596 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -73.41 -26.85 61.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.948 179.037 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -70.21 -14.36 62.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.34 177.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.679 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.8 m-85 -87.72 -44.54 11.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.679 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.2 m-20 128.1 9.17 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 O-C-N 125.166 1.541 . . . . 0.0 111.278 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.568 ' HB ' HD11 ' B' ' 117' ' ' LEU . 98.3 t -101.91 -36.29 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.171 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.443 ' OD1' ' HA ' ' B' ' 118' ' ' LYS . 1.3 m-20 54.31 -119.86 1.54 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.763 HG22 HG23 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -137.52 0.56 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 179.399 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.478 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 10.8 p -43.0 -64.63 0.59 Allowed 'General case' 0 C--O 1.243 0.734 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -83.31 -29.19 34.14 Favored Glycine 0 C--N 1.334 0.444 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.893 178.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.688 HD12 ' HG ' ' B' ' 117' ' ' LEU . 4.8 tt -59.57 -61.99 2.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 117.418 0.609 . . . . 0.0 110.944 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.763 HG23 HG22 ' B' ' 124' ' ' ILE . 3.2 t -50.97 -66.44 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 C-N-CA 120.526 -0.47 . . . . 0.0 109.902 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.585 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 22.0 p -48.34 -47.32 37.12 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.485 HG23 ' CB ' ' A' ' 41' ' ' ALA . 0.9 OUTLIER -71.3 -46.39 60.87 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 118.799 0.727 . . . . 0.0 110.457 -179.502 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.56 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.8 OUTLIER -66.37 -34.91 79.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.654 -179.82 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.924 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -60.77 -57.05 14.33 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.287 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.498 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -52.75 -42.0 64.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.651 0.262 . . . . 0.0 111.656 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . 0.497 ' O ' ' HD3' ' B' ' 138' ' ' ARG . 1.7 m-20 -62.29 -55.31 29.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.679 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.64 -8.96 58.01 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.634 178.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.527 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -82.32 -42.55 18.62 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -74.56 -51.99 13.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.398 177.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' B' ' 138' ' ' ARG . 0.2 OUTLIER -63.97 -47.47 80.26 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.568 -178.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.609 ' HG ' ' CD2' ' A' ' 20' ' ' TYR . 0.7 OUTLIER 16.8 81.73 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.849 0.86 . . . . 0.0 112.664 179.159 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.501 ' NE ' ' HB3' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -172.32 -34.4 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.92 -179.814 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . 0.428 ' N ' ' HG2' ' B' ' 140' ' ' ARG . . . -144.86 -171.13 3.57 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.706 0.289 . . . . 0.0 111.302 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -124.34 -167.82 1.71 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.735 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 65.7 179.83 0.2 Allowed 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.184 0.516 . . . . 0.0 112.34 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -73.62 164.26 26.9 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.191 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.8 148.73 44.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.025 0.441 . . . . 0.0 112.106 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.5 p -126.61 -40.2 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.76 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -62.1 -29.63 70.45 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.805 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 8.4 p30 42.53 35.8 0.71 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -44.31 134.95 4.78 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -142.64 131.02 22.24 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.019 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 167.83 103.55 0.17 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.945 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.9 164.52 24.38 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.941 0.4 . . . . 0.0 111.246 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 10.0 p -70.86 64.92 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 121.523 0.678 . . . . 0.0 111.241 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.27 172.13 7.01 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.546 -179.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.4 t -120.05 -124.11 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.494 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -170.45 -67.44 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.721 0.296 . . . . 0.0 111.469 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . 0.435 ' NH1' ' O ' ' B' ' 160' ' ' GLU . 3.6 tmt_? -162.71 140.96 8.49 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.008 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -162.1 96.34 0.99 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.068 0.461 . . . . 0.0 111.185 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 10.8 mt -137.97 -67.5 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.969 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . 0.435 ' O ' ' NH1' ' B' ' 157' ' ' ARG . 0.6 OUTLIER -143.71 153.96 42.99 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 179.63 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.38 -64.73 1.25 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 173.87 -171.21 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.032 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -92.56 -92.83 1.45 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 120.938 -0.649 . . . . 0.0 113.062 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 33.6 t -170.36 -164.39 0.39 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.677 0.275 . . . . 0.0 111.327 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -147.4 139.58 24.43 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 111.605 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -171.62 152.08 3.08 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.293 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -114.45 -86.95 0.59 Allowed 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.679 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.05 137.97 54.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.818 0.342 . . . . 0.0 111.056 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -129.81 -55.59 1.13 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.454 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.96 -32.54 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.2 t0 79.1 -72.05 0.08 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.481 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.116 -0.945 . . . . 0.0 111.038 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.887 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 105.043 1.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.76 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.806 0 C3'-C2'-C1' 104.605 1.361 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.687 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 C1'-O4'-C4' 110.742 0.744 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.541 ' C4 ' ' C5 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 C4'-C3'-C2' 104.339 1.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.676 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.968 0 C4'-C3'-C2' 104.405 1.205 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.676 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.967 0 C1'-O4'-C4' 107.571 -1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.537 ' H8 ' H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.425 0.401 0 O4'-C4'-C3' 104.438 -1.162 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.525 ' H72' ' C8 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C3'-C2'-C1' 100.899 -1.286 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C3'-C2'-C1' 104.36 1.186 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.683 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.525 0.707 0 C3'-C2'-C1' 105.505 2.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.683 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 N19-C1'-C2' 112.502 -1.061 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.537 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C4'-C3'-C2' 104.159 0.959 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C4'-C3'-C2' 100.938 -2.262 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.871 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 N19-C1'-C2' 115.39 0.744 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.526 0.838 0 C3'-C2'-C1' 105.308 1.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.826 H2'' " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 105.131 1.737 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.826 " O4'" H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C4'-C3' 104.022 -1.578 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.45 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.903 0 C3'-C2'-C1' 105.681 2.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.6 ' C7 ' ' HB ' ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 104.464 1.26 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.505 H2'' " O5'" ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.525 0.676 0 C3'-C2'-C1' 106.034 2.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.505 " O5'" H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.569 0 C4'-C3'-C2' 102.403 -0.797 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 C4'-C3'-C2' 104.031 0.831 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.076 0 C1'-O4'-C4' 106.421 -2.342 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C4'-C3'-C2' 104.523 1.323 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.807 0 C4'-C3'-C2' 104.362 1.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.41 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 101.994 -0.504 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.5 ttm . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.67 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER 70.44 134.63 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 122.861 0.464 . . . . 0.0 110.473 -179.222 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.479 ' O ' HG23 ' B' ' 109' ' ' VAL . 33.1 tp60 -120.35 111.52 17.86 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.283 0.564 . . . . 0.0 111.294 -179.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.841 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.4 112.61 16.81 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.049 -179.557 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.736 HG22 ' CD1' ' B' ' 114' ' ' TYR . 0.6 OUTLIER -114.0 129.3 70.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.486 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.763 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.0 OUTLIER -133.01 135.59 45.54 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 117.886 -1.526 . . . . 0.0 113.768 -179.029 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.743 HG23 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.75 95.61 4.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.351 177.052 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 14.5 p -70.62 69.24 0.41 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.694 HG11 ' HB2' ' A' ' 14' ' ' TYR . 10.3 p -92.28 -133.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.835 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.648 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 25.6 t70 97.81 13.34 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.309 1.052 . . . . 0.0 109.348 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.0 t -145.25 -51.75 0.26 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 113.875 -1.511 . . . . 0.0 111.473 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.744 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.2 m-20 -72.82 41.41 0.1 Allowed 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 115.003 1.482 . . . . 0.0 115.003 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.2 OUTLIER 80.89 4.95 1.54 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 176.464 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.807 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 3.5 t80 -58.16 -59.58 5.07 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.525 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 11.7 mt-30 -49.73 -40.05 39.37 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.65 -33.33 9.76 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.548 ' CD1' ' SD ' ' B' ' 132' ' ' MET . 0.7 OUTLIER -78.25 -57.24 3.88 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.187 -0.605 . . . . 0.0 111.921 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.543 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -63.29 -25.18 68.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.718 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.94 -30.63 61.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.987 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.603 ' CD2' HD12 ' B' ' 139' ' ' LEU . 11.3 m-30 -88.34 -38.64 14.98 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 37.6 t70 133.19 43.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 O-C-N 124.336 1.022 . . . . 0.0 109.578 178.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.54 ' CG1' HD21 ' A' ' 17' ' ' LEU . 6.1 p -160.89 78.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.932 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.703 -177.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.489 ' O ' ' HE3' ' B' ' 132' ' ' MET . 0.0 OUTLIER -64.1 -86.9 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.487 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.765 HG13 ' HE2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -166.9 9.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 115.791 1.775 . . . . 0.0 115.791 178.966 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.569 ' HB2' ' OP1' ' D' ' 190' ' ' ' DG' . 29.0 t -38.36 -65.2 0.36 Allowed 'General case' 0 C--O 1.242 0.704 0 C-N-CA 120.211 -0.596 . . . . 0.0 110.551 -177.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.489 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -90.25 -24.91 27.8 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.584 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.557 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 0.7 OUTLIER -60.6 -56.94 15.26 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.105 -0.056 . . . . 0.0 111.008 179.317 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.723 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.0 t -57.21 -61.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.717 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 57.5 p -50.63 -41.92 55.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -75.21 -50.19 16.99 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.685 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.462 ' N ' ' CG2' ' A' ' 30' ' ' THR . 17.2 m -53.15 -43.76 67.25 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.804 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 11.7 mtt -52.59 -52.7 54.0 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.499 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -55.53 -37.38 67.86 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.828 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -48.46 40.23 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -68.41 -27.35 66.13 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.259 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.583 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -83.1 -46.27 12.98 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.746 0.818 . . . . 0.0 110.73 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.472 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -51.98 -51.64 55.84 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 121.819 0.819 . . . . 0.0 109.482 178.423 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -37.91 49.12 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.14 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.779 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 42.99 44.81 4.19 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.323 -179.853 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 4.0 tpt180 174.4 76.09 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.057 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -165.94 163.89 18.45 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.563 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 3.3 mt-10 -161.48 -92.62 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.051 179.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.563 ' HD3' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 63.25 131.64 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.88 0.848 . . . . 0.0 112.667 178.724 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -97.47 -165.33 1.24 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.242 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 46' ' ' VAL . 7.6 tmtt? -129.79 130.37 45.26 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.801 0.334 . . . . 0.0 111.826 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.415 ' O ' ' HE2' ' A' ' 45' ' ' LYS . 8.4 p -92.57 132.02 38.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.451 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.413 ' HA ' ' OE1' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -77.21 76.99 3.75 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.365 0.602 . . . . 0.0 111.931 -178.942 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -116.84 145.84 43.29 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.114 179.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 pm0 -60.1 133.91 56.55 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 120.804 0.335 . . . . 0.0 111.394 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -134.82 -59.87 0.79 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.036 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 130.4 -122.43 3.62 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.418 -0.42 . . . . 0.0 112.333 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -149.96 139.23 21.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.621 0.248 . . . . 0.0 110.744 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 11.1 t -138.0 76.77 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-O 121.049 0.452 . . . . 0.0 111.866 -179.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -81.91 101.83 10.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.729 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.9 t -118.08 -126.27 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.392 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.44 -58.48 0.23 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.552 0.215 . . . . 0.0 111.44 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -53.5 162.5 0.79 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.885 0.374 . . . . 0.0 110.987 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -147.33 92.53 2.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.402 0.62 . . . . 0.0 110.556 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 14.2 mm -138.51 105.75 3.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.154 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.551 ' HB2' ' CB ' ' B' ' 141' ' ' ALA . 5.1 tp10 -116.16 153.59 31.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.983 178.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.6 ' HB2' ' HG3' ' B' ' 145' ' ' LYS . 2.7 mtm -143.92 -70.57 0.3 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.602 0.239 . . . . 0.0 111.628 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -146.68 -87.05 0.1 Allowed 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 103.25 75.59 1.08 Allowed Glycine 0 C--N 1.335 0.473 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.597 ' HB3' ' HB2' ' B' ' 148' ' ' ASN . 0.5 OUTLIER -168.92 -162.92 0.4 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.332 0.123 . . . . 0.0 111.332 -178.995 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -106.98 -58.36 1.95 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.422 0.526 . . . . 0.0 112.422 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.446 ' HB1' ' HA ' ' B' ' 148' ' ' ASN . . . 70.33 -59.95 0.5 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.442 0.297 . . . . 0.0 111.463 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 55.06 29.11 11.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.262 0.553 . . . . 0.0 111.444 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.55 86.01 1.17 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.822 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.5 p30 -54.02 153.7 4.75 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.77 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.416 ' O ' ' CB ' ' A' ' 71' ' ' ASP . 0.9 OUTLIER -170.95 -37.42 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.99 0.424 . . . . 0.0 110.036 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.416 ' CB ' ' O ' ' A' ' 70' ' ' LYS . 0.4 OUTLIER 88.4 124.89 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.818 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 27.8 m95 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.151 -0.928 . . . . 0.0 111.09 -179.591 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.428 ' O ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.763 0 N-CA-C 110.696 -0.112 . . . . 0.0 110.696 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -120.37 105.45 10.91 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 111.051 179.455 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.648 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 3.8 tm0? -95.62 123.2 39.06 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.541 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.552 ' HD2' ' N7 ' ' D' ' 192' ' ' ' DA' . 14.3 ttm-85 -77.14 101.81 6.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.713 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.782 ' CG1' ' CE1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -93.34 107.64 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.392 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 177.354 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.789 HG21 ' HG2' ' A' ' 4' ' ' ARG . 1.2 m -118.18 110.91 18.16 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.317 0.579 . . . . 0.0 112.328 -175.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.572 ' HA ' ' OP2' ' D' ' 190' ' ' ' DG' . 0.1 OUTLIER -102.13 106.3 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.987 177.138 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.841 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 4.7 p -70.92 88.36 0.75 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.844 0.354 . . . . 0.0 110.1 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.678 HG21 ' CD2' ' B' ' 114' ' ' TYR . 10.9 m -80.34 -142.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.488 -178.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.67 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER 86.28 -15.75 0.46 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -176.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.4 m -112.23 -68.93 0.9 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.944 -1.026 . . . . 0.0 108.691 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.717 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 2.2 m-20 -43.71 -93.24 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -178.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.505 ' HB3' ' O ' ' A' ' 29' ' ' SER . 1.8 t -177.98 47.71 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 121.567 0.699 . . . . 0.0 111.257 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.804 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -82.79 -45.51 14.24 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.082 -179.493 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.541 ' O ' ' N ' ' B' ' 119' ' ' ALA . 0.1 OUTLIER -48.59 -42.48 34.02 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.568 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.56 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -51.81 -47.37 64.33 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 119.305 0.957 . . . . 0.0 112.073 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.725 HD23 ' HA ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -59.72 -51.8 68.22 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.313 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.591 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -74.13 -28.6 61.41 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.618 179.773 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -60.31 -28.2 67.93 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.33 178.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.779 ' CD2' ' HG ' ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.44 -44.64 10.58 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.235 -0.888 . . . . 0.0 109.602 178.18 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.583 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.58 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 176.631 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.461 ' O ' HD13 ' B' ' 117' ' ' LEU . 38.8 t -146.64 94.71 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.591 ' O ' HD13 ' B' ' 124' ' ' ILE . 28.9 m-20 -71.43 57.12 0.25 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.86 178.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.732 HG12 ' HE2' ' A' ' 32' ' ' MET . 0.6 OUTLIER 43.06 0.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 -179.483 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.743 ' HA ' HG23 ' A' ' 7' ' ' VAL . 14.9 p -38.66 -64.52 0.43 Allowed 'General case' 0 C--O 1.246 0.902 0 CA-C-N 119.144 0.884 . . . . 0.0 110.516 -178.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.603 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.9 -15.12 68.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.229 177.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.678 ' CD1' ' HG ' ' B' ' 117' ' ' LEU . 4.8 tt -72.63 -62.04 1.59 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 117.318 0.559 . . . . 0.0 110.348 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.686 HG23 HG21 ' A' ' 28' ' ' VAL . 75.1 t -44.78 -63.86 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.379 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.744 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 53.6 p -53.09 -51.45 61.82 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.603 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -67.55 -47.06 70.93 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 118.746 0.703 . . . . 0.0 110.103 -178.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.9 OUTLIER -53.22 -37.61 62.2 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.812 179.597 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.807 ' HG3' ' HA ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -49.83 -49.17 50.0 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.774 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -43.66 98.35 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -67.06 -51.51 53.73 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.53 ' HG2' ' CD1' ' A' ' 27' ' ' LEU . 4.7 tp10 -58.73 -36.18 73.9 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.888 178.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -71.25 -42.42 68.86 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 121.026 0.441 . . . . 0.0 110.077 178.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.454 ' HD2' ' HA ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -61.42 -52.6 63.89 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.617 0.723 . . . . 0.0 110.139 178.244 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.404 ' HD2' ' HA ' ' B' ' 138' ' ' ARG . 1.0 OUTLIER -83.41 -47.66 11.18 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.228 -1.351 . . . . 0.0 113.865 -176.439 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.603 HD12 ' CD2' ' A' ' 20' ' ' TYR . 29.8 mt 40.05 34.1 0.18 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 121.03 0.443 . . . . 0.0 111.054 -177.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.403 ' HD2' ' HA ' ' B' ' 140' ' ' ARG . 0.0 OUTLIER 166.37 123.62 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.36 -179.032 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . 0.551 ' CB ' ' HB2' ' A' ' 60' ' ' GLU . . . -138.44 150.27 46.31 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.415 ' O ' ' NZ ' ' B' ' 145' ' ' LYS . 0.0 OUTLIER -118.67 174.2 6.41 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.588 179.23 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.522 ' O ' ' HB2' ' B' ' 144' ' ' TRP . 0.2 OUTLIER -79.8 177.94 8.54 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.522 ' HB2' ' O ' ' B' ' 143' ' ' ARG . 6.2 m-90 82.19 103.49 0.06 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.477 0.711 . . . . 0.0 112.387 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.6 ' HG3' ' HB2' ' A' ' 61' ' ' MET . 7.6 ptpt 167.67 162.65 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.969 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 48.9 t -131.02 -101.7 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -146.06 -177.37 5.57 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . 0.597 ' HB2' ' HB3' ' A' ' 64' ' ' SER . 1.9 t30 179.12 149.76 0.27 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.485 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.03 173.21 6.94 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.359 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -175.44 3.05 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.932 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -174.13 132.63 2.31 Favored Glycine 0 C--N 1.336 0.582 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.311 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 20.8 ttm -164.13 139.16 5.9 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 122.322 0.249 . . . . 0.0 110.718 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 9.6 p -166.5 147.5 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 120.93 0.395 . . . . 0.0 111.993 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.35 166.62 32.91 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.651 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 4.0 t -128.5 -124.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.975 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 172.53 106.05 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.844 0.458 . . . . 0.0 110.812 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -103.73 130.29 51.22 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.57 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -164.9 87.55 0.45 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.105 0.478 . . . . 0.0 112.155 -179.917 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 44.8 mm -114.94 91.61 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.275 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -115.08 145.01 42.76 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 28.1 ttm -161.55 141.43 10.41 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.359 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -143.92 152.64 41.37 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.017 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -87.38 -145.26 9.62 Favored Glycine 0 C--N 1.333 0.411 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.537 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 4.4 m -173.63 169.01 4.36 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 122.709 -0.289 . . . . 0.0 111.192 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -118.15 158.77 24.45 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.782 0.325 . . . . 0.0 111.691 -179.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -146.51 148.51 32.27 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.305 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.99 -13.62 11.9 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.978 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -56.97 88.95 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.131 0.491 . . . . 0.0 111.644 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -96.8 -1.55 46.0 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.066 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.427 ' HE2' ' O ' ' B' ' 170' ' ' LYS . 1.2 tmtt? -171.6 -38.12 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.401 ' CB ' ' O ' ' B' ' 170' ' ' LYS . 0.3 OUTLIER 86.36 127.37 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.315 179.044 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . 0.404 ' CE3' ' HA ' ' B' ' 172' ' ' TRP . 3.4 m95 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.403 -0.808 . . . . 0.0 111.163 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.878 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.446 1.149 0 C2'-C3'-O3' 114.611 1.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.739 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.854 0 C3'-C2'-C1' 104.693 1.423 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.626 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 104.29 1.136 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.46 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.77 0 C1'-O4'-C4' 107.264 -1.74 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.624 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.824 0 C4'-C3'-C2' 104.721 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.655 H2'' " O5'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.536 0.804 0 C4'-C3'-C2' 104.529 1.329 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.655 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.583 0 C3'-C2'-C1' 105.096 1.712 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.548 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.827 0 C3'-C2'-C1' 101.049 -1.179 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.514 ' C2 ' ' C2 ' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 104.29 1.136 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.514 ' C2 ' ' C2 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C3'-C2'-C1' 105.657 2.112 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.497 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 104.195 1.068 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.592 " C2'" " H5'" ' C' ' 185' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 105.518 2.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . 0.592 " H5'" " C2'" ' C' ' 184' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.513 -0.451 0 C4'-C3'-C2' 101.055 -2.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.904 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.44 0.686 0 O4'-C1'-C2' 107.53 1.3 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.904 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C4'-C3'-C2' 103.993 0.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 C3'-C2'-C1' 101.685 -0.725 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.824 H2'' " O5'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -1.006 0 C1'-O4'-C4' 106.672 -2.163 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.824 " O5'" H2'' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.405 -1.124 0 C3'-C2'-C1' 105.077 1.698 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.629 ' C7 ' ' HB ' ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C3'-C2'-C1' 105.157 1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.552 ' N7 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 C3'-C2'-C1' 106.317 2.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.566 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 N19-C1'-C2' 116.01 1.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.566 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 C4'-C3'-C2' 104.361 1.161 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.527 0.937 0 C1'-O4'-C4' 107.287 -1.724 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.412 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 104.338 1.17 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.589 H2'' ' C8 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C4'-C3'-C2' 104.34 1.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.589 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C3'-C2'-C1' 101.756 -0.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -30.16 126.89 0.14 Allowed 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.604 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.457 ' O ' ' N ' ' B' ' 109' ' ' VAL . 10.1 tp60 -105.63 111.57 24.32 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.465 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.838 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 1.3 ttm105 -79.3 105.93 10.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.754 HG23 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -112.59 122.32 66.56 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.754 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -125.41 129.67 50.34 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.921 -177.098 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.512 HG11 ' CG1' ' B' ' 105' ' ' ILE . 0.4 OUTLIER -100.36 107.07 20.32 Favored 'Isoleucine or valine' 0 C--N 1.343 0.295 0 N-CA-C 106.973 -1.492 . . . . 0.0 106.973 176.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.429 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 16.6 p -70.57 95.64 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.189 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.648 ' CG1' ' HB3' ' A' ' 14' ' ' TYR . 1.5 t -89.51 -143.55 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.21 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.508 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 33.7 t70 95.94 -10.14 0.09 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.5 t -126.0 -58.78 1.37 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 114.77 -1.105 . . . . 0.0 109.378 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.64 ' CB ' ' CB ' ' B' ' 129' ' ' SER . 0.9 OUTLIER -47.6 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.51 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 m -177.54 38.48 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.248 -0.908 . . . . 0.0 110.933 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.889 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -80.56 -39.17 28.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.346 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.551 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.78 -43.25 48.21 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.364 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.44 ' HB3' ' HB3' ' B' ' 136' ' ' ALA . 1.6 mt -48.33 -32.24 7.17 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.87 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -78.16 -60.09 2.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.092 179.028 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -61.79 -25.79 67.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.982 178.707 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.81 -30.85 71.79 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.75 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.719 ' CE2' ' CD2' ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.6 -35.47 16.84 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.772 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.63 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 27.7 t70 142.99 31.2 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 123.724 0.64 . . . . 0.0 112.211 176.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.599 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.0 t -160.95 100.85 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.531 ' HB3' HD11 ' A' ' 24' ' ' ILE . 70.1 m-20 -55.78 -89.75 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 178.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.749 ' CG2' ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -157.01 6.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.624 ' HA ' HG23 ' B' ' 107' ' ' VAL . 1.7 t -38.92 -64.44 0.45 Allowed 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.201 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.35 -23.36 51.5 Favored Glycine 0 C--N 1.335 0.496 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.02 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.749 ' HB3' ' CG2' ' A' ' 24' ' ' ILE . 0.1 OUTLIER -65.65 -57.9 7.01 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 122.621 0.369 . . . . 0.0 111.2 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.756 ' CG1' ' SD ' ' A' ' 32' ' ' MET . 3.8 t -51.55 -63.29 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.547 0.689 . . . . 0.0 109.21 178.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.703 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -50.16 -46.91 54.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.836 -1.075 . . . . 0.0 113.382 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.6 m -69.61 -50.27 46.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 121.311 0.577 . . . . 0.0 109.502 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.494 ' OG1' HG23 ' B' ' 131' ' ' THR . 1.8 m -55.16 -39.27 69.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.408 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.905 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -60.58 -57.28 13.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.429 179.006 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.408 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -53.7 -40.43 66.0 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.25 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.408 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 80.4 m-20 -70.69 -48.91 52.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.34 179.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.53 ' CB ' HD21 ' B' ' 117' ' ' LEU . 3.5 mm-40 -68.67 -24.92 64.57 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.27 178.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.26 -47.23 58.33 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -65.56 -54.79 22.97 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.49 0.662 . . . . 0.0 109.929 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.432 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -58.22 -50.89 71.96 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.438 -1.256 . . . . 0.0 110.928 -178.924 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.655 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 9.61 69.93 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 178.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 167.04 74.61 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 120.713 0.292 . . . . 0.0 111.482 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -165.8 156.4 13.22 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -102.94 143.75 32.12 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.828 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -96.57 169.21 10.05 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.985 0.422 . . . . 0.0 111.927 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 p-90 -125.61 -152.53 0.52 Allowed 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.235 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.75 127.88 56.26 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.084 -0.385 . . . . 0.0 111.675 -179.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.22 133.97 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.391 179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -147.73 126.3 12.49 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.366 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -178.84 147.61 0.37 Allowed 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.039 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -100.47 127.63 46.76 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.399 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -144.69 144.68 31.34 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.916 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -175.8 87.22 0.08 OUTLIER Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.571 -0.824 . . . . 0.0 113.582 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.2 ptt? -116.45 -174.31 2.54 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.604 0.202 . . . . 0.0 111.004 179.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 12.2 p -155.46 135.81 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.791 0.329 . . . . 0.0 111.374 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -130.89 -179.36 5.27 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.703 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.4 t -108.98 -125.35 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.885 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 178.31 -85.02 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.537 0.208 . . . . 0.0 111.375 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.1 131.05 19.21 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.802 0.334 . . . . 0.0 111.143 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -154.02 50.53 0.66 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.286 0.565 . . . . 0.0 111.025 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.414 ' O ' ' C ' ' A' ' 60' ' ' GLU . 3.1 mp -133.09 -45.86 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.001 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.414 ' C ' ' O ' ' A' ' 59' ' ' ILE . 1.5 mp0 15.71 65.75 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.597 1.159 . . . . 0.0 113.621 178.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.76 133.9 18.27 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.992 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -160.35 158.53 29.81 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.334 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 111.79 138.97 7.64 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.829 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.6 t -160.76 145.89 14.36 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.637 0.256 . . . . 0.0 111.183 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -163.88 129.96 3.09 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.049 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -162.29 73.35 0.38 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.026 0.441 . . . . 0.0 111.54 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.92 63.2 0.63 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.154 0.502 . . . . 0.0 111.078 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.07 167.0 22.76 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.715 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.58 -61.46 0.19 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.058 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.22 -30.66 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 t0 82.13 -70.17 0.06 Allowed 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.779 -1.1 . . . . 0.0 111.685 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.707 -0.664 . . . . 0.0 111.198 179.692 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.415 ' O ' ' C ' ' B' ' 102' ' ' LYS . 10.0 ttt . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.415 ' C ' ' O ' ' B' ' 101' ' ' MET . 0.1 OUTLIER -29.05 116.72 0.11 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.801 0.441 . . . . 0.0 111.866 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.598 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 1.3 tt0 -96.43 111.92 23.85 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.099 0.475 . . . . 0.0 111.747 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.46 ' NE ' ' O4 ' ' C' ' 178' ' ' ' DT' . 0.1 OUTLIER -77.93 102.39 7.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.76 . . . . 0.0 112.198 -178.625 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.786 HG23 ' CD2' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -104.92 117.44 50.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 177.114 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.754 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -120.81 123.25 42.14 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -175.364 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.624 HG23 ' HA ' ' A' ' 25' ' ' SER . 0.9 OUTLIER -100.26 103.32 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.111 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.838 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.6 p -71.65 91.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.766 HG23 ' CG ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -93.33 -139.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 118.028 -0.987 . . . . 0.0 111.332 -178.143 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.629 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 28.4 t70 119.86 5.1 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.003 0.921 . . . . 0.0 109.49 -177.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -175.15 -26.87 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.703 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.2 OUTLIER -70.77 41.57 0.06 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -176.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.613 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.8 m 62.57 -0.32 0.55 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.905 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -57.55 -52.04 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 179.856 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.429 ' O ' ' CB ' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.98 -36.83 18.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.505 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.428 ' HB3' ' HB2' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.05 -56.49 21.32 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -179.661 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.696 ' HB2' ' CG ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -48.26 -51.64 24.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.334 0.588 . . . . 0.0 111.603 -178.583 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.556 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.9 pttt -76.73 -26.68 54.88 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.891 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.429 ' CB ' ' O ' ' B' ' 115' ' ' GLN . . . -63.55 -25.63 68.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.856 178.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.655 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -87.96 -42.38 12.51 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 118.524 -0.751 . . . . 0.0 109.8 178.698 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.541 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 158.41 37.04 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 177.264 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.57 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 0.8 OUTLIER -163.21 92.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.109 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.548 ' O ' HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -70.71 61.89 0.25 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.176 0.512 . . . . 0.0 110.531 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.805 ' CG2' ' HE3' ' A' ' 32' ' ' MET . 0.6 OUTLIER 39.37 -8.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 119.162 3.023 . . . . 0.0 119.162 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.479 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.61 -62.59 0.59 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.675 1.125 . . . . 0.0 110.944 -178.233 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.37 -30.15 25.62 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.44 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.56 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -60.87 -61.44 2.58 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 122.631 0.372 . . . . 0.0 111.447 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 28' ' ' VAL . 2.2 t -55.18 -58.02 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-O 120.636 0.255 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.64 ' CB ' ' CB ' ' A' ' 12' ' ' ASP . 12.0 p -50.29 -41.56 50.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.187 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.8 m -74.38 -52.87 10.87 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.494 HG23 ' OG1' ' A' ' 31' ' ' THR . 0.6 OUTLIER -51.93 -44.18 63.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.174 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.889 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 25.9 mtt -49.29 -40.77 35.99 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.872 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -43.92 94.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.757 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -49.76 67.56 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.545 ' HG2' HD13 ' A' ' 17' ' ' LEU . 2.6 tp10 -60.71 -37.49 81.86 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.508 ' HA ' HD12 ' B' ' 139' ' ' LEU . . . -67.41 -49.94 61.62 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.904 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.65 -48.22 63.46 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 121.965 0.888 . . . . 0.0 109.187 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -51.92 -26.65 10.78 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.753 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.719 ' CD2' ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -96.34 71.91 2.78 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.075 0.464 . . . . 0.0 109.944 177.758 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 3.4 ttp180 -92.7 -12.72 30.71 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -179.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 63.67 -164.89 0.25 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.621 0.248 . . . . 0.0 111.465 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -159.51 111.27 2.07 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.735 0.302 . . . . 0.0 111.308 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 21.7 mtt85 65.82 -175.39 0.18 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.752 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 80.0 m95 70.59 -178.12 0.21 Allowed 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.739 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 3.2 ptpp? -173.47 -55.57 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.582 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 m 37.06 43.91 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 122.864 0.466 . . . . 0.0 112.201 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -61.28 98.42 0.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.253 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -158.8 163.06 37.05 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.067 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -160.78 165.14 30.83 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.472 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.38 178.01 5.64 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.126 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -130.78 -178.64 15.55 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.919 -0.658 . . . . 0.0 113.465 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 6.7 mtt -145.32 156.66 43.93 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.542 0.21 . . . . 0.0 110.882 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 8.2 p -104.06 -46.64 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -140.03 -71.74 0.38 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.523 0.201 . . . . 0.0 111.51 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.2 t -123.18 -125.12 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.864 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.459 ' O ' ' HD2' ' B' ' 157' ' ' ARG . . . -136.99 -45.43 0.57 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . 0.505 ' O ' ' CB ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER 69.27 124.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 122.82 0.448 . . . . 0.0 111.758 179.789 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.505 ' CB ' ' O ' ' B' ' 157' ' ' ARG . 0.3 OUTLIER 98.53 107.23 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.792 0.837 . . . . 0.0 110.079 -179.251 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 50.8 mt -122.09 -80.35 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.27 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' B' ' 161' ' ' MET . 0.1 OUTLIER -137.61 161.99 34.98 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.283 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 161' ' ' MET . . . . . 0.429 ' N ' ' HG3' ' B' ' 160' ' ' GLU . 2.2 ttm -82.92 -50.82 8.19 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.281 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -147.56 -59.26 0.26 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.406 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 135.17 -168.2 23.82 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 121.205 -0.522 . . . . 0.0 112.699 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 48.8 p -129.62 163.54 25.83 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -152.58 130.27 11.58 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.529 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -167.82 170.07 11.07 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.065 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . 0.437 ' O ' ' HB3' ' B' ' 168' ' ' GLU . 4.6 p-10 -84.96 -114.16 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.084 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' B' ' 167' ' ' ASP . 0.7 OUTLIER 177.29 154.65 0.27 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.925 0.393 . . . . 0.0 111.108 179.583 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . 0.471 ' O ' ' HB2' ' B' ' 170' ' ' LYS . 2.7 p30 -122.88 -88.15 0.62 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.728 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' B' ' 169' ' ' ASN . 1.3 tpmp? 170.87 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 35.05 58.78 0.75 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.674 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.115 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.874 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 105.54 2.029 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.745 " H2'" ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.715 0 C3'-C2'-C1' 105.583 2.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.745 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 C3'-C2'-C1' 104.546 1.318 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.481 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.408 -0.896 0 C4'-C3'-C2' 104.463 1.263 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.59 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C4'-C3'-C2' 104.68 1.48 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.642 " H3'" ' O ' ' A' ' 4' ' ' ARG . . . . . . . . 0 O4'--C1' 1.407 -0.991 0 C1'-O4'-C4' 107.256 -1.746 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.641 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.5 0 C3'-C2'-C1' 104.676 1.412 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.818 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.581 0 C3'-C2'-C1' 100.7 -1.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.818 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 O4'-C1'-C2' 107.124 0.931 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.657 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.406 -1.064 0 C3'-C2'-C1' 104.941 1.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.657 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O4'-C1'-N19 108.147 0.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.462 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 N19-C1'-C2' 115.274 0.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 C4'-C3'-C2' 100.916 -2.284 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.884 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.133 0.939 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.549 H2'' " O5'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 C3'-C2'-C1' 106.618 2.798 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.549 " O5'" H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C4'-C3'-C2' 104.025 0.825 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.73 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C4'-C3' 106.173 0.573 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.542 ' OP1' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.409 -0.847 0 C3'-C2'-C1' 105.616 2.083 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.545 " H2'" ' N7 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C3'-C2'-C1' 105.015 1.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.545 ' N7 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 C3'-C2'-C1' 104.852 1.537 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.495 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 N19-C1'-C2' 115.528 0.83 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.429 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.411 -0.719 0 C3'-C2'-C1' 105.559 2.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.402 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.951 0 C1'-O4'-C4' 107.691 -1.435 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C1'-C2' 107.241 1.037 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.411 -0.712 0 C4'-C3'-C2' 104.337 1.137 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.401 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 C3'-C2'-C1' 101.91 -0.564 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 120.906 0.384 . . . . 0.0 111.445 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 168.82 97.76 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.207 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.59 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 2.0 tt0 -101.39 109.02 20.79 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.868 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.2 ttm105 -78.5 103.84 8.71 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.655 HG23 ' CD1' ' B' ' 114' ' ' TYR . 1.7 pt -97.41 126.98 50.13 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.643 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -131.73 123.95 28.76 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.08 -1.048 . . . . 0.0 113.561 -177.139 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.507 HG23 ' HA ' ' B' ' 125' ' ' SER . 0.1 OUTLIER -101.28 106.22 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 175.772 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.743 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 37.5 p -70.86 98.18 1.53 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.655 ' CG2' ' HB3' ' A' ' 14' ' ' TYR . 2.4 t -87.9 -137.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.737 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 24.6 t70 99.27 -9.82 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.901 0.881 . . . . 0.0 108.836 -176.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.2 m -136.98 -55.71 0.72 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.515 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.7 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.68 -92.33 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.462 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 m 176.44 36.76 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 118.866 0.757 . . . . 0.0 111.219 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.904 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.0 OUTLIER -83.77 -43.99 14.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.174 -0.921 . . . . 0.0 113.162 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.562 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -49.1 -44.06 41.9 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.824 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HA ' ' HB1' ' A' ' 19' ' ' ALA . 0.5 OUTLIER -54.04 -56.26 19.64 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.501 0.591 . . . . 0.0 112.265 179.821 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.592 ' HG ' ' HG2' ' B' ' 132' ' ' MET . 0.3 OUTLIER -46.17 -51.22 14.55 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.567 0.699 . . . . 0.0 111.302 -178.207 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.562 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 17.6 pttt -79.05 -29.27 43.42 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.505 ' HB1' ' HA ' ' A' ' 16' ' ' LEU . . . -61.45 -23.52 65.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.491 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.647 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -87.97 -44.4 11.04 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 118.255 -0.879 . . . . 0.0 109.746 178.302 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.647 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 163.13 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 177.944 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.557 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -169.59 106.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -178.816 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.492 ' O ' ' CD1' ' A' ' 24' ' ' ILE . 9.2 m-20 -66.68 55.85 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.672 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.721 HG12 ' CE ' ' B' ' 132' ' ' MET . 1.6 pp 36.24 1.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.64 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 7.0 p -37.74 -63.59 0.45 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.913 0.779 . . . . 0.0 112.372 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.446 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -75.34 -20.3 78.93 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.259 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 24' ' ' ILE . 2.2 tm? -72.93 -58.55 3.24 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 122.597 0.359 . . . . 0.0 110.934 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.608 HG12 ' SD ' ' A' ' 32' ' ' MET . 59.7 t -45.43 -69.99 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.728 0.299 . . . . 0.0 110.973 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.533 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 45.6 p -49.43 -34.11 15.73 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.026 0.53 . . . . 0.0 112.099 178.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.5 m -69.74 -53.93 16.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 m -52.0 -43.39 63.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.182 178.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.787 ' SD ' ' HA ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -55.75 -48.59 74.99 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.906 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.522 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -60.06 -42.78 95.28 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.355 0.525 . . . . 0.0 110.608 179.638 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.522 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 83.0 m-20 -67.33 -49.58 63.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.684 ' HB3' HD21 ' B' ' 117' ' ' LEU . 17.3 tp10 -65.04 -29.15 70.03 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.341 177.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.576 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -68.16 -45.48 73.41 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -54.27 36.27 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.248 177.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.449 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.8 OUTLIER -75.01 -17.97 60.43 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.503 -1.226 . . . . 0.0 113.284 -177.41 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.565 ' HG ' ' CD2' ' B' ' 120' ' ' TYR . 1.0 OUTLIER -9.49 105.67 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -178.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.413 ' CB ' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER 85.77 -8.06 0.8 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 178.405 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.34 66.15 0.69 Allowed 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.6 141.35 35.11 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 120.751 0.31 . . . . 0.0 111.595 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 178.87 97.59 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.84 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -80.05 155.47 27.56 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.055 0.455 . . . . 0.0 111.8 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -153.34 162.44 41.29 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.972 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 3.6 t -125.05 60.54 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 120.954 0.407 . . . . 0.0 111.723 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.09 147.18 50.84 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.024 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -153.98 -178.12 6.87 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.24 124.66 11.63 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.231 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -82.5 179.97 7.62 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.708 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.9 116.57 1.88 Allowed Glycine 0 C--N 1.338 0.676 0 C-N-CA 121.144 -0.55 . . . . 0.0 113.034 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.0 mtm -148.76 -92.65 0.07 Allowed 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.619 0.209 . . . . 0.0 111.343 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.7 t 58.82 67.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-O 121.221 0.534 . . . . 0.0 111.34 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -113.07 101.63 9.63 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.177 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 96.3 t -142.64 -83.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 121.424 0.631 . . . . 0.0 111.819 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 70.26 85.39 0.13 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.64 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -158.04 126.67 5.54 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.682 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 5.8 t80 165.19 105.44 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.053 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 29.4 mm -144.44 63.68 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.614 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -140.96 175.34 9.69 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.401 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.5 mmm -153.31 177.17 11.15 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.43 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -114.72 161.72 17.77 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.415 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 161.72 136.88 2.08 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.245 -0.502 . . . . 0.0 112.638 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.9 t -148.95 153.48 38.02 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.076 0.465 . . . . 0.0 111.639 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -84.45 91.49 7.84 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.131 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -131.14 62.8 1.61 Allowed 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.135 0.493 . . . . 0.0 111.027 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -75.34 99.24 4.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.41 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -122.08 112.27 18.02 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.82 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -135.13 -74.84 0.46 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.11 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.44 ' HE2' ' O ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER 175.36 -32.15 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.44 ' O ' ' HE2' ' A' ' 70' ' ' LYS . 1.8 t0 91.45 139.08 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.227 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.256 1.395 0 CA-C-O 118.668 -0.682 . . . . 0.0 111.521 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.737 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -40.5 135.73 1.47 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.69 0.281 . . . . 0.0 111.09 179.868 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.668 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 1.1 tt0 -109.84 116.73 32.19 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.072 0.463 . . . . 0.0 111.671 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.608 ' CZ ' HG21 ' B' ' 106' ' ' THR . 2.6 ttp85 -78.08 106.5 10.0 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.665 HG21 ' CG ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -103.88 130.08 55.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.81 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.643 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -131.06 126.12 35.0 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.795 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.461 HG12 HD12 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -101.86 102.94 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.319 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.868 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -70.76 67.24 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 122.131 -0.356 . . . . 0.0 111.398 -179.472 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.643 ' O ' ' HB2' ' B' ' 110' ' ' ASP . 3.7 m -99.31 -124.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.643 ' HB2' ' O ' ' B' ' 109' ' ' VAL . 10.4 t0 157.02 -83.13 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' SER . . . . . 0.547 ' HA ' ' CD ' ' B' ' 115' ' ' GLN . 3.8 t -102.63 12.56 36.18 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.638 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.533 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.8 t0 -75.56 59.28 1.11 Allowed 'General case' 0 C--N 1.36 1.059 0 CA-C-N 120.191 1.359 . . . . 0.0 108.304 178.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.448 ' HB2' ' O ' ' A' ' 29' ' ' SER . 13.3 m 64.11 -20.55 0.07 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.177 -177.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.787 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -46.61 -60.33 2.45 Favored 'General case' 0 C--N 1.351 0.674 0 CA-C-O 121.383 0.611 . . . . 0.0 110.326 179.305 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.621 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.8 pt20 -49.53 -40.39 37.77 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.766 -1.107 . . . . 0.0 112.643 -177.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.434 ' HA ' ' HB2' ' B' ' 119' ' ' ALA . 0.3 OUTLIER -55.55 -42.09 74.16 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.684 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.5 OUTLIER -59.03 -52.4 65.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.633 179.753 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.696 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.5 pttt -73.38 -30.45 63.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.209 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.48 -29.21 67.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.198 178.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.565 ' CD2' ' HG ' ' A' ' 39' ' ' LEU . 0.1 OUTLIER -87.7 -41.64 13.21 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.475 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.519 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 155.1 24.01 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 176.786 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.477 ' CG2' ' O ' ' B' ' 121' ' ' ASP . 71.0 t -162.38 101.58 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.609 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 33.4 m-80 -53.14 -84.62 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.771 ' CG2' ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -161.89 3.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 178.308 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.507 ' HA ' HG23 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -38.54 -63.5 0.5 Allowed 'General case' 0 C--O 1.241 0.658 0 CA-C-N 118.249 0.477 . . . . 0.0 110.691 -177.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -88.14 -29.91 18.61 Favored Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.234 178.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.593 HD12 ' HG ' ' B' ' 117' ' ' LEU . 0.2 OUTLIER -58.6 -60.4 3.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.854 0.462 . . . . 0.0 111.127 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.765 HG13 ' SD ' ' B' ' 132' ' ' MET . 1.3 t -55.16 -61.54 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.963 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.7 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.6 p -50.71 -42.17 56.8 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 178.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 16.5 m -67.82 -55.17 14.0 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.518 HG21 ' O ' ' B' ' 128' ' ' VAL . 1.8 t -53.55 -42.63 67.68 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.242 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.904 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 4.3 mtt -58.18 -54.93 41.38 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.587 178.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.17 -37.46 22.48 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.944 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -52.62 13.15 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' B' ' 139' ' ' LEU . 3.0 mp0 -69.45 -15.3 63.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.928 0.394 . . . . 0.0 110.343 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.625 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.96 -50.18 9.43 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.263 0.625 . . . . 0.0 109.512 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -54.33 29.59 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.718 0.77 . . . . 0.0 109.595 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -67.18 -42.42 84.26 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.916 -178.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.642 ' HG ' ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 29.1 62.73 0.13 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.489 0.661 . . . . 0.0 111.775 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.06 176.68 10.92 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.012 -179.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -149.05 159.6 44.08 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.22 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -137.67 -122.38 0.14 Allowed 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.373 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.421 ' O ' ' CB ' ' B' ' 144' ' ' TRP . 1.0 OUTLIER 77.42 157.92 0.19 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 122.537 0.335 . . . . 0.0 111.48 -179.749 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . 0.438 ' O ' ' HB3' ' B' ' 145' ' ' LYS . 63.9 t-105 87.82 129.03 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.087 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.438 ' HB3' ' O ' ' B' ' 144' ' ' TRP . 0.2 OUTLIER 169.52 121.84 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.386 179.423 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.1 p -147.4 150.22 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.678 0.275 . . . . 0.0 111.453 -179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' B' ' 147' ' ' GLU . 3.6 pm0 -73.5 120.36 19.0 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.014 0.435 . . . . 0.0 111.183 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -138.01 152.01 48.45 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.49 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -134.26 142.16 47.24 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.292 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 72.84 147.77 0.09 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.772 0.32 . . . . 0.0 110.969 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -175.55 79.46 0.07 OUTLIER Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.672 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 64.9 mtm -111.21 164.62 12.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 3.2 t -141.75 46.72 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-O 121.045 0.45 . . . . 0.0 110.775 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -96.65 115.57 27.65 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.869 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 6.0 t -141.71 -123.56 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.826 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 56.93 76.75 0.29 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.195 0.521 . . . . 0.0 111.848 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.22 98.55 11.35 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.071 0.462 . . . . 0.0 111.155 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.453 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -175.88 74.64 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.484 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 2.4 mp -116.69 -78.15 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.994 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -159.87 -62.97 0.07 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -152.6 178.38 9.66 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.908 0.385 . . . . 0.0 111.607 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -153.97 116.94 4.48 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.934 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 143.17 101.42 0.38 Allowed Glycine 0 C--N 1.335 0.477 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.099 -179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 164' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' B' ' 165' ' ' PHE . 1.4 m -145.69 -153.43 0.48 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 122.731 -0.276 . . . . 0.0 111.34 -179.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . 0.492 ' HB2' ' O ' ' B' ' 164' ' ' SER . 1.0 OUTLIER 78.67 150.51 0.11 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.948 0.499 . . . . 0.0 111.519 -179.717 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -162.27 -69.65 0.05 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.127 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 60.41 27.34 16.94 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.46 72.97 1.39 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.129 0.49 . . . . 0.0 110.731 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -113.18 -165.07 0.96 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.577 -179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 1.1 ptmm? -161.67 -33.18 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.656 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.494 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 4.0 m-20 77.02 157.91 0.19 Allowed 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.85 178.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 63.1 p-90 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.524 -0.751 . . . . 0.0 111.425 -179.771 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.878 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.803 0 C3'-C2'-C1' 105.591 2.065 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.882 H2'' ' N7 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 P--O3' 1.615 0.672 0 C3'-C2'-C1' 101.321 -0.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.882 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.562 0 O4'-C1'-C2' 107.246 1.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.743 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.862 0 C1'-O4'-C4' 107.822 -1.342 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.494 ' OP1' ' HB2' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C4'-C3'-C2' 104.232 1.032 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.576 ' H73' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.827 0 C4'-C3'-C2' 104.744 1.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.579 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.53 0 C3'-C2'-C1' 105.327 1.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.794 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C3'-C2'-C1' 100.62 -1.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.794 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 O4'-C1'-C2' 107.145 0.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.544 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.526 0.794 0 C3'-C2'-C1' 105.494 1.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.544 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O4'-C1'-C2' 106.995 0.814 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.428 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 N19-C1'-C2' 115.23 0.644 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C4'-C3'-C2' 100.902 -2.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.879 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 N19-C1'-C2' 115.45 0.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.46 H2'' ' C8 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.777 0 C4'-C3'-C2' 104.884 1.684 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.497 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O4'-C1'-C2' 106.798 0.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.776 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 O4'-C4'-C3' 103.96 -1.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.776 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.405 -1.14 0 C4'-C3'-C2' 104.722 1.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.576 ' H72' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C3'-C2'-C1' 105.022 1.658 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.443 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C3'-C2'-C1' 104.515 1.296 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.41 ' N3 ' ' N1 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 N19-C1'-C2' 115.315 0.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.508 H2'' " O5'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 C3'-C2'-C1' 105.232 1.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.508 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 C1'-O4'-C4' 107.956 -1.246 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 C1'-O4'-C4' 111.171 1.05 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.795 0 C4'-C3'-C2' 104.113 0.913 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 C1'-O4'-C4' 110.386 0.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.419 ' O ' ' HG2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 1' ' ' MET . 0.4 OUTLIER -146.48 127.0 14.12 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 179.251 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.675 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 46.1 tt0 -116.22 118.76 33.68 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.301 0.572 . . . . 0.0 110.601 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.781 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.18 105.9 10.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.206 -178.503 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.717 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -104.06 109.86 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.093 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.126 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.853 ' OG1' ' H73' ' C' ' 178' ' ' ' DT' . 0.2 OUTLIER -115.14 121.91 44.46 Favored 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.146 -176.587 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.582 HG13 ' CD1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.23 106.45 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 176.723 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.526 ' HB ' ' HB3' ' B' ' 102' ' ' LYS . 18.1 p -70.06 81.01 0.49 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.022 0.439 . . . . 0.0 110.601 -178.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.769 HG13 ' CB ' ' A' ' 14' ' ' TYR . 14.8 m -73.69 -141.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.627 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.626 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 27.4 t70 88.88 -12.45 0.41 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -124.53 -58.93 1.49 Allowed 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.63 ' HB2' ' OG ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.96 -98.59 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.5 OUTLIER -176.12 41.32 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.212 -0.93 . . . . 0.0 111.82 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.77 ' CD2' HG23 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -81.97 -41.49 20.71 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.94 0.896 . . . . 0.0 113.169 -179.474 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.517 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 1.8 mp0 -49.47 -46.59 48.25 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.52 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -50.02 -30.77 11.36 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.419 0.554 . . . . 0.0 111.917 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.666 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -78.14 -55.14 5.51 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.54 178.614 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.671 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -69.06 -25.54 64.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.335 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.54 -33.17 59.59 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.064 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.624 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 20.0 m-85 -88.87 -45.99 9.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.905 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.624 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 143.1 46.37 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 O-C-N 124.413 1.071 . . . . 0.0 110.824 178.85 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.429 ' HB ' HD23 ' A' ' 17' ' ' LEU . 7.5 t -128.24 73.45 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.333 -178.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.561 ' O ' HD11 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -76.14 45.35 0.36 Allowed 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.713 ' CG1' ' HE1' ' B' ' 132' ' ' MET . 0.6 OUTLIER 39.91 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 118.316 2.71 . . . . 0.0 118.316 177.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.675 ' HA ' HG21 ' B' ' 107' ' ' VAL . 3.1 p -39.35 -64.9 0.43 Allowed 'General case' 0 C--O 1.253 1.256 0 CA-C-N 119.272 0.942 . . . . 0.0 110.667 -177.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.416 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -80.53 -26.63 53.88 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.929 -0.653 . . . . 0.0 111.984 177.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.609 HD22 ' CD1' ' A' ' 17' ' ' LEU . 6.6 tp -66.2 -61.34 2.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.01 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.616 HG21 ' HB ' ' A' ' 24' ' ' ILE . 6.5 t -44.23 -66.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.476 ' HB3' ' O ' ' B' ' 112' ' ' ASP . 0.7 OUTLIER -50.03 -37.44 33.06 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 178.424 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.5 m -71.92 -58.5 3.4 Favored 'General case' 0 CA--C 1.507 -0.691 0 O-C-N 121.81 -0.556 . . . . 0.0 109.916 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.448 ' OG1' HG21 ' B' ' 131' ' ' THR . 1.0 OUTLIER -54.47 -31.61 56.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.586 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.959 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.7 mmt -56.32 -57.26 13.02 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.083 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.562 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 2.6 tt0 -50.12 -34.16 21.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -72.33 -48.99 37.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.79 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 39' ' ' LEU . 3.5 mm-40 -79.63 -15.25 57.97 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.754 0.312 . . . . 0.0 110.311 177.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.579 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -88.06 -29.96 20.27 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.159 0.584 . . . . 0.0 110.418 178.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -75.73 -55.41 5.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.582 0.706 . . . . 0.0 110.299 179.625 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -83.39 -35.66 24.9 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.04 -178.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.606 HD21 ' CD2' ' B' ' 120' ' ' TYR . 1.0 OUTLIER 46.11 28.34 0.64 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.986 0.514 . . . . 0.0 112.12 -178.913 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER 170.55 111.35 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.556 0.342 . . . . 0.0 110.782 179.611 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.72 -56.31 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' C ' ' HG3' ' A' ' 43' ' ' ARG . 0.6 OUTLIER 62.18 174.38 0.13 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.345 -179.726 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.436 ' HG3' ' C ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -144.2 -60.89 0.39 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.229 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER 43.53 63.45 1.55 Allowed 'General case' 0 C--O 1.238 0.467 0 CA-C-O 121.277 0.56 . . . . 0.0 111.036 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -154.66 149.84 27.02 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.219 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 12.8 p -79.57 143.98 11.64 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.24 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.18 150.18 39.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.351 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -116.92 -178.98 3.56 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.394 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -159.74 -153.61 0.36 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.397 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.421 ' O ' ' NH1' ' B' ' 143' ' ' ARG . 0.0 OUTLIER 71.2 175.66 0.29 Allowed 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 179.357 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 120.23 -116.42 3.24 Favored Glycine 0 C--N 1.338 0.692 0 CA-C-N 115.938 -0.573 . . . . 0.0 112.822 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.1 ttp 56.53 78.56 0.21 Allowed 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 11.3 m -83.78 176.97 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.961 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -75.04 -81.69 0.07 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.78 -0.191 . . . . 0.0 110.812 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.5 t -132.81 -122.36 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 110.459 -0.2 . . . . 0.0 110.459 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 77.47 106.96 0.08 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.047 0.451 . . . . 0.0 111.108 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -103.92 138.66 40.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.52 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -173.7 102.88 0.11 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.238 0.542 . . . . 0.0 110.802 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 16.9 mm -90.49 77.47 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.346 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.92 167.48 26.51 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.178 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 69.93 -179.2 0.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.808 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -162.16 179.9 7.57 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.381 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 125.13 168.86 12.84 Favored Glycine 0 C--N 1.335 0.501 0 C-N-CA 121.13 -0.557 . . . . 0.0 112.959 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.1 m -129.96 76.99 1.76 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.901 0.381 . . . . 0.0 111.386 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -157.92 120.45 3.8 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.26 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.81 173.28 8.63 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.618 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.498 ' HB3' HG13 ' B' ' 146' ' ' VAL . 14.0 t70 -166.86 -55.25 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.008 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' A' ' 69' ' ' ASN . 0.4 OUTLIER 79.19 -139.06 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.77 -179.34 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 68' ' ' GLU . 0.6 OUTLIER 81.27 97.75 0.05 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.127 0.571 . . . . 0.0 110.947 -179.402 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.453 ' O ' ' CB ' ' A' ' 71' ' ' ASP . 14.4 mmtm -151.89 -41.21 0.11 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.453 ' CB ' ' O ' ' A' ' 70' ' ' LYS . 1.5 t70 93.88 -49.25 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.858 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 118.524 -0.751 . . . . 0.0 110.523 178.925 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.52 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 111.25 0.093 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.526 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 0.0 OUTLIER 81.34 114.12 0.06 Allowed 'General case' 0 N--CA 1.469 0.523 0 O-C-N 123.785 0.678 . . . . 0.0 111.088 -179.475 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.541 ' HB3' HG21 ' A' ' 9' ' ' VAL . 28.8 tp60 -98.72 116.52 31.14 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.242 0.544 . . . . 0.0 111.048 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.44 ' HG3' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER -78.55 99.9 6.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.483 -178.399 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.77 HG23 ' CD2' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -103.05 118.51 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.067 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -122.33 129.4 52.11 Favored 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.871 -176.916 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.675 HG21 ' HA ' ' A' ' 25' ' ' SER . 0.9 OUTLIER -99.04 96.06 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.868 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.781 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 46.6 p -70.01 67.65 0.29 Allowed 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.694 HG12 ' CD2' ' B' ' 114' ' ' TYR . 6.7 p -80.56 -117.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.264 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.675 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 35.6 t70 85.47 1.29 0.7 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -174.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.45 -67.02 0.88 Allowed 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.269 178.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -133.78 142.3 47.85 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -176.512 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.602 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 46.48 -23.79 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 118.824 2.898 . . . . 0.0 118.824 174.89 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.896 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.6 OUTLIER -52.13 -61.99 1.92 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 120.079 1.309 . . . . 0.0 111.6 -178.314 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.615 ' HA ' ' HE3' ' B' ' 118' ' ' LYS . 77.6 mt-30 -49.56 -37.62 28.02 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.113 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.451 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.49 -57.16 14.17 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.872 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.959 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -49.5 -45.67 47.37 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.187 0.518 . . . . 0.0 111.674 -178.176 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.639 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.4 pttp -80.26 -36.83 34.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.249 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.568 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -68.29 -23.88 64.8 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.914 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.606 ' CD2' HD21 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -87.76 -42.71 12.41 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.04 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.45 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 163.34 17.91 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.522 ' C ' ' H ' ' B' ' 124' ' ' ILE . 72.4 t -146.98 85.28 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.349 0 O-C-N 121.581 -0.699 . . . . 0.0 112.709 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.639 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 0.4 OUTLIER -69.11 50.21 0.08 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.557 0.694 . . . . 0.0 109.977 178.515 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.751 ' CG2' ' HE2' ' A' ' 32' ' ' MET . 1.6 pp 33.28 0.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 120.103 3.372 . . . . 0.0 120.103 179.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.531 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.27 -62.47 0.58 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 118.525 0.602 . . . . 0.0 110.791 -178.944 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.403 ' N ' ' OG ' ' B' ' 125' ' ' SER . . . -80.66 -27.08 52.34 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.695 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 1.9 tm? -67.04 -61.49 1.91 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.929 0.365 . . . . 0.0 110.978 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.673 HG21 ' HB ' ' B' ' 124' ' ' ILE . 12.3 t -48.63 -68.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.249 0 C-N-CA 121.139 -0.224 . . . . 0.0 111.386 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.63 ' OG ' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -49.86 -31.27 11.65 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.0 m -71.65 -54.67 9.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.448 HG21 ' OG1' ' A' ' 31' ' ' THR . 7.2 m -53.9 -36.47 62.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.183 178.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.713 ' HE1' ' CG1' ' A' ' 24' ' ' ILE . 5.3 mmm -53.15 -57.05 11.77 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.12 178.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.509 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -58.53 -36.01 73.2 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.109 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . 0.493 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.67 -48.42 22.12 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.087 -179.249 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.48 -19.25 60.45 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.692 177.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.52 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -72.37 -47.72 47.29 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 177.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.521 ' HA ' ' NE ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -65.84 -56.4 12.07 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-O 121.444 0.64 . . . . 0.0 109.912 178.22 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 -62.64 -51.63 66.51 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.32 -179.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.429 HD12 ' CD2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 33.17 43.37 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.542 0.737 . . . . 0.0 112.545 -179.309 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.57 97.77 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.614 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -81.86 125.79 31.11 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.684 -0.235 . . . . 0.0 111.429 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -165.53 101.2 0.7 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.814 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.421 ' NH1' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -166.27 179.52 5.61 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.756 0.312 . . . . 0.0 111.748 179.82 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -160.0 160.07 32.88 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.094 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . 0.44 ' HD2' ' N ' ' B' ' 146' ' ' VAL . 0.0 OUTLIER -86.7 118.28 26.0 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.9 0.381 . . . . 0.0 111.618 -179.69 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.498 HG13 ' HB3' ' A' ' 67' ' ' ASP . 5.4 t -117.89 -82.54 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.089 178.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . 0.465 ' HB3' ' CG ' ' A' ' 67' ' ' ASP . 0.5 OUTLIER -143.61 -100.09 0.12 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 119.654 -0.213 . . . . 0.0 110.956 178.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -175.59 113.1 0.13 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.15 0.432 . . . . 0.0 111.812 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . 0.422 ' HG2' ' HA ' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -167.33 172.34 9.83 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.941 0.401 . . . . 0.0 111.799 179.736 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.48 135.41 51.2 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.832 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -94.2 176.83 36.08 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 121.079 -0.581 . . . . 0.0 112.662 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 6.7 tpt -123.07 112.59 17.94 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.929 0.395 . . . . 0.0 111.75 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 27.0 m -118.32 161.39 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.714 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.53 -148.81 0.43 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.453 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.6 t -116.19 -124.26 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 O-C-N 122.406 -0.184 . . . . 0.0 110.638 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 176.29 103.3 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.877 0.37 . . . . 0.0 111.234 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . 0.406 ' CG ' HD11 ' B' ' 159' ' ' ILE . 0.2 OUTLIER -85.73 149.0 25.59 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.155 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -176.67 104.99 0.06 Allowed 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.313 0.578 . . . . 0.0 110.746 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.406 HD11 ' CG ' ' B' ' 157' ' ' ARG . 0.7 OUTLIER -137.92 38.66 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.458 -179.723 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -48.99 -53.16 21.07 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.768 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 65.48 -164.69 0.24 Allowed 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.782 0.325 . . . . 0.0 111.434 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -122.45 168.9 11.54 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.813 0.34 . . . . 0.0 111.307 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -128.41 174.13 18.95 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 121.087 -0.577 . . . . 0.0 112.888 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.6 m -177.8 163.18 1.81 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.766 0.317 . . . . 0.0 111.364 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -130.48 168.1 17.57 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.23 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -139.25 -138.67 0.13 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.822 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.05 -25.95 66.51 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 111.438 0.162 . . . . 0.0 111.438 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 60.2 66.63 0.94 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.066 0.46 . . . . 0.0 111.159 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -92.33 -63.7 1.2 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.826 -179.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' B' ' 171' ' ' ASP . 7.4 pttp -174.79 -37.22 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' B' ' 170' ' ' LYS . 35.1 t70 95.88 116.1 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 124.758 1.286 . . . . 0.0 110.433 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.1 t90 . . . . . 0 C--O 1.253 1.244 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.893 -179.093 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.878 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.447 1.246 0 C2'-C3'-O3' 114.918 1.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.742 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.829 0 C3'-C2'-C1' 105.484 1.988 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.672 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C1'-O4'-C4' 110.533 0.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.649 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.963 0 C1'-O4'-C4' 107.502 -1.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.649 " O5'" H2'' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C4'-C3'-C2' 104.332 1.132 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.853 ' H73' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.925 0 C1'-O4'-C4' 107.498 -1.573 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.497 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C3'-C2'-C1' 105.389 1.921 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.571 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.617 0 C3'-C2'-C1' 100.247 -1.752 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.571 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 C3'-C2'-C1' 104.574 1.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.644 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.898 0 C3'-C2'-C1' 105.063 1.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.644 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C1'-O4'-C4' 110.721 0.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.502 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 N19-C1'-C2' 115.006 0.503 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.568 0 C4'-C3'-C2' 100.94 -2.26 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.877 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.44 0.691 0 O4'-C1'-C2' 107.177 0.979 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.866 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 N19-C1'-C2' 115.777 0.986 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 O4'-C1'-C2' 107.062 0.875 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 101.978 -0.516 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.508 " H2'" ' H73' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.803 0 C4'-C3'-C2' 104.849 1.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.59 H2'' ' N7 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.817 0 C4'-C3'-C2' 103.877 0.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.59 ' N7 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C3'-C2'-C1' 104.668 1.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.435 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 N19-C1'-C2' 115.581 0.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.434 ' C5 ' ' C4 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.739 0 C4'-C3'-C2' 104.818 1.618 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.434 ' C4 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.405 -1.126 0 C1'-O4'-C4' 106.985 -1.939 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 C1'-O4'-C4' 110.987 0.919 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.898 0 C4'-C3'-C2' 104.492 1.292 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.424 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 101.96 -0.528 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.614 ' HE3' ' HA ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -139.79 115.45 10.08 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.584 0.706 . . . . 0.0 111.517 178.753 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.62 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 43.4 tp60 -117.69 109.15 16.28 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.373 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.806 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 17.8 ttp-105 -79.31 111.58 15.69 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.819 179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.664 HG22 ' CD1' ' B' ' 114' ' ' TYR . 3.3 pt -102.34 127.8 55.61 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.737 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -131.71 124.73 30.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -177.791 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.506 HG13 ' HB ' ' B' ' 128' ' ' VAL . 0.2 OUTLIER -99.43 105.56 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.206 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.654 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 14.5 p -70.19 89.72 0.65 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 178.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.661 HG12 ' CB ' ' A' ' 14' ' ' TYR . 3.8 p -108.36 -119.89 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.814 -177.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.664 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 0.8 OUTLIER 77.41 10.25 2.41 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-O 122.491 1.138 . . . . 0.0 109.089 -174.747 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.443 ' OG ' ' NZ ' ' B' ' 102' ' ' LYS . 0.5 OUTLIER -128.46 -66.83 0.82 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.507 178.59 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.813 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 1.1 m-20 -51.74 -79.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -177.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.712 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 1.0 OUTLIER 177.28 40.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.39 0.995 . . . . 0.0 111.683 -178.513 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.661 ' CB ' HG12 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.67 -49.84 9.38 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.333 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.56 ' CD ' ' HA ' ' A' ' 10' ' ' ASP . 1.1 mp0 -49.33 -37.69 25.31 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.632 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.7 OUTLIER -56.61 -56.73 17.63 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.598 0.636 . . . . 0.0 111.687 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.747 ' HB2' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.48 -48.11 56.91 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.108 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.551 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 1.9 pttt -80.28 -35.59 35.65 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.475 -178.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.538 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -70.39 -22.64 62.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.256 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.63 ' CG ' HD21 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -87.83 -41.54 13.18 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.855 179.269 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.499 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 168.52 -7.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 177.382 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.652 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 72.2 t -122.08 85.95 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -177.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.58 ' O ' HD11 ' A' ' 24' ' ' ILE . 11.2 p30 -65.08 48.41 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.701 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.736 HG12 ' HE2' ' B' ' 132' ' ' MET . 0.4 OUTLIER 48.08 -15.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 117.203 2.298 . . . . 0.0 117.203 -179.546 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 23' ' ' ASN . 30.4 t -38.28 -62.84 0.54 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 119.137 0.88 . . . . 0.0 109.509 -178.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.424 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.28 -27.21 40.78 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.245 177.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.593 ' HB3' HG21 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -60.02 -62.24 2.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.972 0.386 . . . . 0.0 110.703 179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.699 ' O ' ' HG2' ' A' ' 32' ' ' MET . 12.4 t -51.43 -66.38 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.775 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.555 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 15.5 p -47.2 -40.84 16.97 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.487 ' HB ' HG12 ' A' ' 59' ' ' ILE . 0.5 OUTLIER -78.1 -47.82 17.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.558 1.072 . . . . 0.0 109.304 178.321 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.419 HG21 HG21 ' B' ' 131' ' ' THR . 9.0 m -53.24 -47.37 69.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.729 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 6.2 mmt -55.05 -46.83 75.4 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.656 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.508 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -57.3 -49.1 77.17 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.936 0.398 . . . . 0.0 110.336 178.445 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.478 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.64 -50.49 69.11 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.629 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 2.9 mm-40 -72.13 -8.59 55.53 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.808 178.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.589 ' HA ' ' HE2' ' B' ' 120' ' ' TYR . . . -88.39 -44.1 11.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 122.667 0.387 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -57.36 4.39 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.546 0.689 . . . . 0.0 110.004 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -85.0 -36.53 21.24 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.55 -1.204 . . . . 0.0 113.352 -178.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.833 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER 42.47 66.36 0.76 Allowed 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.779 0.432 . . . . 0.0 110.578 -176.778 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -174.24 112.8 0.17 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.883 0.373 . . . . 0.0 111.67 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -114.75 122.94 47.96 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.672 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.33 177.7 8.25 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.082 0.468 . . . . 0.0 111.822 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.59 146.96 53.93 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.836 -179.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -117.77 161.04 20.35 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.471 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -100.12 -95.28 0.26 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 111.569 0.211 . . . . 0.0 111.569 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.7 p -177.84 157.12 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 120.987 0.422 . . . . 0.0 111.811 -179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.29 175.32 8.36 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.037 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -94.91 -168.63 1.85 Allowed 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.205 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -122.54 134.13 54.55 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.63 0.252 . . . . 0.0 111.162 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.02 157.93 43.77 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.754 0.312 . . . . 0.0 111.464 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 176.71 165.03 31.6 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.407 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.99 -66.64 0.3 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.8 p -142.81 162.75 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 120.769 0.319 . . . . 0.0 111.852 -179.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -49.03 152.78 1.01 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.457 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.6 t -113.33 -122.62 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.886 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -161.87 94.57 0.94 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.96 0.41 . . . . 0.0 111.443 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.02 161.19 5.26 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.698 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -168.63 102.14 0.41 Allowed 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.058 0.456 . . . . 0.0 110.434 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.487 HG12 ' HB ' ' A' ' 30' ' ' THR . 2.9 mt -109.02 -90.11 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.628 -0.715 . . . . 0.0 112.255 -178.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 45.73 81.2 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.12 0.486 . . . . 0.0 111.913 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.504 ' HG2' ' HG3' ' A' ' 33' ' ' GLN . 14.2 tpp -132.71 86.01 2.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.702 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -104.22 171.12 7.51 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.387 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 128.81 136.31 4.13 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.212 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.8 t -153.91 145.06 22.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.567 0.223 . . . . 0.0 111.083 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -174.23 98.48 0.1 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.186 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -162.02 54.41 0.24 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.091 0.472 . . . . 0.0 111.271 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -112.85 98.84 7.45 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.447 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.78 173.17 6.34 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.13 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -113.64 -164.89 0.95 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.749 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' A' ' 70' ' ' LYS . 0.6 OUTLIER -154.77 -44.17 0.09 Allowed 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.74 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' A' ' 72' ' ' TRP . 10.0 t70 80.48 111.75 0.07 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.115 -1.402 . . . . 0.0 111.912 178.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.407 ' CB ' ' O ' ' A' ' 71' ' ' ASP . 1.3 t90 . . . . . 0 C--O 1.253 1.286 0 CA-C-O 118.709 -0.662 . . . . 0.0 111.416 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 2.9 ptt? . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 111.061 0.023 . . . . 0.0 111.061 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.443 ' NZ ' ' OG ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -77.52 144.68 37.47 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.668 0.271 . . . . 0.0 110.651 179.427 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.664 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 1.6 tp60 -114.2 121.77 44.75 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.146 0.498 . . . . 0.0 110.22 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.612 ' HD2' ' O4 ' ' C' ' 178' ' ' ' DT' . 0.3 OUTLIER -78.83 112.39 15.93 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.071 -179.454 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.661 HG22 ' CD2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -113.7 114.04 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.737 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -117.57 129.01 55.51 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.482 ' O ' HG23 ' B' ' 107' ' ' VAL . 0.5 OUTLIER -102.37 102.59 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 174.667 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.806 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -71.22 67.29 0.45 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.371 -0.531 . . . . 0.0 111.223 -179.18 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.499 ' CG1' ' HB2' ' B' ' 112' ' ' ASP . 4.7 m -96.14 -127.64 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.736 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.62 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 1.4 t70 154.12 -89.18 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' SER . . . . . 0.619 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 39.0 t -94.19 9.47 37.8 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 118.685 -0.674 . . . . 0.0 111.521 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.555 ' O ' ' HA ' ' A' ' 29' ' ' SER . 2.3 m-20 -74.64 56.2 0.69 Allowed 'General case' 0 C--N 1.365 1.277 0 CA-C-N 119.943 1.247 . . . . 0.0 109.271 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.508 ' OG ' ' HB2' ' A' ' 33' ' ' GLN . 0.9 OUTLIER 62.07 -14.78 0.05 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.983 -178.774 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.805 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.2 OUTLIER -53.87 -54.67 35.32 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.117 0.484 . . . . 0.0 110.135 178.974 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.622 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.38 -41.11 27.9 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.168 -178.17 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.473 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 3.9 mt -52.46 -53.89 39.56 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.044 -0.41 . . . . 0.0 111.433 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.729 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -53.12 -41.1 64.71 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.764 0.792 . . . . 0.0 111.727 179.785 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.805 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.6 pttt -79.81 -25.74 40.75 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.51 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -59.24 -23.36 62.27 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.833 ' CD2' HD23 ' A' ' 39' ' ' LEU . 2.1 m-85 -88.35 -37.88 15.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.987 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.608 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.2 t70 117.98 75.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.629 1.205 . . . . 0.0 111.948 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.482 HG11 HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -166.8 -40.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.859 -179.306 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.476 ' HB3' HD11 ' B' ' 124' ' ' ILE . 58.7 m-80 65.59 -108.04 0.15 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 -177.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.666 HG13 ' HE3' ' A' ' 32' ' ' MET . 0.2 OUTLIER -153.06 2.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 178.576 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.542 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 81.8 p -39.04 -63.26 0.55 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.403 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.27 -31.52 19.37 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.303 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.56 ' O ' ' HB ' ' B' ' 131' ' ' THR . 8.4 tp -56.97 -62.2 1.91 Allowed 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 117.3 0.55 . . . . 0.0 111.52 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.75 HG11 ' SD ' ' B' ' 132' ' ' MET . 1.5 t -53.48 -59.55 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.797 0.808 . . . . 0.0 109.079 178.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.813 ' HB3' ' CB ' ' A' ' 12' ' ' ASP . 3.5 m -48.29 -50.09 31.28 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.194 -1.366 . . . . 0.0 112.965 179.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.41 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.4 OUTLIER -83.57 -50.3 8.37 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 122.163 -0.336 . . . . 0.0 111.587 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.56 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.5 OUTLIER -55.62 -41.94 74.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -179.153 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.75 ' SD ' HG11 ' B' ' 128' ' ' VAL . 0.0 OUTLIER -60.73 -46.72 89.32 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.333 178.912 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.712 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.6 OUTLIER -49.26 -35.87 18.9 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.179 0.445 . . . . 0.0 110.526 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -70.71 -49.22 49.29 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.513 179.279 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.44 ' HB2' HD21 ' A' ' 17' ' ' LEU . 30.3 mm-40 -77.92 -13.67 59.8 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.964 0.411 . . . . 0.0 110.612 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.632 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -83.55 -34.64 25.18 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.371 0.669 . . . . 0.0 110.074 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.81 -50.89 8.18 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.985 0.898 . . . . 0.0 109.933 178.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . 0.467 ' HB2' ' O ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -62.39 -20.21 64.21 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 113.849 -1.523 . . . . 0.0 114.143 -177.178 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.63 HD21 ' CG ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -43.67 118.38 1.39 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.67 0.668 . . . . 0.0 111.081 -179.418 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.42 156.21 8.13 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -179.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -132.94 124.78 28.45 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.877 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.43 ' O ' ' HB2' ' B' ' 143' ' ' ARG . 9.8 tm-20 -62.3 -73.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.194 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER 177.07 -58.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.413 -179.818 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 29.4 t-105 -118.6 -29.85 5.31 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.38 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.62 102.08 0.07 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.015 0.436 . . . . 0.0 110.912 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.9 p -69.21 79.08 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.332 0.587 . . . . 0.0 111.251 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.09 176.32 5.19 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.362 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -143.78 156.13 44.39 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.017 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -91.33 66.95 5.65 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.151 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.74 -59.25 5.68 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.252 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 101.46 163.1 27.27 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.984 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -103.05 123.36 46.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.722 0.296 . . . . 0.0 110.87 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 10.5 p -94.91 139.76 18.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.39 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.02 176.85 9.4 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.213 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 5.6 t -104.57 -123.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.228 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -175.58 58.89 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.705 0.288 . . . . 0.0 111.239 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 55.13 -166.47 0.1 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.463 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.77 99.89 0.23 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.009 0.433 . . . . 0.0 111.137 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . 0.407 HG23 HD12 ' B' ' 159' ' ' ILE . 24.1 mm -139.39 104.16 2.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.04 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -75.85 114.88 14.97 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.324 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 9.0 mmt -122.71 144.26 49.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.019 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.45 132.11 35.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.14 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -91.58 179.73 41.84 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.617 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 11.3 p -158.09 159.99 36.85 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.595 0.236 . . . . 0.0 111.057 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -150.73 166.08 31.53 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.449 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -134.01 127.66 32.76 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.466 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.78 126.15 54.51 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.896 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.31 152.77 26.42 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.246 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -175.8 -161.82 0.09 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -175.08 -31.41 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.405 -179.807 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' B' ' 170' ' ' LYS . 36.6 t70 90.81 -105.33 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.392 1.077 . . . . 0.0 111.285 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 40.0 t-105 . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.071 -0.966 . . . . 0.0 111.159 -179.936 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.863 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 C3'-C2'-C1' 101.285 -1.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.578 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 101.333 -0.976 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.578 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 O4'-C1'-C2' 107.415 1.195 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.654 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.981 0 C1'-O4'-C4' 107.173 -1.805 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.625 " O5'" H2'' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-C2' 107.111 0.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.612 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.408 -0.951 0 C1'-O4'-C4' 107.399 -1.643 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.533 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 C3'-C2'-C1' 104.996 1.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.69 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 C3'-C2'-C1' 100.754 -1.39 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.69 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 O4'-C1'-C2' 107.248 1.043 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.561 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.944 0 C3'-C2'-C1' 105.003 1.645 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.561 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O4'-C1'-C2' 107.116 0.924 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.462 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 C4'-C3'-C2' 103.967 0.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.579 0 C4'-C3'-C2' 100.947 -2.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.877 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 O4'-C1'-C2' 106.951 0.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.468 H2'' " O5'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C3'-C2'-C1' 106.564 2.76 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.468 " O5'" H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 105.207 1.791 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.558 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O5'--C5' 1.432 -0.519 0 C4'-C3'-C2' 103.979 0.779 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.523 ' N7 ' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.528 1.018 0 C1'-O4'-C4' 105.987 -2.652 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.732 " H2'" ' N7 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 105.308 1.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.732 ' N7 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 106.212 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.53 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 C3'-C2'-C1' 104.845 1.532 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.54 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 C3'-C2'-C1' 104.399 1.214 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.54 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.079 0 C1'-O4'-C4' 106.778 -2.087 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.429 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.572 0 C1'-O4'-C4' 110.881 0.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . 0.429 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C4'-C3'-C2' 104.072 0.872 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.455 ' C2 ' ' N1 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 O4'-C4'-C3' 106.106 0.506 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 1.7 ttp . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 120.562 0.22 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 1' ' ' MET . 7.4 mmtm 72.44 133.73 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.234 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.557 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 2.0 tt0 -108.8 112.38 24.62 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.531 0.681 . . . . 0.0 111.535 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.794 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 8.3 ttm-85 -79.57 99.98 7.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.171 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.681 HG23 ' CD1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -101.87 130.3 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.969 0 N-CA-C 106.787 -1.561 . . . . 0.0 106.787 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.68 ' HB ' ' CG2' ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.09 134.23 50.28 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.344 -0.942 . . . . 0.0 112.765 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.672 ' HA ' ' OP2' ' C' ' 177' ' ' ' DG' . 0.9 OUTLIER -99.53 81.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.493 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 69.7 p -68.89 71.3 0.22 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.162 -0.961 . . . . 0.0 110.85 -178.191 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.768 HG22 ' HB3' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -77.89 -102.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.729 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.712 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 27.3 t0 113.88 14.09 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.363 0.665 . . . . 0.0 110.719 -178.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 177.73 -23.09 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.624 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 2.4 m-20 -72.27 56.01 0.34 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 -176.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.515 ' O ' ' HB3' ' B' ' 132' ' ' MET . 61.6 m 57.91 0.91 0.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.821 ' CD1' HG21 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -68.02 -49.31 62.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.502 ' HG3' ' CD2' ' A' ' 14' ' ' TYR . 4.5 mt-30 -49.41 -36.94 23.66 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -176.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.438 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -63.16 -56.37 17.35 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.724 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -46.47 -47.17 19.27 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 112.169 -178.159 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 1.4 pttt -79.57 -29.67 41.36 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.818 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.46 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -74.82 -25.35 58.96 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.019 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.541 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.9 -38.13 15.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.234 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 158.28 12.97 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 177.255 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.424 ' CG1' HD11 ' A' ' 17' ' ' LEU . 75.8 t -134.34 79.91 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.584 -0.697 . . . . 0.0 111.716 -178.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.532 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.7 OUTLIER -66.66 52.92 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.945 0.403 . . . . 0.0 111.349 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.778 ' CG2' ' HE1' ' B' ' 132' ' ' MET . 0.5 OUTLIER 41.6 -8.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 118.375 2.731 . . . . 0.0 118.375 178.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.623 ' HA ' ' CG2' ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.73 -62.48 0.61 Allowed 'General case' 0 C--O 1.245 0.837 0 CA-C-N 120.13 1.332 . . . . 0.0 109.852 -178.464 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.85 -24.89 57.31 Favored Glycine 0 CA--C 1.522 0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.621 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.705 ' HB3' HG22 ' A' ' 24' ' ' ILE . 7.8 tp -67.49 -61.5 1.87 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 117.207 0.503 . . . . 0.0 111.471 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.627 ' O ' ' HG2' ' A' ' 32' ' ' MET . 33.5 t -45.0 -63.0 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.61 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.722 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 7.4 p -48.78 -47.32 41.97 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.988 1.315 . . . . 0.0 113.091 177.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.6 m -61.5 -51.26 69.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.407 ' OG1' HG23 ' B' ' 131' ' ' THR . 7.1 m -59.11 -41.84 89.12 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.27 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.849 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -52.64 -52.23 56.54 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.174 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.474 ' HB2' ' CB ' ' B' ' 113' ' ' SER . 2.3 tt0 -62.79 -51.71 66.01 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.269 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -56.28 -51.35 68.47 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.416 ' HG3' HD22 ' A' ' 39' ' ' LEU . 3.0 tp10 -65.8 -29.07 69.5 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.204 178.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.544 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -70.48 -44.31 67.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.116 0.484 . . . . 0.0 110.257 178.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -56.28 7.19 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.38 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.33 -33.98 25.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.704 -1.134 . . . . 0.0 113.646 -176.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.421 HD11 ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 30.8 53.69 0.17 Allowed 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.321 0.581 . . . . 0.0 111.811 -178.066 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 1.1 tpt180 177.75 84.03 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.898 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -142.85 147.83 36.05 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.605 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.31 171.63 11.74 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.063 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -82.68 -62.64 1.55 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 68.11 173.13 0.28 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.075 0.464 . . . . 0.0 111.932 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -175.69 140.95 0.47 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.188 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 3.3 p -140.94 165.86 19.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.551 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -83.94 178.44 7.88 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.988 0.423 . . . . 0.0 111.834 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -157.86 -176.69 6.07 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.021 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.47 146.44 35.94 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.033 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -77.08 158.96 30.18 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.988 0.423 . . . . 0.0 111.271 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -100.44 161.53 18.93 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 121.036 -0.602 . . . . 0.0 113.077 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.8 ptm -119.76 173.12 7.22 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.804 0.335 . . . . 0.0 111.479 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.4 m -122.62 153.03 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.483 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -118.05 168.61 10.38 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.467 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.4 t -109.53 -10.3 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.823 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.408 ' O ' ' HD2' ' A' ' 57' ' ' ARG . . . 47.81 66.62 0.99 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.031 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.408 ' HD2' ' O ' ' A' ' 56' ' ' ALA . 4.3 mpt_? -129.54 110.53 11.92 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.089 0.471 . . . . 0.0 111.851 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -148.47 89.94 1.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.295 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 65.6 mt -129.03 -59.87 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.827 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -55.24 128.96 36.45 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.984 0.421 . . . . 0.0 111.284 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.9 mtp -174.2 125.94 0.34 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.645 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -118.06 138.46 52.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.855 0.359 . . . . 0.0 111.573 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -128.53 84.84 0.32 Allowed Glycine 0 C--N 1.334 0.445 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.444 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.3 t -82.33 -170.87 3.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.971 0.415 . . . . 0.0 111.575 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -125.2 -172.29 2.55 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.254 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . 79.12 157.28 0.16 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.713 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -133.17 -63.15 0.77 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.151 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -178.86 4.9 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.813 0.339 . . . . 0.0 111.497 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.16 -58.48 2.13 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.479 ' O ' ' HB3' ' A' ' 71' ' ' ASP . 16.6 ttpp 177.74 -31.15 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.263 0.554 . . . . 0.0 109.538 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.479 ' HB3' ' O ' ' A' ' 70' ' ' LYS . 20.6 t70 75.77 -70.58 0.14 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.764 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.3 t90 . . . . . 0 C--O 1.255 1.363 0 CA-C-O 118.587 -0.72 . . . . 0.0 111.141 -179.985 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' MET . . . . . 0.524 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 9.2 tpt . . . . . 0 N--CA 1.495 1.791 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' LYS . . . . . 0.712 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER 79.47 138.16 0.07 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.069 0.461 . . . . 0.0 110.351 -178.87 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' GLN . . . . . 0.458 ' CG ' ' HE2' ' A' ' 14' ' ' TYR . 57.6 tp60 -121.95 117.5 26.57 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.938 0.875 . . . . 0.0 110.553 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' ARG . . . . . 0.733 ' NH1' ' H62' ' C' ' 179' ' ' ' DA' . 39.6 ttt85 -79.26 109.43 13.59 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.095 -1.412 . . . . 0.0 112.899 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' ILE . . . . . 0.821 HG21 ' CD1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -96.58 116.87 39.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.892 0 N-CA-C 103.739 -2.689 . . . . 0.0 103.739 174.4 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.68 ' CG2' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -118.52 112.18 19.57 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.593 -174.917 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' VAL . . . . . 0.657 HG13 ' CD1' ' A' ' 5' ' ' ILE . 1.0 OUTLIER -102.44 106.17 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.525 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' THR . . . . . 0.794 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 25.6 p -72.07 90.38 1.18 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . 0.706 ' HB ' ' HB3' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.68 -146.75 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 118.882 -0.58 . . . . 0.0 111.832 -178.38 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' ASP . . . . . 0.591 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 8.7 t70 105.13 5.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 24.6 t -150.23 -41.18 0.13 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 113.66 -1.609 . . . . 0.0 110.414 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' ASP . . . . . 0.722 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.3 OUTLIER -74.71 33.78 0.1 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.501 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.474 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.2 OUTLIER 72.21 3.86 4.82 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 177.383 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.849 ' HA ' ' HG3' ' A' ' 32' ' ' MET . 1.9 t80 -57.75 -55.63 32.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.203 0.456 . . . . 0.0 111.507 179.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' GLN . . . . . 0.546 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 15.2 mt-30 -49.68 -42.7 46.27 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -177.414 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' LEU . . . . . 0.544 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -49.19 -30.66 7.21 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.692 0.282 . . . . 0.0 111.726 179.774 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' LEU . . . . . 0.56 HD12 ' CD1' ' B' ' 127' ' ' LEU . 0.4 OUTLIER -78.56 -57.55 3.71 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.372 0.606 . . . . 0.0 111.574 178.314 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' LYS . . . . . 0.61 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -65.09 -25.48 67.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.995 -179.909 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.95 -27.98 47.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.079 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' TYR . . . . . 0.566 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.1 m-30 -88.21 -47.41 8.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.667 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.566 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 5.0 m-20 143.45 41.51 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.193 0.933 . . . . 0.0 110.52 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' VAL . . . . . 0.522 ' O ' ' CG1' ' B' ' 122' ' ' VAL . 6.1 p -160.25 87.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-O 121.661 0.743 . . . . 0.0 111.592 -177.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.624 ' O ' ' HE3' ' A' ' 32' ' ' MET . 1.2 m120 -63.22 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' ILE . . . . . 0.716 HG13 ' HE3' ' A' ' 32' ' ' MET . 0.1 OUTLIER -146.86 4.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' SER . . . . . 0.501 ' HA ' ' CG2' ' A' ' 7' ' ' VAL . 1.2 t -39.51 -64.63 0.46 Allowed 'General case' 0 C--O 1.244 0.814 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.011 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.94 -21.53 45.98 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . 0.622 HD11 ' SD ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -64.43 -56.72 12.38 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 122.73 0.412 . . . . 0.0 110.911 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' VAL . . . . . 0.704 ' O ' ' HG2' ' B' ' 132' ' ' MET . 2.2 t -56.67 -60.99 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' SER . . . . . 0.624 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.2 p -47.15 -38.8 12.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.147 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 93.1 m -70.96 -48.58 52.59 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' THR . . . . . 0.407 HG23 ' OG1' ' A' ' 31' ' ' THR . 0.5 OUTLIER -66.62 -31.86 72.81 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.124 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' MET . . . . . 0.778 ' HE1' ' CG2' ' A' ' 24' ' ' ILE . 4.7 mmt -65.39 -57.04 9.33 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' GLN . . . . . 0.49 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -48.79 -37.13 18.28 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 -75.05 -41.41 59.14 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.997 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -84.25 -12.75 54.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.81 0.338 . . . . 0.0 110.832 177.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' ALA . . . . . 0.622 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -87.34 -29.61 21.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.42 0.688 . . . . 0.0 109.313 178.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 2.1 mmt180 -81.45 -48.25 12.13 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.763 0.792 . . . . 0.0 110.102 178.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -78.7 -40.27 34.19 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 113.958 -1.474 . . . . 0.0 112.969 -177.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' LEU . . . . . 0.541 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 26.79 67.67 0.06 Allowed 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.496 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.443 ' HD3' ' O ' ' B' ' 140' ' ' ARG . 0.0 OUTLIER -95.37 13.3 26.24 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -95.19 43.07 1.09 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -97.71 174.08 6.8 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.967 0.413 . . . . 0.0 111.828 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -46.6 141.67 3.62 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.351 -179.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -131.4 167.04 19.97 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.185 0.516 . . . . 0.0 111.772 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 41.0 mttt -87.52 -57.38 2.97 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.7 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 40.3 t 48.84 79.44 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -179.28 156.04 0.74 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.553 179.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.33 54.59 0.31 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.896 0.379 . . . . 0.0 110.959 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -172.87 142.65 1.14 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.02 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -95.37 -58.11 2.22 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.05 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 161.23 -143.84 9.28 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.489 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 14.1 mmt -98.39 102.38 14.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.876 0.369 . . . . 0.0 110.807 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 22.2 t -85.21 75.75 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.353 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -178.94 -85.1 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.065 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 155' ' ' VAL . . . . . 0.403 ' O ' ' CB ' ' B' ' 156' ' ' ALA . 0.8 OUTLIER 51.38 126.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 CA-C-O 123.461 1.601 . . . . 0.0 115.314 179.453 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 156' ' ' ALA . . . . . 0.403 ' CB ' ' O ' ' B' ' 155' ' ' VAL . . . 88.4 107.81 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 111.423 -2.626 . . . . 0.0 112.164 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -141.26 103.46 4.43 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.529 179.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 158' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -168.93 83.13 0.14 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.135 0.493 . . . . 0.0 111.63 -179.495 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 21.4 mm -119.67 93.32 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.009 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -85.45 5.78 29.66 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 1.1 mmt -72.76 69.15 0.9 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.247 0.546 . . . . 0.0 110.408 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -69.9 68.16 0.28 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.495 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -68.46 -42.07 82.84 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 121.231 -0.509 . . . . 0.0 113.139 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 71.17 77.18 0.18 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.008 0.432 . . . . 0.0 111.57 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -158.47 134.3 9.0 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.959 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -155.34 62.91 0.62 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.991 0.424 . . . . 0.0 111.675 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.88 67.39 1.22 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.286 0.565 . . . . 0.0 111.596 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -70.77 82.37 0.63 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.974 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -97.11 176.67 5.85 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.641 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 170' ' ' LYS . . . . . 0.513 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 0.0 OUTLIER 176.76 -26.92 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.267 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 171' ' ' ASP . . . . . 0.513 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 6.3 m-20 80.0 141.07 0.07 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.65 179.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 54.1 m95 . . . . . 0 C--O 1.25 1.112 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.034 -179.646 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 173' ' ' ' DA' . . . . . 0.887 HO5' ' P ' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.442 0.882 0 C4'-C3'-C2' 104.876 1.676 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 174' ' ' ' DT' . . . . . 0.627 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.721 0 C4'-C3'-C2' 101.758 -1.442 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 175' ' ' ' DA' . . . . . 0.627 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.521 0 C3'-C2'-C1' 104.997 1.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 176' ' ' ' DT' . . . . . 0.601 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.799 0 C1'-O4'-C4' 107.621 -1.485 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 177' ' ' ' DG' . . . . . 0.672 ' OP2' ' HA ' ' A' ' 7' ' ' VAL . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 C4'-C3'-C2' 104.286 1.086 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 178' ' ' ' DT' . . . . . 0.627 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.85 0 C3'-C2'-C1' 104.876 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 179' ' ' ' DA' . . . . . 0.733 ' H62' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.432 -0.49 0 C3'-C2'-C1' 105.551 2.036 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 180' ' ' ' DT' . . . . . 0.602 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 C3'-C2'-C1' 100.91 -1.278 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 181' ' ' ' DA' . . . . . 0.602 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 C3'-C2'-C1' 104.142 1.03 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 182' ' ' ' DC' . . . . . 0.5 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.832 0 C4'-C3'-C2' 104.789 1.589 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 183' ' ' ' DC' . . . . . 0.545 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 N19-C1'-C2' 112.98 -0.763 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 184' ' ' ' DC' . . . . . 0.545 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 C3'-C2'-C1' 101.477 -0.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.64 0 C4'-C3'-C2' 100.959 -2.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 186' ' ' ' DT' . . . . . 0.876 HO5' ' P ' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 C1'-O4'-C4' 110.319 0.442 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 187' ' ' ' DC' . . . . . 0.615 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C3'-C2'-C1' 101.961 -0.528 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 188' ' ' ' DG' . . . . . 0.615 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 C3'-C2'-C1' 101.981 -0.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 189' ' ' ' DG' . . . . . 0.409 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.649 0 O4'-C1'-N19 108.269 0.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 190' ' ' ' DG' . . . . . 0.552 ' N7 ' ' NH1' ' A' ' 4' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.939 0 C4'-C3'-C2' 104.879 1.679 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 191' ' ' ' DT' . . . . . 0.502 ' C7 ' ' HD3' ' A' ' 4' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 C1'-O4'-C4' 106.883 -2.012 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 192' ' ' ' DA' . . . . . 0.617 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 105.805 2.218 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 193' ' ' ' DT' . . . . . 0.527 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 N19-C1'-C2' 115.758 0.974 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 194' ' ' ' DA' . . . . . 0.527 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.838 0 C4'-C3'-C2' 104.804 1.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 195' ' ' ' DC' . . . . . 0.417 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.999 0 C1'-O4'-C4' 106.929 -1.979 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 196' ' ' ' DA' . . . . . 0.456 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 C3'-C2'-C1' 104.229 1.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 N19-C1'-C2' 115.325 0.703 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 198' ' ' ' DA' . . . . . 0.459 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 C1'-O4'-C4' 110.407 0.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HD3' ' HB3' ' B' ' 110' ' ' ASP . 8.8 mmtm . . . . . 0 CA--C 1.534 0.349 0 CA-C-O 120.243 0.068 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.485 ' O ' ' HA ' ' B' ' 108' ' ' THR . 7.5 tt0 -130.26 120.74 24.9 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.916 0.389 . . . . 0.0 111.795 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 1.041 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -81.95 116.99 21.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.885 ' CG1' HG13 ' B' ' 107' ' ' VAL . 0.5 OUTLIER -113.78 122.22 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.105 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.691 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.59 129.85 41.44 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.025 -1.07 . . . . 0.0 112.954 -177.888 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.674 HG22 HG12 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -100.22 103.54 14.93 Favored 'Isoleucine or valine' 0 C--N 1.346 0.421 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 175.381 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -69.77 67.17 0.25 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 122.009 0.909 . . . . 0.0 109.774 -178.866 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.716 HG21 ' HB3' ' A' ' 12' ' ' ASP . 9.4 p -106.09 -132.32 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.389 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.635 ' H ' HG22 ' A' ' 9' ' ' VAL . 3.2 t70 148.34 -87.16 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 70.7 m -74.65 -5.67 44.34 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.716 ' HB3' HG21 ' A' ' 9' ' ' VAL . 4.2 t0 -79.68 56.76 2.32 Favored 'General case' 0 C--N 1.353 0.727 0 CA-C-N 120.437 1.471 . . . . 0.0 109.936 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' B' ' 132' ' ' MET . 13.2 m 65.25 -18.5 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.722 ' CE1' ' HB ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -50.63 -56.03 13.71 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 118.347 0.521 . . . . 0.0 110.777 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.745 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -50.75 -43.84 58.36 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.641 -0.708 . . . . 0.0 112.763 -177.906 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.641 HD13 ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -54.43 -40.59 68.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.905 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.93 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.665 0.745 . . . . 0.0 110.634 179.782 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 13.9 pttt -69.06 -25.78 64.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.655 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.17 -22.04 60.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 178.443 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.664 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 15.1 m-30 -87.84 -54.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.664 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 12.4 p-10 163.92 35.15 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.764 0.665 . . . . 0.0 112.117 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.655 HG13 ' O ' ' A' ' 22' ' ' VAL . 9.6 p -154.39 99.12 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.524 0.678 . . . . 0.0 112.622 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.7 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 16.0 m-20 -60.71 13.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.962 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.987 HG21 ' CE ' ' B' ' 132' ' ' MET . 1.7 pp 65.12 -5.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 N-CA-C 117.484 2.401 . . . . 0.0 117.484 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.757 ' HA ' ' HB ' ' B' ' 107' ' ' VAL . 9.8 p -38.49 -62.35 0.6 Allowed 'General case' 0 C--N 1.308 -1.233 0 O-C-N 123.243 0.339 . . . . 0.0 111.734 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.539 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -67.05 -38.72 92.74 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.663 -0.779 . . . . 0.0 113.059 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.492 ' CD2' HG22 ' A' ' 24' ' ' ILE . 3.5 tp -63.5 -61.44 2.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 117.208 0.504 . . . . 0.0 112.299 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.925 HG13 HG21 ' B' ' 124' ' ' ILE . 53.6 t -40.1 -73.4 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -178.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.735 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -57.71 -32.55 67.5 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.894 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.539 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.9 OUTLIER -66.54 -54.09 27.53 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 177.904 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.498 HG21 ' OG1' ' B' ' 131' ' ' THR . 9.4 m -51.78 -47.83 64.03 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.317 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.848 ' HE1' ' CG1' ' B' ' 124' ' ' ILE . 5.3 mtt -49.07 -48.99 43.68 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.242 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.15 -36.33 18.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.446 0.566 . . . . 0.0 110.394 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -67.8 -51.42 48.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.467 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.91 ' HB3' HD21 ' B' ' 117' ' ' LEU . 2.4 tp10 -75.34 -17.23 60.29 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.625 0.25 . . . . 0.0 110.84 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.766 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -86.28 -25.74 25.33 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 123.193 0.597 . . . . 0.0 109.691 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.22 -47.83 12.0 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 121.858 0.837 . . . . 0.0 109.756 177.916 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 . . . . . 0 N--CA 1.443 -0.799 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.414 -177.419 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.55 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 52.9 tp60 -105.58 113.32 26.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.772 0.796 . . . . 0.0 110.31 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.7 ' HB3' ' NH1' ' B' ' 104' ' ' ARG . 7.9 ttp-105 -79.31 103.55 9.31 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.712 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.722 ' HB ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.66 129.03 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.342 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.645 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -128.61 115.6 18.32 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.859 -177.868 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.885 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.14 98.72 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.701 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 108' ' ' THR . . . . . 1.041 HG22 ' HG3' ' A' ' 4' ' ' ARG . 41.6 p -68.13 84.3 0.24 Allowed 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.006 HG21 ' HB2' ' B' ' 114' ' ' TYR . 6.4 t -72.56 -116.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.413 -177.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.628 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 4.9 t70 75.63 -7.48 1.78 Allowed 'General case' 0 C--N 1.351 0.649 0 CA-C-O 121.443 0.64 . . . . 0.0 109.597 -176.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 2.4 m -127.18 -69.43 0.75 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.46 179.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.735 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 0.6 OUTLIER -42.36 -78.28 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.68 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.476 ' H ' ' HB2' ' A' ' 29' ' ' SER . 1.7 m 169.0 46.78 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.55 0.691 . . . . 0.0 110.662 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.006 ' HB2' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.89 -52.55 6.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.831 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.9 OUTLIER -48.69 -35.31 13.66 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -175.494 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.766 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -62.47 -57.03 12.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.632 0.651 . . . . 0.0 111.658 179.582 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.91 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -46.37 -48.76 18.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.506 0.67 . . . . 0.0 111.411 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.715 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 5.2 pttt -79.35 -27.88 42.03 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.004 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -58.45 -28.06 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.519 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.574 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.2 OUTLIER -88.42 -45.81 9.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.254 177.964 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 157.04 22.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 175.973 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.567 ' O ' HG12 ' B' ' 122' ' ' VAL . 49.5 t -138.93 82.57 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -178.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 1.042 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -64.54 56.74 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.006 0.431 . . . . 0.0 111.489 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.042 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER 44.66 -11.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.474 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.1 OUTLIER -38.19 -60.64 0.75 Allowed 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.362 1.437 . . . . 0.0 110.542 -178.523 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -81.11 -27.84 47.73 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.608 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.668 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -66.95 -62.35 1.48 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.701 0.4 . . . . 0.0 111.101 -179.901 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.924 HG22 HG22 ' A' ' 28' ' ' VAL . 3.0 t -47.08 -66.6 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-O 121.144 0.497 . . . . 0.0 109.877 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.558 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 13.7 p -47.99 -34.97 10.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.267 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.7 m -73.77 -56.24 5.23 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.498 ' OG1' HG21 ' A' ' 31' ' ' THR . 0.7 OUTLIER -51.74 -39.16 58.0 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.365 -0.834 . . . . 0.0 108.914 178.668 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.987 ' CE ' HG21 ' A' ' 24' ' ' ILE . 19.0 mmt -52.91 -54.08 39.86 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.042 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.2 -46.85 79.29 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.34 -54.57 30.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.882 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.732 ' CB ' HD21 ' A' ' 17' ' ' LEU . 21.7 mm-40 -62.76 -27.14 69.08 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.282 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.641 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -72.31 -46.45 55.58 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.571 0.348 . . . . 0.0 110.72 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -56.59 5.77 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.213 0.53 . . . . 0.0 111.545 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.725 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -176.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.583 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 7.4 mmmm . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' B' ' 109' ' ' VAL . 25.1 tt0 -95.31 115.97 28.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.24 0.543 . . . . 0.0 111.556 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.986 ' HG3' HG22 ' B' ' 108' ' ' THR . 7.9 ttm-85 -79.55 100.01 7.56 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.75 HG12 HG13 ' B' ' 107' ' ' VAL . 0.7 OUTLIER -103.28 130.54 53.37 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.842 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.367 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.833 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -130.05 127.66 40.36 Favored 'General case' 0 C--N 1.311 -1.083 0 C-N-CA 118.73 -1.188 . . . . 0.0 113.893 -177.1 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.868 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.1 t -101.02 112.54 34.26 Favored 'Isoleucine or valine' 0 C--N 1.347 0.49 0 C-N-CA 124.39 1.076 . . . . 0.0 108.789 176.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.0 p -70.92 85.17 0.69 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.826 0.739 . . . . 0.0 110.386 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.945 HG21 ' CD1' ' A' ' 14' ' ' TYR . 10.3 m -72.26 -162.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.981 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.567 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.6 t70 84.7 -23.59 0.17 Allowed 'General case' 0 C--N 1.351 0.636 0 C-N-CA 123.396 0.679 . . . . 0.0 109.365 -177.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.36 -75.52 0.53 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.294 177.471 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.914 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 1.0 OUTLIER -51.46 -87.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.981 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.516 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 5.2 t -176.85 41.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.256 0.935 . . . . 0.0 112.259 -178.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.945 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.2 -43.8 15.74 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.688 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 16.8 mt-30 -47.84 -37.8 14.66 Favored 'General case' 0 C--O 1.221 -0.418 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -174.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.892 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -58.42 -56.22 24.93 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.473 1.033 . . . . 0.0 111.693 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.796 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -48.05 -47.89 33.47 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.454 0.645 . . . . 0.0 111.63 -178.214 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -76.74 -27.16 55.27 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.41 178.969 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -66.03 -27.61 68.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.855 178.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.545 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -87.8 -40.48 14.01 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.57 178.482 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.545 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.8 OUTLIER 151.21 21.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.267 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.469 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 68.4 t -155.9 89.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.515 0 C-N-CA 120.886 -0.326 . . . . 0.0 111.833 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.467 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 1.1 m120 -61.2 -100.28 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.064 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -146.26 4.79 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.409 ' C ' ' O ' ' A' ' 24' ' ' ILE . 89.5 p -44.38 -64.82 0.61 Allowed 'General case' 0 C--O 1.244 0.794 0 C-N-CA 119.395 -0.922 . . . . 0.0 108.826 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.4 -28.65 29.58 Favored Glycine 0 CA--C 1.519 0.319 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.593 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.913 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -58.74 -59.6 5.16 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 122.198 0.199 . . . . 0.0 110.858 179.489 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.064 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.1 t -52.31 -61.65 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.835 ' HB3' ' CB ' ' B' ' 112' ' ' ASP . 12.1 p -50.55 -42.73 55.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 89.3 m -71.34 -53.29 14.68 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.47 -41.46 89.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.129 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.968 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -56.0 -52.99 62.24 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.446 178.433 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.444 ' HG3' ' HB3' ' B' ' 113' ' ' SER . 53.2 mt-30 -53.68 -56.68 15.17 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.35 -53.27 56.11 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.955 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -66.83 -23.33 66.02 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.145 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.775 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -72.19 -47.57 49.66 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.79 -51.58 66.52 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? . . . . . 0 N--CA 1.444 -0.731 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.151 -179.706 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.442 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 12.3 mptt . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.821 ' HB3' HG23 ' A' ' 9' ' ' VAL . 3.5 tp60 -99.36 125.06 44.96 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.976 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.455 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.3 OUTLIER -77.91 114.61 16.94 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.279 -177.911 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 1.04 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -102.89 108.98 25.48 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.949 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 177.899 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.833 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -115.25 114.02 24.65 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.986 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.75 HG13 HG12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.21 101.35 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 176.849 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.986 HG22 ' HG3' ' A' ' 4' ' ' ARG . 77.0 p -68.61 95.2 0.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.01 HG21 ' CG ' ' B' ' 114' ' ' TYR . 16.5 m -91.29 -148.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.613 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.529 ' N ' HG23 ' B' ' 109' ' ' VAL . 15.9 t70 88.84 -13.33 0.39 Allowed 'General case' 0 C--N 1.346 0.445 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 -176.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.4 t -114.46 -62.48 1.59 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.835 ' CB ' ' HB3' ' A' ' 29' ' ' SER . 0.6 OUTLIER -48.66 -89.34 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 O-C-N 123.591 0.557 . . . . 0.0 111.865 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.444 ' HB3' ' HG3' ' A' ' 33' ' ' GLN . 1.3 m 176.04 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.865 0.757 . . . . 0.0 111.438 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.01 ' CG ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.37 -44.36 16.23 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.312 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.578 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 4.4 mt-30 -48.78 -42.63 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.775 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.8 OUTLIER -52.32 -30.19 27.11 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.955 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -77.5 -53.62 7.41 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 121.599 0.714 . . . . 0.0 111.204 179.534 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.625 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -70.43 -28.83 65.35 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.556 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -60.57 -28.13 68.23 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.864 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.719 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -89.16 -36.81 15.48 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.022 179.097 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.719 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 33.2 t70 146.83 25.36 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 176.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.582 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 61.8 t -159.67 101.13 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 O-C-N 121.841 -0.537 . . . . 0.0 112.396 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.557 ' O ' ' HE1' ' A' ' 32' ' ' MET . 67.8 m-80 -58.9 -92.51 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 177.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.011 HG22 ' HB3' ' B' ' 127' ' ' LEU . 0.1 OUTLIER -154.84 6.76 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.727 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.868 ' HA ' HG22 ' A' ' 7' ' ' VAL . 54.0 p -38.6 -64.27 0.45 Allowed 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.076 -177.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.588 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.25 -20.25 46.41 Favored Glycine 0 CA--C 1.522 0.471 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.834 177.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 1.011 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.82 -61.21 2.56 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.061 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.913 HG22 HG21 ' A' ' 24' ' ' ILE . 26.0 t -55.15 -65.16 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 CA-C-O 121.687 0.755 . . . . 0.0 109.136 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.914 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 3.0 p -49.44 -47.96 47.8 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.588 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -81.14 -48.53 12.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.441 1.019 . . . . 0.0 111.198 -178.404 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.736 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.98 -37.91 69.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.102 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.913 ' SD ' HD12 ' A' ' 27' ' ' LEU . 1.6 mmt -64.21 -48.19 76.83 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.389 178.31 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 26.1 tt0 -48.79 -42.13 34.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.096 0.407 . . . . 0.0 110.659 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.51 -55.68 22.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.177 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.52 ' HG3' HD21 ' A' ' 17' ' ' LEU . 23.9 tp10 -71.31 -9.76 58.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.102 178.07 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.892 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.19 -46.93 8.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.985 0.421 . . . . 0.0 109.925 178.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -63.3 -56.17 18.65 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.623 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 2.8 tpt85 . . . . . 0 N--CA 1.438 -1.04 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.236 -178.884 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 3.5 mptt . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 121.211 0.529 . . . . 0.0 110.986 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.446 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 29.7 tp60 -104.64 109.62 21.61 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.13 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.856 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 2.3 ttm105 -78.91 104.6 9.65 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.331 -179.115 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.656 HG12 HG13 ' B' ' 107' ' ' VAL . 0.2 OUTLIER -104.08 130.21 55.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 177.786 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.7 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.36 128.41 39.6 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 119.117 -1.033 . . . . 0.0 112.901 -177.951 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.69 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -100.1 107.64 21.33 Favored 'Isoleucine or valine' 0 C--N 1.35 0.598 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 6.2 p -71.23 98.34 1.71 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.94 -0.475 . . . . 0.0 110.442 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.005 HG21 ' HB3' ' A' ' 14' ' ' TYR . 3.8 t -92.35 -130.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 119.094 -0.479 . . . . 0.0 112.077 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.541 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 31.4 t70 85.18 -9.23 0.84 Allowed 'General case' 0 C--N 1.351 0.641 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.4 m -132.23 -56.54 0.97 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.856 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.8 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 2.8 m-20 -49.86 -98.36 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -177.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 41.3 t -178.41 36.78 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.376 -0.828 . . . . 0.0 110.606 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.005 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.79 -45.71 14.0 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.794 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.685 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.1 -39.24 27.4 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -176.014 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.795 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -59.14 -56.84 17.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.439 0.563 . . . . 0.0 112.284 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.95 HD12 ' HA ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -59.61 -39.46 84.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 120.027 -0.669 . . . . 0.0 112.744 -177.471 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.685 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -80.14 -35.47 36.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.041 0.448 . . . . 0.0 112.123 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.569 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -73.66 -21.57 60.23 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.896 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.894 ' CE2' HD23 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -87.79 -40.08 14.36 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 118.913 -0.565 . . . . 0.0 109.642 178.799 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.602 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 7.0 t70 171.52 -5.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.81 ' HB ' HD22 ' A' ' 17' ' ' LEU . 74.4 t -121.57 82.0 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -177.046 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 1.025 ' O ' HD12 ' A' ' 24' ' ' ILE . 45.5 p30 -67.19 51.44 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 111.068 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.025 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 46.11 -15.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -37.99 -63.01 0.51 Allowed 'General case' 0 C--O 1.238 0.486 0 CA-C-N 120.166 1.348 . . . . 0.0 110.838 -177.688 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.52 -29.16 30.69 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.473 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.796 ' CD1' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -58.0 -62.33 1.9 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.463 179.511 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.015 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.8 t -48.48 -63.48 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.382 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.828 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 94.2 p -49.55 -38.73 32.05 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 81.3 m -67.31 -54.41 20.96 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.586 HG22 HD11 ' B' ' 127' ' ' LEU . 93.0 m -58.15 -40.85 82.45 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.257 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.948 ' SD ' HD12 ' B' ' 117' ' ' LEU . 8.1 mmt -53.52 -54.27 39.63 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.974 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? -62.73 -45.11 94.22 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.935 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.47 -50.72 71.62 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.554 ' HG2' ' CD1' ' B' ' 127' ' ' LEU . 5.6 tp10 -64.57 -37.93 89.24 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.922 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -56.11 -43.5 78.18 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 177.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -53.24 19.86 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.539 0.521 0 CA-C-N 114.187 -1.369 . . . . 0.0 113.224 -177.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.516 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 12.0 mmmt . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.529 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 33.8 tp60 -121.15 112.53 18.78 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.535 0.683 . . . . 0.0 112.121 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.488 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 5.5 ttm105 -79.55 111.91 16.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.895 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.7 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.8 OUTLIER -101.47 130.06 51.61 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.758 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.255 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.66 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.96 116.56 17.3 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.281 -177.96 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.793 HG22 HG22 ' B' ' 109' ' ' VAL . 0.8 OUTLIER -101.66 104.54 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 174.929 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.856 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 8.9 p -70.02 95.29 0.94 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.855 HG11 ' HB3' ' B' ' 114' ' ' TYR . 0.9 OUTLIER -93.2 -145.3 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.992 -178.632 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 28.2 t0 92.69 -10.62 0.18 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -175.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.46 -64.35 1.26 Allowed 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.354 177.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.828 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -44.0 -94.44 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.436 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -177.59 42.33 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.699 -0.625 . . . . 0.0 110.94 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.855 ' HB3' HG11 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.13 -45.52 15.05 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.055 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.548 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 3.9 mt-30 -49.86 -43.67 49.26 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.922 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -50.43 -33.82 22.29 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 1.057 HD12 HD22 ' B' ' 127' ' ' LEU . 0.4 OUTLIER -78.1 -53.94 6.83 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.894 -0.722 . . . . 0.0 111.771 178.594 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.548 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.1 OUTLIER -63.44 -25.49 68.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.995 178.621 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.62 -26.18 31.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.775 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.63 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 97.4 m-85 -87.64 -49.11 7.37 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.295 178.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.63 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 25.0 p-10 136.46 34.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 124.844 1.34 . . . . 0.0 112.078 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.599 ' CG1' HD13 ' B' ' 117' ' ' LEU . 5.5 p -120.76 -39.7 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.419 ' O ' ' HE1' ' A' ' 32' ' ' MET . 36.8 m-80 59.95 -119.64 0.92 Allowed 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 0.87 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -139.21 4.02 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 179.477 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.69 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.4 OUTLIER -40.53 -64.96 0.46 Allowed 'General case' 0 C--O 1.243 0.744 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.466 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.445 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.5 -23.13 51.95 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.128 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 1.057 HD22 HD12 ' B' ' 117' ' ' LEU . 7.0 tp -63.99 -61.27 2.38 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-N 116.843 0.322 . . . . 0.0 111.187 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.87 HG23 ' CG2' ' B' ' 124' ' ' ILE . 24.8 t -51.83 -61.19 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.8 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.8 p -48.41 -49.08 36.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.445 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.5 OUTLIER -77.04 -43.73 33.45 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.61 0.641 . . . . 0.0 110.496 179.776 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -63.14 -39.89 96.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.647 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.95 ' HA ' HD12 ' A' ' 17' ' ' LEU . 4.8 mmt -63.48 -57.05 11.45 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.62 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.442 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 5.3 tp60 -48.82 -37.52 19.55 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.962 0.164 . . . . 0.0 111.225 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -65.18 -57.47 8.45 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.769 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.928 ' HB2' HD11 ' A' ' 17' ' ' LEU . 1.3 mm-40 -75.81 -8.56 57.17 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.569 0.223 . . . . 0.0 111.053 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.795 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.23 -32.48 19.75 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.39 -46.77 13.11 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.898 0.856 . . . . 0.0 110.326 178.245 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 11.4 mtt180 . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 113.617 -1.629 . . . . 0.0 114.614 -176.479 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.579 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 1.7 mmmt . . . . . 0 N--CA 1.47 0.529 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.715 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -119.28 107.64 13.64 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.312 0.577 . . . . 0.0 111.796 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.893 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.94 109.79 14.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.534 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.909 HD13 HG13 ' B' ' 107' ' ' VAL . 0.0 OUTLIER -121.28 112.93 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 177.396 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.787 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.0 OUTLIER -123.46 132.92 54.08 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.84 -177.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.834 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.41 112.27 32.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 176.928 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.402 HG23 ' NH1' ' B' ' 104' ' ' ARG . 6.5 p -67.06 92.76 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.623 -0.673 . . . . 0.0 110.07 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.813 HG11 ' CB ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -97.64 -155.13 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.404 -178.235 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 24.7 t0 113.22 5.27 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.597 1.159 . . . . 0.0 108.837 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.7 t -152.18 -38.8 0.11 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.756 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.726 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -73.3 32.64 0.07 Allowed 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -177.306 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER 70.71 1.71 3.83 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 120.692 -1.255 . . . . 0.0 113.856 178.202 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.034 ' CZ ' HG21 ' B' ' 105' ' ' ILE . 0.7 OUTLIER -55.92 -53.6 54.88 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.919 0.39 . . . . 0.0 110.919 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.622 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 3.0 mp0 -49.91 -41.55 46.21 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -177.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.726 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -51.08 -29.71 13.88 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.836 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.94 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.65 -59.8 2.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.466 0.651 . . . . 0.0 110.919 178.2 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 4.4 pttt -63.63 -25.91 68.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.799 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.464 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.25 -25.64 34.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.098 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.61 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 21.0 m-85 -88.32 -50.24 6.46 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.565 178.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.61 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 19.7 t0 143.34 50.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.216 0.947 . . . . 0.0 110.166 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 22' ' ' VAL . 1.4 p -176.05 96.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.738 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -60.83 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.109 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.974 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -146.38 5.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 24' ' ' ILE . 36.2 p -39.11 -62.99 0.58 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.455 -177.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.18 -30.04 32.12 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.098 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.816 HD23 HG23 ' A' ' 24' ' ' ILE . 22.0 tp -60.56 -56.3 22.95 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.193 0.197 . . . . 0.0 111.28 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.992 HG22 HG21 ' B' ' 124' ' ' ILE . 3.1 t -53.96 -64.43 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.439 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.687 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.75 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 10.8 p -49.73 -42.19 45.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.411 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.11 -46.15 52.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.436 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.784 ' HB ' HD21 ' B' ' 127' ' ' LEU . 22.9 m -63.21 -36.13 82.63 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.981 179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' MET . . . . . 1.071 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -54.57 -47.86 72.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.184 179.071 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.5 -36.85 76.84 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 120.475 0.179 . . . . 0.0 111.182 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.43 -44.8 50.21 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.767 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.2 tp10 -69.86 -26.63 64.3 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.045 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.764 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.34 -44.72 64.54 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -55.55 11.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.509 0.671 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 CA--C 1.543 0.708 0 CA-C-N 114.668 -1.151 . . . . 0.0 114.046 -176.627 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.49 ' HA ' ' HD3' ' B' ' 102' ' ' LYS . 1.8 mmtp . . . . . 0 N--CA 1.465 0.29 0 CA-C-O 121.007 0.432 . . . . 0.0 111.982 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.487 ' HG2' HG22 ' B' ' 105' ' ' ILE . 2.0 tt0 -113.54 110.6 20.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.965 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.711 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 11.8 ttm-85 -79.23 99.14 6.91 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.183 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 1.034 HG21 ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -104.82 112.29 37.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.587 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.787 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -107.33 125.1 50.75 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.447 -175.995 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.909 HG13 HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -99.33 93.3 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.576 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.893 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.3 p -66.31 67.64 0.05 Allowed 'General case' 0 CA--C 1.523 -0.079 0 CA-C-O 122.276 1.036 . . . . 0.0 109.526 -177.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.061 HG11 ' CB ' ' B' ' 114' ' ' TYR . 7.1 p -69.92 -127.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.848 -178.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.715 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 3.6 t70 83.44 -3.35 1.19 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.914 0.864 . . . . 0.0 109.082 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 38.0 m -127.06 -64.66 0.99 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.358 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.75 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.64 -85.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.712 0 O-C-N 123.696 0.623 . . . . 0.0 112.258 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.497 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.6 t 174.64 43.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.364 0.602 . . . . 0.0 110.881 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.061 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.4 OUTLIER -84.06 -42.27 16.31 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.57 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.42 -42.24 21.86 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -175.629 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.764 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -52.54 -49.79 64.18 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.996 0.816 . . . . 0.0 111.362 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.899 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.41 -48.98 78.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.819 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.571 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -71.27 -26.13 62.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.238 0.542 . . . . 0.0 110.529 179.534 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.16 -24.04 62.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.82 178.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.601 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 10.4 m-30 -87.98 -43.64 11.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.601 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 1.9 p-10 121.72 19.36 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.137 0 O-C-N 125.007 1.442 . . . . 0.0 111.81 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 79.2 t -101.7 -40.64 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.25 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.605 ' O ' HD12 ' B' ' 117' ' ' LEU . 5.3 m-80 61.54 -124.96 0.84 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.071 HG23 ' HE2' ' A' ' 32' ' ' MET . 0.3 OUTLIER -131.51 3.59 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.425 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.5 OUTLIER -39.43 -64.33 0.48 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.253 -178.444 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.426 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -87.23 -25.39 33.92 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.387 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.784 HD21 ' HB ' ' A' ' 31' ' ' THR . 6.1 tt -59.38 -61.44 2.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.188 0.518 . . . . 0.0 110.222 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.011 HG13 ' HE3' ' B' ' 132' ' ' MET . 3.4 t -50.67 -63.54 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.443 178.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.726 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 92.4 p -48.58 -46.9 39.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.438 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.6 OUTLIER -70.17 -48.01 59.14 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.689 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -65.02 -33.72 76.72 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.817 179.949 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.011 ' HE3' HG13 ' B' ' 128' ' ' VAL . 2.1 mmt -56.13 -52.92 62.62 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.187 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -58.16 -36.86 73.64 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.622 0.231 . . . . 0.0 111.622 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 134' ' ' ASN . . . . . 0.462 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.44 -51.05 13.95 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.774 ' HB3' HD21 ' A' ' 17' ' ' LEU . 12.0 tp10 -67.47 -24.46 65.6 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.965 -0.384 . . . . 0.0 109.965 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.726 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -69.41 -46.28 67.2 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -53.45 12.96 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.853 178.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.636 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -175.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.275 0 CA-C-O 120.861 0.362 . . . . 0.0 110.45 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.64 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 43.2 tp60 -124.96 116.28 21.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.148 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.858 ' HG3' HG22 ' B' ' 108' ' ' THR . 2.0 ttm105 -79.11 114.3 17.94 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.668 0.747 . . . . 0.0 111.667 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.949 HD13 ' CD1' ' B' ' 114' ' ' TYR . 4.4 pt -114.62 128.91 71.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.717 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.56 131.73 41.82 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.285 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.715 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.22 103.45 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 106.914 -1.514 . . . . 0.0 106.914 174.208 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.501 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 9.7 p -70.36 69.08 0.37 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.715 0.769 . . . . 0.0 109.837 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.9 HG11 ' HB2' ' A' ' 14' ' ' TYR . 14.3 p -85.89 -135.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.384 -1.28 . . . . 0.0 111.468 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.782 ' H ' HG22 ' A' ' 9' ' ' VAL . 20.4 t70 108.39 20.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.171 0.986 . . . . 0.0 109.607 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.552 ' H ' HG22 ' A' ' 9' ' ' VAL . 4.3 t -160.7 -45.69 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.5 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.751 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -79.05 61.39 3.2 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 119.61 -0.836 . . . . 0.0 113.165 -177.317 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.534 ' HB2' ' O ' ' B' ' 129' ' ' SER . 3.7 m 68.19 -7.78 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 177.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.9 ' HB2' HG11 ' A' ' 9' ' ' VAL . 1.1 t80 -50.29 -57.61 7.48 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.674 1.125 . . . . 0.0 110.348 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.582 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 39.5 mt-30 -49.77 -38.81 35.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.878 -178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.79 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -51.32 -33.09 27.62 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.942 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.67 -52.55 8.79 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.245 0.545 . . . . 0.0 111.317 178.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.691 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -66.28 -25.5 66.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.388 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 -28.21 62.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.411 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.717 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 6.8 m-30 -88.29 -40.78 13.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.888 178.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.717 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 120.39 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 125.203 1.565 . . . . 0.0 109.496 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.8 t -141.71 -48.15 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.04 0 CA-C-N 114.421 -1.263 . . . . 0.0 111.068 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.406 ' OD1' ' HB3' ' A' ' 18' ' ' LYS . 18.3 m-80 67.39 -113.71 0.17 Allowed 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -178.313 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.053 HG23 ' HE2' ' B' ' 132' ' ' MET . 0.1 OUTLIER -143.04 -1.27 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 178.628 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 24' ' ' ILE . 63.0 p -39.52 -64.9 0.43 Allowed 'General case' 0 C--O 1.245 0.853 0 CA-C-N 118.901 0.773 . . . . 0.0 110.468 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.537 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -79.0 -29.11 52.65 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.432 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.919 HD22 ' HG ' ' A' ' 17' ' ' LEU . 16.7 tp -62.41 -58.41 7.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.87 HG23 ' CG2' ' A' ' 24' ' ' ILE . 4.0 t -52.17 -71.39 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.396 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.81 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 93.7 p -47.37 -39.36 15.0 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.3 m -69.67 -48.0 61.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.251 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.3 m -65.34 -32.13 73.62 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.694 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.801 ' HE2' HG23 ' B' ' 124' ' ' ILE . 11.5 mmt -59.43 -57.42 13.04 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.959 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -55.56 -34.99 65.25 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.547 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -49.38 21.26 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 1.107 ' HB3' HD21 ' B' ' 117' ' ' LEU . 3.4 tp10 -72.15 -21.75 61.41 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.083 0.468 . . . . 0.0 109.776 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.612 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -70.38 -45.35 66.18 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.244 0.545 . . . . 0.0 109.628 178.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -55.02 5.12 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.883 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.662 0 CA-C-N 114.895 -1.048 . . . . 0.0 113.747 -176.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.42 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 7.4 mptt . . . . . 0 CA--C 1.532 0.287 0 CA-C-O 120.733 0.302 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.727 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 7.7 tt0 -97.22 108.87 21.69 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.237 0.542 . . . . 0.0 110.942 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.757 ' NH2' HG21 ' B' ' 106' ' ' THR . 0.3 OUTLIER -78.34 99.09 6.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.428 0.632 . . . . 0.0 110.163 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.863 HD11 HG11 ' B' ' 128' ' ' VAL . 3.9 pt -100.34 126.93 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.757 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -131.75 122.85 26.53 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -175.669 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.732 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.01 106.73 19.94 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.499 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.858 HG22 ' HG3' ' A' ' 4' ' ' ARG . 76.8 p -70.07 98.7 1.35 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.282 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.908 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.73 -124.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.85 -178.22 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.64 ' HB2' ' N ' ' A' ' 3' ' ' GLN . 26.0 t0 95.84 9.99 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 122.098 0.952 . . . . 0.0 108.845 -175.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.4 t -164.51 -43.13 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.985 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.829 ' HB2' HG12 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -68.47 52.58 0.08 Allowed 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.153 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.632 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.1 m 56.03 7.97 0.34 Allowed 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.068 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.949 ' CD1' HD13 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -63.99 -54.6 31.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.973 0.416 . . . . 0.0 111.491 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.578 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.95 -34.17 12.39 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.609 -176.421 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.609 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -52.15 -56.19 16.12 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.145 0.498 . . . . 0.0 110.781 178.857 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 1.107 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.5 OUTLIER -55.11 -50.85 68.18 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.031 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.606 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -71.85 -25.6 62.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.36 -179.386 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -58.1 -26.03 62.09 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.063 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.686 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 4.6 m-30 -88.27 -44.43 10.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.65 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.686 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.8 m-20 129.68 38.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.884 1.365 . . . . 0.0 111.284 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 91.0 t -122.74 -44.11 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.011 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.436 ' OD1' ' HE1' ' B' ' 114' ' ' TYR . 0.6 OUTLIER 61.55 -132.61 0.65 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 -178.253 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.016 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -134.07 8.48 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.744 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.504 ' HA ' ' HB ' ' A' ' 7' ' ' VAL . 0.9 OUTLIER -39.72 -63.99 0.53 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 120.235 -0.586 . . . . 0.0 109.944 -178.023 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.474 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.0 -30.78 13.4 Favored Glycine 0 C--O 1.225 -0.439 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.712 177.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.822 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -52.57 -61.11 2.49 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.638 0.375 . . . . 0.0 110.61 179.038 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.016 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.4 t -54.27 -64.35 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.544 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.751 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 4.9 p -49.22 -44.8 43.71 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.75 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.474 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -69.91 -53.72 16.67 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 121.767 -0.583 . . . . 0.0 109.843 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.5 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -57.9 -37.81 74.7 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.52 -179.63 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.053 ' HE2' HG23 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -49.19 -46.46 45.58 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.328 179.138 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -48.37 80.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.584 0.23 . . . . 0.0 111.35 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -58.14 -56.54 20.73 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.485 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.4 ' HG3' ' CD1' ' A' ' 27' ' ' LEU . 1.7 mm-40 -59.98 -40.13 88.06 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.79 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -60.04 -44.33 94.73 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.605 178.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -56.51 7.7 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.315 0.579 . . . . 0.0 111.339 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.568 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.125 -177.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.473 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 11.1 mmtm . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.694 0.283 . . . . 0.0 111.509 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.4 tp60 -101.75 118.46 36.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.631 0.729 . . . . 0.0 112.087 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.931 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.39 101.03 7.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.94 -179.532 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.917 HD13 ' CD2' ' B' ' 114' ' ' TYR . 8.3 pt -104.52 128.79 57.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.788 HG21 ' CZ ' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -131.56 124.59 30.35 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.882 -177.273 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.925 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -101.25 105.0 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 174.792 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 9.9 p -69.14 87.77 0.41 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -178.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.925 HG22 HG22 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -86.78 -139.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.16 -178.605 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.67 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 2.4 t70 87.22 -5.15 0.64 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -175.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.53 -67.7 0.94 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.117 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.848 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 1.1 m-20 -49.55 -87.45 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m -177.43 42.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.174 0.897 . . . . 0.0 111.751 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.982 ' CD1' HD13 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -82.53 -44.56 15.76 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.664 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.67 -40.39 39.71 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -176.27 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.735 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -57.09 -54.0 51.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.736 0.698 . . . . 0.0 111.995 -179.503 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.881 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -49.54 -48.06 48.6 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.282 0.563 . . . . 0.0 111.387 -178.871 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.664 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.13 -30.41 43.68 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.045 179.274 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -63.78 -27.43 69.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.175 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.604 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -87.69 -44.77 10.93 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-O 118.765 -0.636 . . . . 0.0 109.399 178.816 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.604 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 157.28 16.46 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 177.028 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.515 ' O ' HD12 ' A' ' 17' ' ' LEU . 70.9 t -156.85 90.37 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 118.265 0.484 . . . . 0.0 111.973 -177.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.578 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 1.3 p30 -56.78 -100.1 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.013 HG23 ' HE2' ' B' ' 132' ' ' MET . 0.3 OUTLIER -139.97 1.26 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 24' ' ' ILE . 88.0 p -41.89 -65.26 0.47 Allowed 'General case' 0 C--O 1.239 0.519 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.866 -178.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.93 -25.88 43.54 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.813 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.746 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -62.17 -59.41 5.08 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.945 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -52.77 -66.25 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.713 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.779 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 18.1 p -48.74 -35.59 14.51 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.5 m -72.88 -56.26 5.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 28' ' ' VAL . 3.1 t -58.74 -36.64 74.67 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.126 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' MET . . . . . 1.092 ' SD ' HD12 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -55.53 -55.37 32.65 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.641 178.775 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -56.19 -53.49 56.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.589 0.233 . . . . 0.0 110.782 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -57.69 -46.91 83.69 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB3' HD11 ' B' ' 117' ' ' LEU . 3.2 tp10 -70.23 -19.89 63.12 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.353 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.738 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -77.38 -44.48 29.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -54.74 7.61 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.564 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.741 -176.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.67 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 17.1 tt0 -98.41 115.18 27.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.799 178.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.788 ' CZ ' HG21 ' A' ' 6' ' ' THR . 28.7 ttt-85 -77.52 101.93 6.7 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.226 -0.589 . . . . 0.0 110.461 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.982 HD13 ' CD1' ' A' ' 14' ' ' TYR . 1.8 pt -102.62 130.21 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.657 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.77 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.4 OUTLIER -131.26 121.59 25.04 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.056 -0.657 . . . . 0.0 111.823 -176.954 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.67 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.8 OUTLIER -101.28 91.59 2.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.085 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 176.127 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.931 HG22 ' HG3' ' A' ' 4' ' ' ARG . 31.9 p -60.85 90.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.505 0.669 . . . . 0.0 110.385 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.018 HG21 ' CD1' ' B' ' 114' ' ' TYR . 31.6 m -87.5 -148.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.885 -177.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 23.7 t70 96.04 -10.33 0.09 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.371 1.069 . . . . 0.0 108.342 -176.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.417 ' HG ' ' HZ2' ' A' ' 2' ' ' LYS . 58.4 m -118.15 -62.9 1.49 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.779 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.4 OUTLIER -42.03 -92.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.662 0.601 . . . . 0.0 112.34 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.48 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.2 m -180.0 41.18 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.724 -0.61 . . . . 0.0 110.765 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.018 ' CD1' HG21 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -83.04 -45.2 14.32 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.617 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.7 mp0 -49.18 -45.27 43.83 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.738 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -51.8 -28.02 14.22 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.759 0.709 . . . . 0.0 112.356 -179.914 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 1.092 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.6 OUTLIER -78.33 -57.25 3.88 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 120.113 -0.635 . . . . 0.0 111.329 178.111 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -62.36 -25.43 67.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.337 178.979 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.39 -27.06 34.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.004 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.62 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.5 m-30 -88.18 -49.56 6.93 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.644 178.343 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.9 m-20 139.4 46.14 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 O-C-N 124.407 1.067 . . . . 0.0 110.675 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.743 ' O ' HG13 ' B' ' 122' ' ' VAL . 4.0 p -163.14 89.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.725 0.774 . . . . 0.0 110.783 -178.27 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.725 ' O ' ' HE1' ' A' ' 32' ' ' MET . 74.6 m-80 -58.41 -98.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.722 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.091 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -152.55 9.73 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.405 ' C ' ' O ' ' B' ' 124' ' ' ILE . 2.1 p -39.59 -64.7 0.45 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.144 -177.085 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.609 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.13 -28.5 20.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.705 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -55.48 -61.43 2.35 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.485 0.314 . . . . 0.0 110.783 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.091 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -53.59 -62.7 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.602 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.808 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.848 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 2.3 p -50.13 -43.69 51.99 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.609 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.5 OUTLIER -70.16 -50.27 42.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.457 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.442 ' N ' ' CG2' ' B' ' 130' ' ' THR . 54.8 m -55.9 -43.46 77.29 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.51 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.013 ' HE2' HG23 ' A' ' 24' ' ' ILE . 4.6 mtt -61.08 -57.63 11.74 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.897 178.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -40.39 37.21 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.067 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -56.04 12.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.242 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.566 ' HB2' HD21 ' A' ' 17' ' ' LEU . 14.0 mm-40 -69.41 -13.45 62.37 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.544 0.211 . . . . 0.0 111.293 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.735 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -86.49 -38.18 17.52 Favored 'General case' 0 C--O 1.227 -0.1 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -47.61 45.4 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.3 ttp85 . . . . . 0 N--CA 1.441 -0.878 0 CA-C-N 114.075 -1.42 . . . . 0.0 110.613 -179.371 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 36.3 mmtt . . . . . 0 N--CA 1.476 0.83 0 CA-C-O 120.559 0.218 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.621 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.5 OUTLIER -102.72 101.8 11.93 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.711 0.767 . . . . 0.0 112.07 -179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.89 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.2 ttp-105 -79.68 98.85 7.13 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.919 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 1.113 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -107.42 108.77 26.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.727 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.264 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.63 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -103.77 123.9 47.91 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.068 -176.33 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.691 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -100.63 105.83 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.397 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.2 p -70.23 90.63 0.69 Allowed 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.013 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.942 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.7 t -83.28 -134.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.494 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 26.8 t70 90.56 -5.79 0.3 Allowed 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.23 -58.56 0.59 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.27 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.734 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -43.65 -92.08 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.51 ' O ' ' HB2' ' B' ' 132' ' ' MET . 0.6 OUTLIER -179.02 37.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.388 0.995 . . . . 0.0 112.034 -179.396 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.942 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.76 -43.75 16.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.083 0.953 . . . . 0.0 112.56 179.472 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.626 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 38.6 mt-30 -50.05 -44.12 51.4 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.924 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.2 mt -48.1 -30.4 4.46 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.267 0.485 . . . . 0.0 112.291 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.8 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -78.26 -57.35 3.83 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.408 177.518 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.626 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -63.18 -25.49 68.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.842 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.428 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -26.31 33.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.335 178.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.557 ' O ' ' CB ' ' A' ' 21' ' ' ASP . 9.6 m-30 -87.85 -40.62 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.557 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.3 t0 120.91 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 122.34 1.067 . . . . 0.0 111.086 177.647 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.7 ' CG1' HD12 ' A' ' 17' ' ' LEU . 8.1 p -151.49 92.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.852 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.888 ' O ' HD12 ' A' ' 24' ' ' ILE . 1.7 m120 -65.75 48.8 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.46 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.05 HG21 ' SD ' ' B' ' 132' ' ' MET . 1.3 pp 31.68 9.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.642 ' HA ' HG22 ' B' ' 107' ' ' VAL . 67.2 m -36.47 -63.06 0.42 Allowed 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.036 0.446 . . . . 0.0 111.252 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -17.38 70.27 Favored Glycine 0 C--N 1.335 0.493 0 CA-C-N 115.848 -0.614 . . . . 0.0 112.62 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.788 ' CB ' HG22 ' A' ' 24' ' ' ILE . 2.3 tm? -67.54 -61.21 2.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.749 HG22 HG22 ' B' ' 128' ' ' VAL . 87.2 t -45.02 -67.67 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.361 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.565 ' HA ' ' HG2' ' A' ' 32' ' ' MET . 1.2 p -48.43 -36.92 15.81 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.581 0.752 . . . . 0.0 112.396 178.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.6 m -68.54 -52.75 28.55 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.421 HG21 HG21 ' B' ' 131' ' ' THR . 15.7 m -55.95 -35.71 66.98 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.756 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.864 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 1.3 mmt -56.94 -55.03 39.91 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.983 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.533 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -56.09 -49.91 72.5 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.745 0.307 . . . . 0.0 111.259 179.844 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -59.6 -51.44 69.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.871 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.815 ' HB3' HD11 ' B' ' 117' ' ' LEU . 5.2 tp10 -74.13 -14.89 61.03 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.392 178.238 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.959 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -84.26 -32.7 24.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -52.03 13.31 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.772 0.796 . . . . 0.0 109.475 178.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.729 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.506 -178.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.481 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 1.4 mmpt? . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 120.899 0.38 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.774 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 4.5 tp60 -115.27 116.52 28.45 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.208 0.528 . . . . 0.0 110.648 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.453 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.02 111.08 14.86 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.083 -178.607 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.862 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -115.31 118.84 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 175.844 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.662 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -123.98 131.19 53.53 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 120.285 -0.566 . . . . 0.0 111.722 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.691 HG12 HG12 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -101.23 86.45 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.89 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 68.2 p -64.88 77.1 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 -179.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.723 HG11 ' HB2' ' B' ' 114' ' ' TYR . 7.2 p -108.92 -120.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.893 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.621 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 1.1 t70 94.47 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.963 1.363 . . . . 0.0 109.506 -176.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.672 ' H ' HG22 ' B' ' 109' ' ' VAL . 45.7 t -154.46 -52.45 0.09 Allowed 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 112.507 -2.133 . . . . 0.0 111.845 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.523 ' O ' ' HB2' ' A' ' 29' ' ' SER . 55.1 m-20 -75.33 54.14 0.7 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -177.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.533 ' OG ' ' HB2' ' A' ' 33' ' ' GLN . 2.4 m 70.48 -3.31 1.92 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.113 ' CE1' HG21 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -55.1 -53.92 49.75 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.482 0.583 . . . . 0.0 111.204 179.491 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.541 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 14.3 mt-30 -49.85 -42.79 48.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -177.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.959 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -52.09 -31.38 30.32 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.428 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.815 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -77.75 -53.69 7.23 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.603 179.403 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.6 -28.11 68.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.57 -29.87 66.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.213 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.607 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.9 OUTLIER -88.5 -43.02 11.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.372 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.607 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 151.39 31.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 176.902 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 121' ' ' ASP . 74.5 t -162.37 97.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.407 0.146 . . . . 0.0 111.08 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.801 ' O ' ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.1 -83.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 178.09 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.023 HD11 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -165.2 3.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 178.543 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.433 ' C ' ' O ' ' B' ' 124' ' ' ILE . 7.0 p -38.24 -63.74 0.47 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.39 0.995 . . . . 0.0 111.19 -177.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -84.81 -29.47 29.0 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.195 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.712 HD22 HD22 ' B' ' 117' ' ' LEU . 14.2 tp -59.72 -59.87 4.75 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.956 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -50.97 -59.69 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.734 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.1 m -50.03 -40.32 44.53 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 17.7 m -71.07 -53.01 16.18 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.536 HG22 ' HA ' ' B' ' 128' ' ' VAL . 4.9 t -59.6 -36.97 77.34 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.857 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.05 ' SD ' HG21 ' A' ' 24' ' ' ILE . 3.5 mmt -60.6 -58.3 9.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.892 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.487 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 1.8 tt0 -55.67 -39.99 71.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.445 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -49.63 55.74 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.311 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.478 ' HA ' ' OE1' ' B' ' 135' ' ' GLU . 3.7 mm-40 -69.87 -26.99 64.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.924 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -63.93 -48.17 77.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 176.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -53.92 49.0 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.276 -0.875 . . . . 0.0 108.833 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.33 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.289 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 10.0 mmtt . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 110.857 -0.053 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.483 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -110.41 106.38 15.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.1 ttm105 -78.62 102.32 7.91 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.247 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 1.106 HD13 ' CD2' ' B' ' 114' ' ' TYR . 4.5 pt -104.0 130.12 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.837 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.06 126.07 34.88 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.052 0.453 . . . . 0.0 111.681 -176.787 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.608 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -99.67 106.7 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.62 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' B' ' 102' ' ' LYS . 1.8 p -70.21 73.93 0.49 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.418 0.628 . . . . 0.0 109.388 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.054 HG21 ' HB3' ' A' ' 14' ' ' TYR . 7.3 p -76.85 -135.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.411 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.824 ' H ' HG22 ' A' ' 9' ' ' VAL . 16.0 t70 89.07 -7.31 0.44 Allowed 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.064 1.302 . . . . 0.0 108.964 -176.004 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 67.8 m -132.13 -54.77 0.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.404 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.762 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -46.14 -93.39 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.515 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.2 OUTLIER -178.32 38.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 118.964 0.802 . . . . 0.0 111.288 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.054 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.2 -41.85 17.95 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.318 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.7 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.6 mm100 -48.79 -40.6 29.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -173.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.901 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -57.58 -52.12 66.69 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 119.031 0.832 . . . . 0.0 112.141 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.096 HD22 ' HA ' ' B' ' 132' ' ' MET . 1.5 tp -61.66 -36.48 80.95 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 119.805 -0.758 . . . . 0.0 112.971 -177.214 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.7 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -79.89 -29.3 39.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.509 0.671 . . . . 0.0 110.737 177.71 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.495 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -75.19 -32.16 61.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.851 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.632 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -87.63 -41.92 13.06 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.655 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.622 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 165.42 12.36 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 176.973 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.435 HG23 ' C ' ' A' ' 21' ' ' ASP . 78.6 t -155.79 86.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 118.377 0.535 . . . . 0.0 111.354 -177.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.455 ' O ' ' CE ' ' B' ' 132' ' ' MET . 4.9 p30 -58.9 -95.1 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.116 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.81 -0.31 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 177.825 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.454 ' C ' ' O ' ' A' ' 24' ' ' ILE . 73.7 p -41.38 -64.36 0.57 Allowed 'General case' 0 C--O 1.244 0.796 0 C-N-CA 119.126 -1.029 . . . . 0.0 109.22 -179.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.46 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.06 -29.0 24.11 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.121 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.644 ' CD1' HD23 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -56.06 -61.86 2.1 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 116.812 0.306 . . . . 0.0 110.81 179.518 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.116 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.5 t -52.33 -61.6 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.163 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.723 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.5 p -50.25 -48.62 54.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.46 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.11 -51.3 25.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.65 ' OG1' HG21 ' B' ' 131' ' ' THR . 2.6 m -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.311 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' MET . . . . . 1.017 ' HE2' HG23 ' B' ' 124' ' ' ILE . 16.7 mtt -61.65 -49.95 74.47 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.986 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.476 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.69 -43.58 80.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.334 0.515 . . . . 0.0 109.862 178.731 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.476 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -66.07 -48.06 72.21 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.238 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.651 ' HB3' ' CD2' ' B' ' 117' ' ' LEU . 3.9 tp10 -64.37 -30.05 71.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.887 177.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.623 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -69.47 -49.52 54.1 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 177.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.39 -51.47 66.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.736 0.779 . . . . 0.0 109.004 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.426 ' NE ' ' OD1' ' A' ' 34' ' ' ASN . 2.0 mtm-85 . . . . . 0 N--CA 1.448 -0.551 0 CA-C-N 113.918 -1.492 . . . . 0.0 111.406 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.575 ' HE3' ' HA ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.377 0 CA-C-O 120.87 0.367 . . . . 0.0 111.122 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.575 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 4.9 tp60 -100.5 110.02 22.17 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.532 0.682 . . . . 0.0 111.111 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.527 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.1 OUTLIER -79.4 101.48 8.17 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.362 -178.897 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.809 HD13 ' CD2' ' A' ' 14' ' ' TYR . 5.5 pt -108.0 122.53 62.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.837 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.0 125.0 32.15 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.966 -178.176 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.61 HG13 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -100.75 101.8 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.949 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.839 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.1 p -66.81 86.23 0.12 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.384 0.611 . . . . 0.0 110.83 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.036 HG21 ' CD1' ' B' ' 114' ' ' TYR . 28.6 m -81.71 -141.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.849 -178.567 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.691 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.8 t70 93.1 -7.24 0.15 Allowed 'General case' 0 C--N 1.356 0.86 0 CA-C-O 121.97 0.89 . . . . 0.0 108.757 -176.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.04 -58.16 1.01 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.283 177.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.723 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.07 -89.69 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.395 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.8 m 179.91 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.266 0.939 . . . . 0.0 112.03 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.106 ' CD2' HD13 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -82.7 -40.8 20.12 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.742 0.817 . . . . 0.0 113.18 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.662 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 3.8 mt-30 -48.84 -42.03 34.98 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -175.082 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.623 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -58.42 -45.95 87.43 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.015 1.28 . . . . 0.0 112.091 -179.383 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.924 HD23 ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -55.39 -45.63 76.61 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.532 0.682 . . . . 0.0 111.132 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.662 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.18 -34.37 43.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 179.98 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.52 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -60.3 -28.45 68.12 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.701 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.62 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.32 -45.34 10.1 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.52 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.5 m-20 147.63 41.82 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 176.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.448 ' HB ' ' CD1' ' B' ' 117' ' ' LEU . 24.6 t -150.87 -37.92 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' B' ' 122' ' ' VAL . 17.0 m-80 64.26 -112.16 0.31 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.05 HG21 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.5 -0.99 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 179.169 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.449 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.1 OUTLIER -40.01 -64.39 0.5 Allowed 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.769 -178.706 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.22 -31.48 16.78 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.01 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.613 HD12 ' HG ' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.07 -61.18 2.39 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.562 0.345 . . . . 0.0 110.143 178.673 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.991 HG22 HG21 ' A' ' 24' ' ' ILE . 2.4 t -52.58 -61.31 0.82 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.121 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.762 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 28.8 t -48.92 -45.21 41.18 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -71.93 -51.42 22.23 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.65 HG21 ' OG1' ' A' ' 31' ' ' THR . 21.0 m -58.58 -47.81 83.03 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.027 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.096 ' HA ' HD22 ' A' ' 17' ' ' LEU . 5.5 mmt -56.25 -57.75 10.89 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.131 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.447 ' HA ' ' HB3' ' B' ' 136' ' ' ALA . 42.0 tt0 -51.66 -37.52 50.82 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.485 0.183 . . . . 0.0 111.301 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -55.38 14.43 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.639 ' HB3' HD11 ' A' ' 17' ' ' LEU . 3.2 mt-10 -74.92 -9.69 58.78 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.736 0.303 . . . . 0.0 110.72 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.901 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.33 -29.62 21.43 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 -48.34 11.45 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 122.153 0.977 . . . . 0.0 109.027 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 . . . . . 0 CA--C 1.545 0.763 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.103 -178.027 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.6 mtmm . . . . . 0 N--CA 1.468 0.463 0 CA-C-O 120.504 0.192 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.678 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -126.62 122.74 35.87 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.39 0.614 . . . . 0.0 112.488 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.92 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.72 111.46 14.85 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.697 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -111.75 122.91 66.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.435 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.717 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.04 128.8 41.02 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 119.99 -0.684 . . . . 0.0 112.641 -177.385 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.652 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.86 109.91 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 175.614 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.4 p -70.59 77.47 0.59 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.79 0.805 . . . . 0.0 109.392 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.888 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.9 p -92.51 -147.45 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-N 114.044 -1.435 . . . . 0.0 111.086 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.729 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 20.1 t70 106.7 13.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.477 1.132 . . . . 0.0 109.658 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -160.22 -40.3 0.05 Allowed 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.529 -1.668 . . . . 0.0 109.911 179.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.845 ' HB2' HG23 ' A' ' 9' ' ' VAL . 0.6 OUTLIER -69.81 35.11 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.53 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 28.7 m 72.18 4.08 4.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 177.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.001 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -58.0 -55.09 39.45 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.167 0.508 . . . . 0.0 111.959 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.551 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.6 mt-30 -49.74 -40.38 40.63 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -176.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.823 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -54.86 -32.49 60.8 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.917 HD22 HD22 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -77.35 -51.78 10.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.645 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.671 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -68.16 -26.09 65.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.398 0.618 . . . . 0.0 109.788 178.478 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -60.63 -30.61 69.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.749 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.679 ' CE2' ' HG ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -88.35 -44.32 10.87 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 118.677 -0.677 . . . . 0.0 110.041 178.704 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.597 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 160.4 24.22 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.533 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.662 ' O ' HD23 ' A' ' 17' ' ' LEU . 68.1 t -160.65 101.22 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.671 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 1.5 m120 -58.77 -82.92 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 106.287 -1.745 . . . . 0.0 106.287 177.12 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.872 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -161.04 -1.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.647 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.468 ' C ' ' O ' ' A' ' 24' ' ' ILE . 0.5 OUTLIER -38.81 -62.87 0.57 Allowed 'General case' 0 C--O 1.241 0.617 0 CA-C-N 118.872 0.76 . . . . 0.0 109.686 -178.483 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.34 -33.44 31.89 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.802 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.917 HD22 HD22 ' A' ' 17' ' ' LEU . 26.5 tp -59.13 -60.93 3.07 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.031 0.416 . . . . 0.0 111.21 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.921 HG13 ' HE2' ' A' ' 32' ' ' MET . 3.2 t -48.91 -68.49 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 O-C-N 123.351 0.407 . . . . 0.0 109.995 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.712 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -47.16 -41.49 17.93 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.183 0.593 . . . . 0.0 112.561 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -69.94 -50.04 45.92 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.856 0.836 . . . . 0.0 108.981 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.758 HG22 HD11 ' B' ' 127' ' ' LEU . 8.1 m -63.77 -28.83 70.14 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.205 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.921 ' HE2' HG13 ' A' ' 28' ' ' VAL . 4.0 mmt -55.87 -47.42 77.39 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.649 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -56.42 -57.17 13.44 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.521 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 2.8 t-20 -50.65 -51.31 50.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.013 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 1.024 ' HG2' HD13 ' B' ' 127' ' ' LEU . 2.0 tp10 -68.57 -36.94 79.43 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.653 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -57.93 -42.95 85.92 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -52.13 18.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.17 178.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.92 -177.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.494 0 CA-C-O 120.941 0.401 . . . . 0.0 111.413 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.729 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.0 tp60 -98.3 109.73 22.44 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.468 0.652 . . . . 0.0 109.815 178.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.504 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.1 OUTLIER -78.83 99.82 6.89 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.283 -178.304 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.811 HD13 ' CD1' ' A' ' 14' ' ' TYR . 7.2 pt -102.41 123.41 55.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.717 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.6 OUTLIER -131.24 123.35 28.23 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.914 -177.518 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.619 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.05 96.82 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 175.464 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.92 HG22 ' HG3' ' A' ' 4' ' ' ARG . 67.3 p -68.79 94.31 0.6 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.291 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.727 HG21 ' HB2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -116.49 -108.78 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.401 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.678 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 2.4 t0 81.95 25.51 0.2 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 123.211 1.481 . . . . 0.0 107.844 -174.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.8 p -151.21 -57.77 0.16 Allowed 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 112.005 -2.362 . . . . 0.0 111.196 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.712 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 65.3 m-20 -72.87 59.14 0.48 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.56 ' O ' ' HB3' ' A' ' 32' ' ' MET . 64.8 m 60.68 2.65 0.52 Allowed 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.84 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -59.97 -49.91 75.82 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.473 0.654 . . . . 0.0 109.584 178.715 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.716 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -49.46 -39.56 33.79 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.66 -177.663 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.653 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -54.99 -45.62 75.07 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.134 0.879 . . . . 0.0 110.238 179.578 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.93 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.3 OUTLIER -56.51 -53.89 52.2 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.843 179.208 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.716 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 17.8 pttt -68.92 -25.29 64.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.537 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -55.66 -28.0 53.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.3 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.568 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 87.6 m-85 -87.92 -42.75 12.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 177.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.568 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.6 t70 118.27 61.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.648 178.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.918 ' CG1' HD12 ' B' ' 117' ' ' LEU . 3.2 p -151.62 -33.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.46 -178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.433 ' OD1' ' HB3' ' B' ' 118' ' ' LYS . 67.9 m-80 61.83 -123.38 0.78 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -178.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 0.884 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -137.28 9.93 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.598 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.436 ' C ' ' O ' ' B' ' 124' ' ' ILE . 91.9 p -38.84 -63.42 0.52 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.107 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.07 -34.64 14.19 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.681 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 1.024 HD13 ' HG2' ' A' ' 35' ' ' GLU . 34.0 tp -52.85 -61.64 2.16 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 117.33 0.565 . . . . 0.0 110.993 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.884 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.6 t -50.05 -63.86 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.251 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.835 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.81 -47.0 42.58 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 123.773 0.829 . . . . 0.0 112.916 178.085 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -65.46 -56.83 10.28 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.547 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -55.49 -40.48 71.77 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.835 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.001 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 31.6 mtt -58.94 -53.76 54.77 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.816 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.53 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -53.32 -45.14 68.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.438 0.563 . . . . 0.0 110.843 178.978 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -65.41 -56.95 9.69 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.085 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -64.22 -24.14 67.56 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.823 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -71.76 -49.42 39.14 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.045 0.45 . . . . 0.0 109.863 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -52.23 64.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.706 0.765 . . . . 0.0 109.83 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 138' ' ' ARG . . . . . 0.574 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.442 -0.869 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.905 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.444 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 8.4 mtmm . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.475 0.179 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.573 ' O ' ' HA ' ' B' ' 108' ' ' THR . 44.4 tt0 -100.19 118.73 37.11 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.218 0.533 . . . . 0.0 111.833 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.982 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.12 103.12 7.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.67 0.748 . . . . 0.0 111.594 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.811 HD13 ' CD1' ' B' ' 114' ' ' TYR . 2.6 pt -108.08 122.83 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.662 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.39 125.97 32.07 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.859 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.646 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.69 109.83 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.393 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.3 p -70.34 85.93 0.59 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.37 0.605 . . . . 0.0 110.484 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.204 HG21 ' CD1' ' A' ' 14' ' ' TYR . 26.6 m -77.98 -146.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.088 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.664 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 22.9 t0 91.95 -7.88 0.22 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.777 0.799 . . . . 0.0 109.153 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.5 t -130.91 -59.72 0.99 Allowed 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.053 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.769 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.7 OUTLIER -44.4 -94.26 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -178.443 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.538 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 3.1 m -179.8 38.15 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 118.978 0.808 . . . . 0.0 111.526 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.204 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.92 -44.29 15.53 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.655 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 3.4 mt-30 -48.78 -38.78 22.92 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.809 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -53.74 -57.18 11.79 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.673 0.67 . . . . 0.0 112.331 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.923 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -54.25 -42.68 70.18 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 120.211 -0.596 . . . . 0.0 112.437 -178.05 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.655 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.7 -28.4 40.65 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.371 179.615 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -56.29 -24.86 45.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.587 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.615 ' HE2' ' HA ' ' B' ' 136' ' ' ALA . 2.8 m-85 -87.98 -49.15 7.25 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.146 -0.934 . . . . 0.0 108.82 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.562 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 3.8 m-20 143.46 37.15 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 O-C-N 124.443 1.089 . . . . 0.0 110.504 178.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 t -147.87 77.74 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.652 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.537 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 18.9 m-80 -59.0 -105.17 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.053 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -147.62 7.4 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.43 ' C ' ' O ' ' A' ' 24' ' ' ILE . 31.0 p -41.86 -64.42 0.58 Allowed 'General case' 0 C--O 1.24 0.594 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.335 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.8 -30.85 13.79 Favored Glycine 0 C--N 1.333 0.39 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.991 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.674 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -52.3 -61.5 2.24 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 122.486 0.315 . . . . 0.0 110.226 178.786 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.053 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -51.23 -58.7 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.749 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 9.7 p -48.67 -42.4 34.56 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.403 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -79.59 -45.12 19.76 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.13 0.49 . . . . 0.0 110.256 179.826 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.575 HG22 HD21 ' B' ' 127' ' ' LEU . 3.2 m -59.3 -44.64 92.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.803 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.933 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.16 -48.52 61.84 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.436 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -61.38 -37.42 83.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.825 -0.17 . . . . 0.0 111.315 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -51.31 42.0 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.712 ' HG2' HD13 ' B' ' 127' ' ' LEU . 20.5 tp10 -65.77 -34.45 78.21 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.586 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -62.45 -45.16 94.33 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -50.42 71.77 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 122.121 0.962 . . . . 0.0 108.785 177.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.2 ttp85 . . . . . 0 CA--C 1.55 0.969 0 CA-C-N 113.322 -1.763 . . . . 0.0 113.673 -178.013 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.664 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.266 0 CA-C-O 121.204 0.526 . . . . 0.0 111.122 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.683 ' HB3' HG23 ' A' ' 9' ' ' VAL . 13.9 tt0 -105.21 107.63 18.72 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.823 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.452 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 5.2 ttm105 -78.6 101.48 7.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.393 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 1.092 HD13 ' CD2' ' A' ' 14' ' ' TYR . 20.0 pt -102.94 116.6 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.65 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.662 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.92 119.19 35.12 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.223 -177.844 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.795 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.63 92.21 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 176.03 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.982 HG22 ' HG3' ' A' ' 4' ' ' ARG . 81.7 p -62.08 90.87 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.089 0.471 . . . . 0.0 110.412 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.911 HG21 ' HB2' ' B' ' 114' ' ' TYR . 2.1 t -84.12 -136.43 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.04 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.7 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 90.14 -12.26 0.32 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -175.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 39.5 t -122.31 -63.11 1.32 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.161 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.749 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -43.49 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.365 0.416 . . . . 0.0 112.071 -179.018 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER 176.24 44.24 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.744 0.702 . . . . 0.0 110.671 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.911 ' HB2' HG21 ' B' ' 109' ' ' VAL . 0.3 OUTLIER -83.1 -41.9 18.03 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.471 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.616 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.58 -43.62 36.06 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -176.445 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.586 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -48.83 -30.61 5.96 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.713 0.688 . . . . 0.0 112.163 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.933 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.34 -60.11 2.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.374 178.351 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.616 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.1 OUTLIER -63.38 -25.8 68.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.241 179.754 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.407 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.93 -29.17 55.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.518 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.594 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 14.4 m-30 -94.23 -42.32 9.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.594 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 27.6 t70 125.15 54.7 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 122.343 1.068 . . . . 0.0 110.177 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.891 ' CG1' HD13 ' B' ' 117' ' ' LEU . 4.8 p -142.84 -38.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 CA-C-N 113.846 -1.525 . . . . 0.0 111.856 -177.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.708 ' O ' HD12 ' B' ' 117' ' ' LEU . 21.9 m-80 54.65 -117.05 1.12 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 0.995 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.78 5.86 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -179.296 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.456 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -39.18 -63.78 0.51 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.978 -178.471 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.419 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -85.98 -31.24 21.02 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.347 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.739 HD23 HG23 ' B' ' 124' ' ' ILE . 20.3 tp -55.5 -61.67 2.19 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 116.824 0.312 . . . . 0.0 110.664 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.995 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.2 t -52.76 -63.22 0.5 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.974 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.057 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.769 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 11.3 p -49.52 -46.78 48.91 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -72.74 -47.4 47.21 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.537 HG21 ' OG1' ' A' ' 31' ' ' THR . 16.7 m -57.78 -53.98 52.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.4 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.923 ' SD ' HD12 ' A' ' 17' ' ' LEU . 6.1 mmt -50.06 -52.65 32.78 Favored 'General case' 0 C--O 1.205 -1.246 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.118 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.538 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 3.6 tt0 -53.96 -49.1 69.5 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 117.735 0.243 . . . . 0.0 111.369 179.315 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -65.04 -43.42 92.43 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -76.19 -8.65 57.5 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.124 177.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.809 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.43 -47.21 8.95 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 123.158 0.583 . . . . 0.0 109.909 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -56.82 6.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.486 0.66 . . . . 0.0 109.867 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.545 0.757 0 CA-C-N 114.579 -1.191 . . . . 0.0 114.126 -177.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.487 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.2 mmtm . . . . . 0 C--O 1.235 0.29 0 CA-C-O 121.114 0.483 . . . . 0.0 110.149 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.508 ' HG2' ' CG2' ' A' ' 5' ' ' ILE . 1.0 OUTLIER -88.88 114.62 25.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.489 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.975 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -78.94 98.57 6.46 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.936 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 1.115 HG21 ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -114.67 109.8 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.526 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.788 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.3 OUTLIER -108.87 133.81 52.39 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.582 -177.252 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.725 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -99.44 101.18 11.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.0 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.438 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 25.9 p -62.39 88.46 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.632 0.73 . . . . 0.0 110.189 -178.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.236 HG21 ' CD2' ' A' ' 14' ' ' TYR . 28.7 m -80.05 -137.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 114.258 -1.337 . . . . 0.0 112.032 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.548 ' N ' HG23 ' A' ' 9' ' ' VAL . 24.6 t0 81.82 -10.54 1.13 Allowed 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -177.087 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.0 m -120.49 -69.68 0.83 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.674 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.7 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 0.2 OUTLIER -51.32 -89.41 0.0 OUTLIER 'General case' 0 C--N 1.353 0.747 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.146 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.514 ' HB3' ' O ' ' B' ' 129' ' ' SER . 29.2 t -177.14 47.55 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.249 0.931 . . . . 0.0 111.529 -178.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.236 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -80.35 -46.8 15.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -179.796 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.64 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 2.3 mm100 -49.18 -39.78 30.65 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -176.099 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.529 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.7 OUTLIER -56.01 -56.15 24.26 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.704 HD21 ' CG ' ' B' ' 135' ' ' GLU . 0.2 OUTLIER -45.5 -52.91 9.66 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.804 0.812 . . . . 0.0 111.508 -177.695 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.729 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 5.8 pttt -78.99 -26.58 43.35 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.772 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -62.2 -22.84 66.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.251 177.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.704 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -87.83 -43.37 11.88 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 118.666 -0.683 . . . . 0.0 109.441 178.322 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.608 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 164.34 21.79 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 177.786 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.519 ' H ' ' HA ' ' A' ' 18' ' ' LYS . 59.0 t -153.54 101.82 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.824 ' O ' HD12 ' A' ' 24' ' ' ILE . 46.8 m-80 -66.25 52.37 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.141 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.083 HG21 ' HE3' ' B' ' 132' ' ' MET . 1.9 pp 35.61 -2.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 120.068 3.359 . . . . 0.0 120.068 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.504 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -38.05 -57.66 1.03 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 118.917 0.78 . . . . 0.0 110.204 -179.537 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.61 -29.55 43.25 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.868 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.754 HD12 ' CG2' ' A' ' 24' ' ' ILE . 1.1 tm? -60.83 -56.13 24.82 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.943 HG12 ' SD ' ' A' ' 32' ' ' MET . 90.7 t -45.52 -67.95 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 109.987 178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.628 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.1 p -50.57 -42.24 55.28 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.577 0.751 . . . . 0.0 112.71 178.059 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.2 m -66.46 -57.44 7.36 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.456 ' HA ' HD22 ' A' ' 34' ' ' ASN . 0.8 OUTLIER -52.85 -41.64 64.46 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.038 178.887 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.943 ' SD ' HG12 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -48.68 -49.59 37.0 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.389 178.713 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.42 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -57.68 -45.49 85.55 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.361 179.556 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.456 HD22 ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -65.6 -51.79 57.02 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.185 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.881 ' HG3' HD21 ' B' ' 127' ' ' LEU . 1.4 mm-40 -64.5 -28.31 69.57 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.576 178.271 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.569 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.61 -45.57 61.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.002 0.43 . . . . 0.0 110.491 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -73.23 -56.54 4.94 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.088 0.471 . . . . 0.0 111.233 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.525 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.6 OUTLIER . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.388 0.137 . . . . 0.0 110.654 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.807 ' HB3' HG23 ' A' ' 9' ' ' VAL . 12.5 tp60 -114.62 116.98 29.61 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.324 0.583 . . . . 0.0 111.472 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.676 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.38 106.49 11.45 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.29 -0.868 . . . . 0.0 112.042 -179.124 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.883 HD13 ' CD1' ' A' ' 14' ' ' TYR . 2.8 pt -115.03 115.65 50.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.788 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -124.46 132.12 53.5 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.612 -177.521 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 1.055 HG13 HD11 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.37 99.28 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 174.676 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.975 HG22 ' HG3' ' A' ' 4' ' ' ARG . 71.8 p -69.15 71.92 0.27 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.773 HG21 ' HB3' ' B' ' 112' ' ' ASP . 14.4 p -101.81 -131.56 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.919 -176.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.754 ' H ' HG22 ' B' ' 109' ' ' VAL . 1.0 OUTLIER 155.38 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -178.335 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 8.3 t -80.43 -1.23 40.58 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.773 ' HB3' HG21 ' B' ' 109' ' ' VAL . 4.9 t0 -74.91 52.75 0.56 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 120.303 1.41 . . . . 0.0 109.534 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 32' ' ' MET . 2.8 m 65.17 -11.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.115 ' CZ ' HG21 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -53.53 -60.04 3.82 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 118.207 0.458 . . . . 0.0 110.326 179.719 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 85.8 mt-30 -49.56 -41.04 40.5 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.979 -177.663 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.508 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.93 -28.08 21.85 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.833 HD12 ' CG1' ' B' ' 122' ' ' VAL . 0.5 OUTLIER -77.52 -55.4 5.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.44 0.638 . . . . 0.0 110.885 178.751 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.702 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -64.01 -25.87 68.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.26 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.87 -27.8 45.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.379 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.584 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 13.0 m-30 -88.5 -42.53 12.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.078 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 18.7 t70 124.95 63.67 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 O-C-N 124.548 1.155 . . . . 0.0 110.469 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.833 ' CG1' HD12 ' B' ' 117' ' ' LEU . 3.7 p -159.7 -32.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.507 -178.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.472 ' H ' ' HA ' ' B' ' 118' ' ' LYS . 6.7 p30 54.64 -102.91 0.16 Allowed 'General case' 0 C--N 1.343 0.29 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.014 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.166 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -158.4 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 179.3 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.448 ' OG ' ' N ' ' B' ' 126' ' ' GLY . 8.8 p -39.61 -64.63 0.46 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.436 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.747 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.04 -32.78 16.56 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.724 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.881 HD21 ' HG3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -56.57 -62.92 1.4 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.852 0.326 . . . . 0.0 111.12 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.166 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -55.22 -69.16 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.748 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 1.1 t -51.38 -41.21 60.53 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.747 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -76.05 -50.08 15.75 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 118.754 0.706 . . . . 0.0 109.282 179.12 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.613 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 1.3 m -51.47 -35.96 42.23 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.083 ' HE3' HG21 ' A' ' 24' ' ' ILE . 2.4 mtt -55.4 -48.76 73.87 Favored 'General case' 0 C--O 1.201 -1.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.439 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -53.98 -36.44 62.92 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.216 0.916 . . . . 0.0 110.561 179.42 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 134' ' ' ASN . . . . . 0.471 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 1.3 m-20 -75.19 -48.49 23.27 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.704 ' CG ' HD21 ' A' ' 17' ' ' LEU . 2.7 tp10 -68.92 -21.94 64.19 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.834 177.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.64 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -76.71 -47.37 22.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.672 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -56.41 13.43 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.659 0.742 . . . . 0.0 109.549 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.444 -0.759 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.445 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt . . . . . 0 N--CA 1.47 0.527 0 CA-C-O 121.011 0.434 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.563 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -98.76 106.78 19.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.454 0.645 . . . . 0.0 110.397 179.516 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 1.014 ' HG2' HG22 ' B' ' 106' ' ' THR . 0.0 OUTLIER -79.48 103.91 9.72 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.187 -179.221 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.909 HG21 ' CE1' ' B' ' 114' ' ' TYR . 9.0 pt -100.05 128.88 51.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.846 ' CG2' HG23 ' B' ' 106' ' ' THR . 0.3 OUTLIER -132.52 124.37 28.36 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 117.992 -1.483 . . . . 0.0 113.997 -177.965 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.677 HG22 HG22 ' A' ' 9' ' ' VAL . 1.2 p -100.33 101.72 12.47 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 176.114 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.546 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 37.7 p -69.98 80.71 0.48 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.447 0.641 . . . . 0.0 110.471 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.963 HG11 ' HB3' ' A' ' 14' ' ' TYR . 4.0 t -72.93 -124.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.912 -178.472 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.712 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 0.4 OUTLIER 99.95 6.02 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.179 0.992 . . . . 0.0 109.88 -176.294 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.722 ' H ' HG12 ' A' ' 9' ' ' VAL . 38.7 t -167.44 -42.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.876 -1.056 . . . . 0.0 112.161 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.65 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 0.5 OUTLIER -62.24 47.92 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -177.274 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.565 ' O ' ' HB3' ' B' ' 132' ' ' MET . 1.0 OUTLIER 53.66 7.51 0.11 Allowed 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 177.181 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.972 ' CE1' HD11 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -66.59 -52.57 43.95 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.278 0.49 . . . . 0.0 111.141 179.181 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.77 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.54 -36.88 24.92 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.957 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.72 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -55.5 -56.47 19.82 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.477 0.58 . . . . 0.0 111.224 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.806 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.5 -54.09 15.62 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.288 0.566 . . . . 0.0 111.355 -178.985 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 7.5 pttt -71.9 -25.74 62.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.153 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -58.5 -20.12 42.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.469 178.067 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.648 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 23.5 m-85 -87.69 -53.58 4.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.65 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 O-C-N 124.303 1.002 . . . . 0.0 111.821 178.57 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.805 ' CG1' HD12 ' A' ' 17' ' ' LEU . 9.7 p -147.03 80.61 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.522 0.677 . . . . 0.0 112.439 -178.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 1.054 ' O ' HD12 ' A' ' 24' ' ' ILE . 48.8 m-80 -65.42 63.44 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.883 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.095 HD11 HD12 ' B' ' 105' ' ' ILE . 0.5 OUTLIER 39.53 -7.94 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 118.336 2.717 . . . . 0.0 118.336 179.176 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -37.71 -60.07 0.75 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 120.432 1.469 . . . . 0.0 110.318 -178.28 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.53 -28.27 40.05 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.143 -0.551 . . . . 0.0 112.279 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.737 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -65.09 -61.35 2.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 122.677 0.391 . . . . 0.0 111.202 179.961 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.846 HG22 ' CG2' ' B' ' 128' ' ' VAL . 15.4 t -47.89 -61.25 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.478 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.812 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 7.7 p -49.2 -44.8 43.46 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 124.814 1.246 . . . . 0.0 113.417 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 97.4 m -67.07 -51.09 58.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.679 HG22 HD21 ' B' ' 127' ' ' LEU . 1.2 m -60.37 -34.07 73.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.288 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.925 ' HE2' HG23 ' B' ' 124' ' ' ILE . 3.3 mmt -57.73 -57.28 13.45 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.933 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.432 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -57.98 -45.42 86.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.606 0.241 . . . . 0.0 110.866 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.432 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 2.4 t-20 -64.06 -55.49 21.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.615 179.208 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.914 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.7 tp10 -67.57 -22.1 65.4 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.745 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -72.1 -42.94 65.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.71 -56.63 5.0 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.783 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.479 ' HA ' ' HD3' ' A' ' 38' ' ' ARG . 22.3 mmt180 . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -176.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.712 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.465 0.302 0 CA-C-O 120.716 0.293 . . . . 0.0 111.389 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.543 ' O ' ' HA ' ' A' ' 8' ' ' THR . 3.7 tt0 -122.79 125.65 45.88 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.808 ' NH2' HG21 ' B' ' 106' ' ' THR . 4.3 ttt-85 -78.32 112.51 15.4 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.958 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 1.095 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -95.45 122.47 46.95 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.542 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 175.069 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 106' ' ' THR . . . . . 1.014 HG22 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -131.89 109.83 10.36 Favored 'General case' 0 C--N 1.299 -1.589 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.889 -177.03 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.817 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -102.92 107.71 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.364 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.822 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 6.1 p -70.97 98.19 1.57 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.464 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.758 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.94 -148.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.888 -178.449 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.598 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 15.6 t70 106.55 6.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 122.197 0.998 . . . . 0.0 108.591 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.68 -41.68 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.6 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.812 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -78.57 42.32 0.43 Allowed 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -176.875 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.497 ' O ' ' HB3' ' A' ' 32' ' ' MET . 41.0 m 67.97 -2.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 177.087 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.909 ' CE1' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -54.23 -51.02 65.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.878 0.763 . . . . 0.0 110.604 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.586 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 6.2 mm-40 -50.0 -43.99 50.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.94 -176.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.745 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -53.55 -27.9 28.65 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.764 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.925 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -77.58 -55.46 5.34 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.622 0.725 . . . . 0.0 110.906 178.184 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.6 OUTLIER -65.87 -25.44 67.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.832 179.848 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.82 -28.35 48.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.007 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.563 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 16.0 m-30 -88.57 -42.56 11.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.897 178.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 25.3 t70 121.29 62.4 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 124.58 1.175 . . . . 0.0 109.775 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 51.3 t -144.21 -48.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.975 -178.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 64.54 -113.95 0.34 Allowed 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -178.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 0.981 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -146.93 4.28 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 114.66 1.355 . . . . 0.0 114.66 179.245 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.427 ' C ' ' O ' ' B' ' 124' ' ' ILE . 27.6 t -40.58 -64.6 0.5 Allowed 'General case' 0 C--O 1.241 0.643 0 C-N-CA 120.139 -0.625 . . . . 0.0 109.905 -178.274 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.451 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.71 -25.41 35.36 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.787 177.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.766 HD11 ' HG2' ' A' ' 35' ' ' GLU . 4.3 tp -60.84 -61.41 2.61 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 179.367 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.981 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.1 t -52.48 -65.57 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.884 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.65 ' HB3' ' CB ' ' A' ' 12' ' ' ASP . 8.8 p -46.94 -44.23 19.75 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.451 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -75.24 -43.81 49.57 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 119.097 0.862 . . . . 0.0 109.392 178.605 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.602 ' OG1' HG21 ' A' ' 31' ' ' THR . 18.9 m -59.58 -39.9 85.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.479 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.806 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 6.4 mmt -61.05 -57.5 12.34 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.341 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -34.24 56.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 118.152 0.433 . . . . 0.0 111.745 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -79.23 -47.86 15.2 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.182 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.685 ' HB3' HD21 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -72.87 -22.2 60.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.988 0.423 . . . . 0.0 109.925 177.855 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.72 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -71.71 -45.2 62.56 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.6 mmt85 -67.5 -56.05 11.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.104 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 138' ' ' ARG . . . . . 0.435 ' HD2' ' C ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.751 0 CA-C-N 114.052 -1.431 . . . . 0.0 114.287 -177.099 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.6 ' HA ' ' CB ' ' B' ' 110' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.412 0 CA-C-O 121.193 0.52 . . . . 0.0 111.746 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.612 ' O ' ' HA ' ' B' ' 108' ' ' THR . 15.8 tt0 -129.6 113.12 14.42 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 121.491 0.662 . . . . 0.0 110.997 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.863 ' HG3' HG22 ' B' ' 108' ' ' THR . 4.3 ttm180 -78.77 109.8 13.35 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.598 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.909 HD12 HD11 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -102.54 109.82 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.059 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 176.153 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.858 ' CG2' ' HG2' ' B' ' 104' ' ' ARG . 1.5 m -117.25 118.55 32.59 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 120.264 -0.574 . . . . 0.0 111.463 -175.098 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.916 HG13 HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.75 106.22 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.24 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.83 79.91 0.62 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.209 0.528 . . . . 0.0 110.375 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.162 HG21 ' CD1' ' A' ' 14' ' ' TYR . 6.2 m -72.84 -158.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.37 -178.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.596 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 10.9 t70 93.55 -22.66 0.06 Allowed 'General case' 0 C--N 1.351 0.643 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -176.43 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.47 ' OG ' ' HE3' ' B' ' 102' ' ' LYS . 0.4 OUTLIER -116.37 -1.58 12.27 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.896 177.185 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.758 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -110.7 -95.58 0.42 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.774 177.596 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.78 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.3 OUTLIER -173.85 30.34 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 118.481 0.582 . . . . 0.0 111.96 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.162 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -70.34 -39.11 74.89 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.533 0.733 . . . . 0.0 112.243 179.091 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.571 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.8 OUTLIER -49.79 -47.94 50.9 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -176.442 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.73 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -49.53 -28.96 6.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -179.468 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.845 HD12 HG23 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -78.26 -60.16 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.391 0.615 . . . . 0.0 111.057 178.101 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -62.67 -25.5 68.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.648 179.496 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.4 -27.11 34.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.647 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.679 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 14.8 m-30 -88.58 -52.32 5.22 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.862 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.679 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 16.6 p-10 147.02 40.86 0.0 OUTLIER 'General case' 0 C--N 1.357 0.924 0 O-C-N 124.638 1.211 . . . . 0.0 111.395 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.799 HG11 HD22 ' A' ' 17' ' ' LEU . 14.4 p -138.08 89.33 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.162 0.506 . . . . 0.0 112.317 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.975 ' O ' HD12 ' A' ' 24' ' ' ILE . 5.4 m-20 -76.78 50.89 0.73 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.161 0.505 . . . . 0.0 110.636 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.993 ' HB ' HG23 ' A' ' 28' ' ' VAL . 1.4 pp 33.76 5.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.888 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.4 p -37.49 -63.55 0.44 Allowed 'General case' 0 C--O 1.247 0.961 0 CA-C-N 119.092 0.86 . . . . 0.0 110.743 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.445 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -76.44 -25.64 65.21 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.003 177.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.827 HD12 ' CG2' ' A' ' 24' ' ' ILE . 3.2 tm? -65.84 -60.21 3.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.51 -0.281 . . . . 0.0 110.791 179.369 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.993 HG23 ' HB ' ' A' ' 24' ' ' ILE . 61.8 t -42.14 -71.6 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 CA-C-N 117.586 0.175 . . . . 0.0 110.642 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.673 ' O ' ' HB2' ' B' ' 113' ' ' SER . 88.2 p -49.57 -34.17 16.95 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.1 m -75.2 -52.14 11.65 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 121.043 -1.036 . . . . 0.0 110.308 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.624 ' CG2' HD11 ' B' ' 127' ' ' LEU . 0.8 OUTLIER -56.8 -28.45 61.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.403 -179.763 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.912 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -54.2 -54.44 39.88 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.698 178.824 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.461 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.55 -33.14 65.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 111.633 -179.416 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.461 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.8 t-20 -76.33 -47.68 22.7 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.733 ' HB3' HD21 ' B' ' 117' ' ' LEU . 5.1 tp10 -67.41 -31.47 71.7 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.327 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.745 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -72.41 -39.47 67.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.74 179.458 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -70.14 -56.2 7.45 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.57 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 . . . . . 0 N--CA 1.446 -0.652 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.823 -177.477 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.596 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 5.7 mmtm . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.581 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -100.72 111.76 24.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.823 0.821 . . . . 0.0 112.627 -178.567 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.858 ' HG2' ' CG2' ' A' ' 6' ' ' THR . 0.1 OUTLIER -79.59 101.31 8.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.7 -178.602 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.916 HG12 HG13 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -107.3 128.52 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 176.101 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.681 HG22 HG23 ' A' ' 6' ' ' THR . 0.5 OUTLIER -132.09 129.12 39.54 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.659 -178.494 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.888 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.23 88.08 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 175.639 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.863 HG22 ' HG3' ' A' ' 4' ' ' ARG . 57.9 p -70.82 67.27 0.38 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.467 0.651 . . . . 0.0 109.691 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.137 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -63.77 -101.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 114.716 -1.129 . . . . 0.0 112.341 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.632 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.2 t70 75.75 -1.89 2.89 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 -173.163 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.447 ' H ' ' C ' ' B' ' 109' ' ' VAL . 54.9 p -94.26 -73.8 0.56 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.034 -1.439 . . . . 0.0 109.758 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' B' ' 114' ' ' TYR . 1.1 p-10 -144.83 156.1 43.84 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -175.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.673 ' HB2' ' O ' ' A' ' 29' ' ' SER . 1.0 OUTLIER 48.19 -27.3 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 175.539 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.137 ' CB ' HG21 ' B' ' 109' ' ' VAL . 1.7 t80 -54.6 -60.04 3.89 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.321 0.964 . . . . 0.0 109.393 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.655 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 48.0 mt-30 -49.75 -42.22 45.79 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.669 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.745 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -50.71 -55.7 15.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.468 0.651 . . . . 0.0 109.375 178.169 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.733 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -46.72 -53.89 10.82 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.318 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.655 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -74.5 -25.47 59.38 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.085 179.666 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.501 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.82 -29.83 60.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.647 178.566 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.673 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 15.0 m-30 -87.94 -40.63 13.77 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.673 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 4.5 p-10 132.92 17.33 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 O-C-N 124.988 1.43 . . . . 0.0 111.751 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.558 ' HB ' ' CD1' ' B' ' 117' ' ' LEU . 26.1 t -105.34 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.177 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.87 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -67.43 45.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.092 0.472 . . . . 0.0 111.199 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.014 HG22 HD12 ' B' ' 127' ' ' LEU . 1.8 pp 32.74 6.56 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 119.457 3.132 . . . . 0.0 119.457 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.517 ' N ' ' O ' ' B' ' 123' ' ' ASN . 3.7 p -37.93 -62.93 0.51 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 117.973 0.351 . . . . 0.0 111.347 -178.6 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.452 ' N ' ' OG ' ' B' ' 125' ' ' SER . . . -82.85 -24.36 53.15 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.058 178.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 1.014 HD12 HG22 ' B' ' 124' ' ' ILE . 2.3 tm? -66.81 -61.51 1.92 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.807 HG23 ' HB ' ' B' ' 124' ' ' ILE . 2.6 t -52.43 -60.64 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-O 121.007 0.432 . . . . 0.0 109.889 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.758 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 63.3 p -54.82 -33.25 61.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.075 -0.966 . . . . 0.0 113.397 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 3.4 m -79.57 -54.22 6.11 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 121.728 -0.607 . . . . 0.0 111.073 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.04 -36.64 40.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.915 -178.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.83 ' HE3' HG21 ' A' ' 24' ' ' ILE . 3.9 mtt -56.77 -53.23 60.18 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.36 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.78 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -56.26 -40.48 74.27 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.742 -179.777 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 134' ' ' ASN . . . . . 0.55 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 73.9 m-80 -67.98 -55.08 14.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.299 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -34.58 77.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.925 0.393 . . . . 0.0 110.248 178.369 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.73 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -66.38 -45.69 79.21 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.057 178.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -52.17 65.27 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.814 0.816 . . . . 0.0 109.378 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.444 -0.737 0 CA-C-N 114.003 -1.453 . . . . 0.0 112.145 -178.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.54 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.831 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.61 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 33.6 tp60 -112.59 110.34 20.45 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.276 178.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 1.145 ' HG2' HG22 ' B' ' 106' ' ' THR . 5.4 ttm105 -80.0 117.03 20.47 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-O 121.641 0.734 . . . . 0.0 112.662 -178.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.82 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.96 131.95 55.59 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 177.036 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.918 ' CB ' HG23 ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.48 121.93 32.08 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.557 -177.422 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.689 ' CG1' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -102.72 96.94 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 174.835 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.617 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 69.7 p -70.92 87.35 0.72 Allowed 'General case' 0 C--N 1.317 -0.84 0 O-C-N 121.102 -0.999 . . . . 0.0 109.921 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.041 HG23 ' HB3' ' A' ' 14' ' ' TYR . 14.0 m -144.86 55.47 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 117.217 2.302 . . . . 0.0 117.217 -177.396 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.818 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 0.8 OUTLIER -73.98 54.33 0.51 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 123.761 1.743 . . . . 0.0 108.277 173.906 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.44 ' H ' ' C ' ' A' ' 9' ' ' VAL . 28.6 t -164.65 -47.78 0.03 OUTLIER 'General case' 0 C--N 1.27 -2.85 0 CA-C-N 111.463 -2.608 . . . . 0.0 110.905 -178.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.628 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 20.4 m-20 -73.4 47.25 0.22 Allowed 'General case' 0 C--N 1.348 0.502 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.717 -178.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.549 ' O ' ' HB3' ' B' ' 132' ' ' MET . 51.0 m 69.5 -3.07 1.71 Allowed 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.041 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -61.64 -45.23 94.96 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.556 0.693 . . . . 0.0 110.213 179.26 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.752 ' HG3' ' HA ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -48.17 -44.68 32.75 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.092 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.603 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.1 OUTLIER -60.36 -49.01 79.3 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -178.63 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.953 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.1 -44.78 52.22 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.393 0.616 . . . . 0.0 111.372 -179.66 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.751 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 21.2 pttt -79.63 -33.85 41.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.32 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.503 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -62.07 -28.99 70.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.362 178.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.603 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -88.15 -45.29 10.24 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 117.772 -1.109 . . . . 0.0 110.864 179.218 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.603 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 152.35 31.46 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.453 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.533 HG23 ' HE1' ' A' ' 20' ' ' TYR . 27.1 t -145.52 -33.67 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.502 -0.879 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.603 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 9.9 p30 53.89 -104.42 0.21 Allowed 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -176.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.053 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -153.66 -0.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 178.456 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 24' ' ' ILE . 51.8 p -39.01 -64.31 0.46 Allowed 'General case' 0 C--O 1.241 0.648 0 CA-C-N 119.265 0.938 . . . . 0.0 109.505 -178.527 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.45 -28.64 24.13 Favored Glycine 0 CA--C 1.522 0.475 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.208 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.746 HD13 HD11 ' A' ' 17' ' ' LEU . 2.9 tp -56.45 -58.29 8.67 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.815 0.308 . . . . 0.0 110.357 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.053 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.6 t -53.99 -62.6 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.7 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 59.9 p -49.43 -45.16 46.11 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.72 -46.07 26.89 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.861 0.362 . . . . 0.0 110.221 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.635 ' CG2' HD21 ' B' ' 127' ' ' LEU . 36.3 m -61.2 -38.52 86.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.399 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' MET . . . . . 1.021 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -51.3 -43.34 61.63 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.135 179.258 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.507 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -63.49 -46.2 87.21 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.558 0.218 . . . . 0.0 110.731 179.02 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.507 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.27 -48.17 79.29 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.746 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.581 ' HG3' ' HG ' ' B' ' 127' ' ' LEU . 2.5 mm-40 -66.26 -36.14 82.24 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.501 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -59.38 -42.78 92.45 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.719 -0.613 . . . . 0.0 109.466 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -78.36 -56.46 4.43 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.922 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -176.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.552 ' O ' ' HG2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 121.173 0.511 . . . . 0.0 111.927 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.818 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 1.4 tp60 -97.0 121.59 39.05 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.864 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.597 ' HG3' ' OG1' ' A' ' 6' ' ' THR . 2.7 ttm105 -77.8 105.99 9.34 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.734 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.727 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -99.8 108.69 23.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.022 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 178.447 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 106' ' ' THR . . . . . 1.145 HG22 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -119.35 112.74 19.81 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.416 -173.965 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.512 HG22 ' CG1' ' B' ' 109' ' ' VAL . 1.2 p -100.59 112.13 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.45 177.11 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.784 HG23 ' HG3' ' A' ' 4' ' ' ARG . 3.3 p -70.93 87.51 0.73 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.994 HG21 ' CD2' ' B' ' 114' ' ' TYR . 13.2 m -89.37 -143.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.653 ' N ' HG23 ' B' ' 109' ' ' VAL . 6.4 t70 87.95 -7.49 0.56 Allowed 'General case' 0 C--N 1.351 0.633 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -176.327 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.34 -65.52 1.1 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.244 -1.344 . . . . 0.0 107.839 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.7 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -43.53 -86.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.172 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 2.2 m 175.97 41.31 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 118.428 0.558 . . . . 0.0 111.454 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.994 ' CD2' HG21 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -83.6 -45.46 13.47 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.631 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -48.58 -40.68 28.19 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.048 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.501 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -53.81 -56.28 18.97 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.115 0.87 . . . . 0.0 111.705 179.387 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.832 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -55.67 -45.74 77.68 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.925 -178.534 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.631 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -73.41 -26.85 61.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.948 179.037 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.404 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -70.21 -14.36 62.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.34 177.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.683 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.8 m-85 -87.72 -44.54 11.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.683 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.2 m-20 128.1 9.17 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 O-C-N 125.166 1.541 . . . . 0.0 111.278 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.777 ' HB ' HD13 ' B' ' 117' ' ' LEU . 98.3 t -101.91 -36.29 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.171 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.701 ' O ' HD12 ' B' ' 117' ' ' LEU . 1.3 m-20 54.31 -119.86 1.54 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.021 HG23 ' HE2' ' A' ' 32' ' ' MET . 0.3 OUTLIER -137.52 0.56 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 179.399 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.43 ' C ' ' O ' ' B' ' 124' ' ' ILE . 10.8 p -43.0 -64.63 0.59 Allowed 'General case' 0 C--O 1.243 0.734 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.414 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -83.31 -29.19 34.14 Favored Glycine 0 C--N 1.334 0.444 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.893 178.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.73 HD12 ' HG ' ' B' ' 117' ' ' LEU . 4.8 tt -59.57 -61.99 2.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 117.418 0.609 . . . . 0.0 110.944 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.944 HG22 HG21 ' A' ' 24' ' ' ILE . 3.2 t -50.97 -66.44 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 C-N-CA 120.526 -0.47 . . . . 0.0 109.902 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.628 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 22.0 p -48.34 -47.32 37.12 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.429 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.9 OUTLIER -71.3 -46.39 60.87 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 118.799 0.727 . . . . 0.0 110.457 -179.502 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.591 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.8 OUTLIER -66.37 -34.91 79.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.654 -179.82 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.953 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -60.77 -57.05 14.33 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.287 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.494 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -52.75 -42.0 64.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.651 0.262 . . . . 0.0 111.656 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 134' ' ' ASN . . . . . 0.513 ' O ' ' HD3' ' B' ' 138' ' ' ARG . 1.7 m-20 -62.29 -55.31 29.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.679 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.63 ' HB3' HD21 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -74.64 -8.96 58.01 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.634 178.473 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.603 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -82.32 -42.55 18.62 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -74.56 -51.99 13.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.398 177.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 138' ' ' ARG . . . . . 0.528 ' N ' ' HD2' ' B' ' 138' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.443 -0.804 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.568 -178.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.676 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.32 0 CA-C-O 120.872 0.368 . . . . 0.0 110.473 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.478 ' O ' HG22 ' B' ' 109' ' ' VAL . 33.1 tp60 -120.35 111.52 17.86 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.283 0.564 . . . . 0.0 111.294 -179.308 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.976 ' HG2' HG22 ' B' ' 106' ' ' THR . 0.0 OUTLIER -79.4 112.61 16.81 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.049 -179.557 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.787 HG12 HG13 ' B' ' 107' ' ' VAL . 0.6 OUTLIER -114.0 129.3 70.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.486 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.81 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.0 OUTLIER -133.01 135.59 45.54 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 117.886 -1.526 . . . . 0.0 113.768 -179.029 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.777 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.75 95.61 4.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.351 177.052 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 14.5 p -70.62 69.24 0.41 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.801 HG11 ' HB2' ' A' ' 14' ' ' TYR . 10.3 p -92.28 -133.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.835 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.782 ' H ' HG22 ' A' ' 9' ' ' VAL . 25.6 t70 97.81 13.34 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.309 1.052 . . . . 0.0 109.348 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.405 ' H ' HG22 ' A' ' 9' ' ' VAL . 28.0 t -145.25 -51.75 0.26 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 113.875 -1.511 . . . . 0.0 111.473 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.798 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.2 m-20 -72.82 41.41 0.1 Allowed 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 115.003 1.482 . . . . 0.0 115.003 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.497 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.2 OUTLIER 80.89 4.95 1.54 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 176.464 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.877 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 3.5 t80 -58.16 -59.58 5.07 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.545 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 11.7 mt-30 -49.73 -40.05 39.37 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.042 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.874 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -48.65 -33.33 9.76 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.426 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.082 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.7 OUTLIER -78.25 -57.24 3.88 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.187 -0.605 . . . . 0.0 111.921 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.546 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -63.29 -25.18 68.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.718 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.415 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.94 -30.63 61.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.987 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.614 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 11.3 m-30 -88.34 -38.64 14.98 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.614 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 37.6 t70 133.19 43.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 O-C-N 124.336 1.022 . . . . 0.0 109.578 178.666 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.795 ' CG1' HD22 ' A' ' 17' ' ' LEU . 6.1 p -160.89 78.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.932 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.703 -177.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.636 ' O ' ' HE3' ' B' ' 132' ' ' MET . 0.0 OUTLIER -64.1 -86.9 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.487 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.153 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -166.9 9.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 115.791 1.775 . . . . 0.0 115.791 178.966 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.442 ' C ' ' O ' ' A' ' 24' ' ' ILE . 29.0 t -38.36 -65.2 0.36 Allowed 'General case' 0 C--O 1.242 0.704 0 C-N-CA 120.211 -0.596 . . . . 0.0 110.551 -177.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.562 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -90.25 -24.91 27.8 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.584 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.824 HD11 ' HG2' ' B' ' 135' ' ' GLU . 0.7 OUTLIER -60.6 -56.94 15.26 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.105 -0.056 . . . . 0.0 111.008 179.317 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.153 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.0 t -57.21 -61.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.737 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 57.5 p -50.63 -41.92 55.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.562 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -75.21 -50.19 16.99 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.685 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.462 ' N ' ' CG2' ' A' ' 30' ' ' THR . 17.2 m -53.15 -43.76 67.25 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.947 ' HE3' HG12 ' B' ' 124' ' ' ILE . 11.7 mtt -52.59 -52.7 54.0 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.499 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -55.53 -37.38 67.86 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.828 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -48.46 40.23 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -68.41 -27.35 66.13 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.259 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.565 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -83.1 -46.27 12.98 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.746 0.818 . . . . 0.0 110.73 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -51.98 -51.64 55.84 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 121.819 0.819 . . . . 0.0 109.482 178.423 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.187 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.14 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 111.051 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.673 ' HB2' ' HB2' ' A' ' 10' ' ' ASP . 3.8 tm0? -95.62 123.2 39.06 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.541 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.441 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 14.3 ttm-85 -77.14 101.81 6.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.713 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 1.031 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -93.34 107.64 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.392 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 177.354 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.976 HG22 ' HG2' ' A' ' 4' ' ' ARG . 1.2 m -118.18 110.91 18.16 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.317 0.579 . . . . 0.0 112.328 -175.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.787 HG13 HG12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -102.13 106.3 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.987 177.138 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.848 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 4.7 p -70.92 88.36 0.75 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.844 0.354 . . . . 0.0 110.1 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 1.121 HG21 ' CD2' ' B' ' 114' ' ' TYR . 10.9 m -80.34 -142.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.488 -178.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.681 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 0.4 OUTLIER 86.28 -15.75 0.46 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -176.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.4 m -112.23 -68.93 0.9 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.944 -1.026 . . . . 0.0 108.691 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.737 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 2.2 m-20 -43.71 -93.24 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -178.158 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 29' ' ' SER . 1.8 t -177.98 47.71 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 121.567 0.699 . . . . 0.0 111.257 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 1.121 ' CD2' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.79 -45.51 14.24 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.082 -179.493 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.543 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.1 OUTLIER -48.59 -42.48 34.02 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.568 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.565 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -51.81 -47.37 64.33 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 119.305 0.957 . . . . 0.0 112.073 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.821 HD11 HD12 ' B' ' 127' ' ' LEU . 0.2 OUTLIER -59.72 -51.8 68.22 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.313 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.595 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -74.13 -28.6 61.41 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.618 179.773 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -60.31 -28.2 67.93 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.33 178.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.579 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.44 -44.64 10.58 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.235 -0.888 . . . . 0.0 109.602 178.18 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.58 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 176.631 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.635 ' O ' HD12 ' B' ' 117' ' ' LEU . 38.8 t -146.64 94.71 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 1.067 ' O ' HD12 ' B' ' 124' ' ' ILE . 28.9 m-20 -71.43 57.12 0.25 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.86 178.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.067 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER 43.06 0.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 -179.483 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.777 ' HA ' HG22 ' A' ' 7' ' ' VAL . 14.9 p -38.66 -64.52 0.43 Allowed 'General case' 0 C--O 1.246 0.902 0 CA-C-N 119.144 0.884 . . . . 0.0 110.516 -178.163 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.676 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.9 -15.12 68.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.229 177.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.935 ' HB3' HG22 ' B' ' 124' ' ' ILE . 4.8 tt -72.63 -62.04 1.59 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 117.318 0.559 . . . . 0.0 110.348 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.116 HG22 ' CG2' ' A' ' 28' ' ' VAL . 75.1 t -44.78 -63.86 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.379 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.798 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 53.6 p -53.09 -51.45 61.82 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.676 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -67.55 -47.06 70.93 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 118.746 0.703 . . . . 0.0 110.103 -178.88 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.547 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.9 OUTLIER -53.22 -37.61 62.2 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.812 179.597 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.082 ' SD ' HD12 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -49.83 -49.17 50.0 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.774 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -43.66 98.35 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -67.06 -51.51 53.73 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.824 ' HG2' HD11 ' A' ' 27' ' ' LEU . 4.7 tp10 -58.73 -36.18 73.9 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.888 178.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.874 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -71.25 -42.42 68.86 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 121.026 0.441 . . . . 0.0 110.077 178.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -61.42 -52.6 63.89 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.617 0.723 . . . . 0.0 110.139 178.244 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.439 -1.017 0 CA-C-N 114.228 -1.351 . . . . 0.0 113.865 -176.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.457 ' O ' ' N ' ' B' ' 109' ' ' VAL . 10.1 tp60 -105.63 111.57 24.32 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.465 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.829 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 1.3 ttm105 -79.3 105.93 10.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.954 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -112.59 122.32 66.56 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.909 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.767 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -125.41 129.67 50.34 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.921 -177.098 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -100.36 107.07 20.32 Favored 'Isoleucine or valine' 0 C--N 1.343 0.295 0 N-CA-C 106.973 -1.492 . . . . 0.0 106.973 176.957 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 16.6 p -70.57 95.64 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.189 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.01 HG21 ' CB ' ' A' ' 14' ' ' TYR . 1.5 t -89.51 -143.55 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.21 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 33.7 t70 95.94 -10.14 0.09 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.5 t -126.0 -58.78 1.37 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 114.77 -1.105 . . . . 0.0 109.378 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.67 ' HB2' HG13 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -47.6 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.51 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 m -177.54 38.48 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.248 -0.908 . . . . 0.0 110.933 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.01 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -80.56 -39.17 28.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.346 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.575 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.78 -43.25 48.21 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.364 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.713 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -48.33 -32.24 7.17 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.891 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -78.16 -60.09 2.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.092 179.028 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -61.79 -25.79 67.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.982 178.707 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.81 -30.85 71.79 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.75 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.662 ' CZ ' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.6 -35.47 16.84 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.772 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.659 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 27.7 t70 142.99 31.2 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 123.724 0.64 . . . . 0.0 112.211 176.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.598 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.0 t -160.95 100.85 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.039 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.412 ' OD1' ' HB3' ' A' ' 18' ' ' LYS . 70.1 m-20 -55.78 -89.75 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 178.07 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.014 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -157.01 6.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.888 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.7 t -38.92 -64.44 0.45 Allowed 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.201 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.35 -23.36 51.5 Favored Glycine 0 C--N 1.335 0.496 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.02 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 1.014 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -65.65 -57.9 7.01 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 122.621 0.369 . . . . 0.0 111.2 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.955 HG23 ' HB ' ' A' ' 24' ' ' ILE . 3.8 t -51.55 -63.29 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.547 0.689 . . . . 0.0 109.21 178.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.754 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -50.16 -46.91 54.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.836 -1.075 . . . . 0.0 113.382 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.6 m -69.61 -50.27 46.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 121.311 0.577 . . . . 0.0 109.502 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.609 ' OG1' HG21 ' B' ' 131' ' ' THR . 1.8 m -55.16 -39.27 69.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.408 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.95 ' HE1' HG12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -60.58 -57.28 13.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.429 179.006 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -40.43 66.0 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.25 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.69 -48.91 52.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.34 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.85 ' CB ' HD21 ' B' ' 117' ' ' LEU . 3.5 mm-40 -68.67 -24.92 64.57 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.27 178.074 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.594 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.26 -47.23 58.33 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -65.56 -54.79 22.97 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.49 0.662 . . . . 0.0 109.929 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.526 0 CA-C-N 114.438 -1.256 . . . . 0.0 110.928 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.409 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.602 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 1.3 tt0 -96.43 111.92 23.85 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.099 0.475 . . . . 0.0 111.747 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.46 ' HB2' HH11 ' B' ' 104' ' ' ARG . 0.1 OUTLIER -77.93 102.39 7.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.76 . . . . 0.0 112.198 -178.625 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.75 HD11 HG11 ' B' ' 128' ' ' VAL . 0.4 OUTLIER -104.92 117.44 50.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 177.114 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.767 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -120.81 123.25 42.14 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -175.364 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.985 HG12 HG22 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -100.26 103.32 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.111 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.829 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.6 p -71.65 91.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.994 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -93.33 -139.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 118.028 -0.987 . . . . 0.0 111.332 -178.143 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.629 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 28.4 t70 119.86 5.1 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.003 0.921 . . . . 0.0 109.49 -177.306 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -175.15 -26.87 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.754 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.2 OUTLIER -70.77 41.57 0.06 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -176.985 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.622 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.8 m 62.57 -0.32 0.55 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.994 ' CG ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -57.55 -52.04 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 179.856 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.559 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.98 -36.83 18.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.505 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.594 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.05 -56.49 21.32 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -179.661 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.85 HD21 ' CB ' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -48.26 -51.64 24.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.334 0.588 . . . . 0.0 111.603 -178.583 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.555 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.9 pttt -76.73 -26.68 54.88 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.891 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -63.55 -25.63 68.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.856 178.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.796 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -87.96 -42.38 12.51 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 118.524 -0.751 . . . . 0.0 109.8 178.698 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.541 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 158.41 37.04 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 177.264 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.706 HG13 ' O ' ' B' ' 122' ' ' VAL . 0.8 OUTLIER -163.21 92.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.109 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 1.015 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -70.71 61.89 0.25 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.176 0.512 . . . . 0.0 110.531 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.141 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.6 OUTLIER 39.37 -8.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 119.162 3.023 . . . . 0.0 119.162 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.522 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.61 -62.59 0.59 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.675 1.125 . . . . 0.0 110.944 -178.233 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.37 -30.15 25.62 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.44 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.57 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -60.87 -61.44 2.58 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 122.631 0.372 . . . . 0.0 111.447 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.141 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.2 t -55.18 -58.02 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-O 120.636 0.255 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.64 ' CB ' ' CB ' ' A' ' 12' ' ' ASP . 12.0 p -50.29 -41.56 50.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.187 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.8 m -74.38 -52.87 10.87 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.609 HG21 ' OG1' ' A' ' 31' ' ' THR . 0.6 OUTLIER -51.93 -44.18 63.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.174 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.0 ' HE2' HG23 ' A' ' 24' ' ' ILE . 25.9 mtt -49.29 -40.77 35.99 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.872 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -43.92 94.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.757 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -49.76 67.56 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.719 ' CG ' HD21 ' A' ' 17' ' ' LEU . 2.6 tp10 -60.71 -37.49 81.86 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.713 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -67.41 -49.94 61.62 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.904 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.65 -48.22 63.46 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 121.965 0.888 . . . . 0.0 109.187 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? . . . . . 0 CA--C 1.541 0.618 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.753 -179.291 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.342 0 CA-C-O 120.996 0.426 . . . . 0.0 111.207 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.641 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 2.0 tt0 -101.39 109.02 20.79 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 1.063 ' HG3' HG23 ' B' ' 108' ' ' THR . 4.2 ttm105 -78.5 103.84 8.71 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.748 HD11 HG11 ' A' ' 28' ' ' VAL . 1.7 pt -97.41 126.98 50.13 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.775 HG21 ' NH1' ' B' ' 104' ' ' ARG . 0.6 OUTLIER -131.73 123.95 28.76 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.08 -1.048 . . . . 0.0 113.561 -177.139 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.827 HG13 HG12 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -101.28 106.22 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 175.772 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 37.5 p -70.86 98.18 1.53 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.014 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.4 t -87.9 -137.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.78 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 24.6 t70 99.27 -9.82 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.901 0.881 . . . . 0.0 108.836 -176.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.2 m -136.98 -55.71 0.72 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.515 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.733 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.68 -92.33 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.462 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' B' ' 129' ' ' SER . 2.7 m 176.44 36.76 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 118.866 0.757 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.014 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.77 -43.99 14.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.174 -0.921 . . . . 0.0 113.162 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.573 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -49.1 -44.06 41.9 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.824 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.5 OUTLIER -54.04 -56.26 19.64 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.501 0.591 . . . . 0.0 112.265 179.821 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.692 HD13 ' CE2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -46.17 -51.22 14.55 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.567 0.699 . . . . 0.0 111.302 -178.207 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.573 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 17.6 pttt -79.05 -29.27 43.42 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.483 ' HB3' ' HA ' ' A' ' 16' ' ' LEU . . . -61.45 -23.52 65.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.491 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.692 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -87.97 -44.4 11.04 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 118.255 -0.879 . . . . 0.0 109.746 178.302 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.658 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 163.13 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 177.944 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.557 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -169.59 106.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -178.816 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.955 ' O ' HD12 ' A' ' 24' ' ' ILE . 9.2 m-20 -66.68 55.85 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.672 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.97 HG21 ' HE3' ' B' ' 132' ' ' MET . 1.6 pp 36.24 1.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.464 ' N ' ' O ' ' A' ' 23' ' ' ASN . 7.0 p -37.74 -63.59 0.45 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.913 0.779 . . . . 0.0 112.372 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.446 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -75.34 -20.3 78.93 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.259 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.762 HD12 ' CG2' ' A' ' 24' ' ' ILE . 2.2 tm? -72.93 -58.55 3.24 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 122.597 0.359 . . . . 0.0 110.934 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.969 HG12 ' SD ' ' A' ' 32' ' ' MET . 59.7 t -45.43 -69.99 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.728 0.299 . . . . 0.0 110.973 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.554 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 45.6 p -49.43 -34.11 15.73 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.026 0.53 . . . . 0.0 112.099 178.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.5 m -69.74 -53.93 16.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 m -52.0 -43.39 63.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.182 178.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.969 ' SD ' HG12 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -55.75 -48.59 74.99 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.906 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.525 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -60.06 -42.78 95.28 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.355 0.525 . . . . 0.0 110.608 179.638 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 83.0 m-20 -67.33 -49.58 63.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.749 ' HB3' HD21 ' B' ' 117' ' ' LEU . 17.3 tp10 -65.04 -29.15 70.03 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.341 177.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.708 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -68.16 -45.48 73.41 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -54.27 36.27 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.248 177.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.54 0.581 0 CA-C-N 114.503 -1.226 . . . . 0.0 113.284 -177.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.78 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 120.69 0.281 . . . . 0.0 111.09 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.672 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 1.1 tt0 -109.84 116.73 32.19 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.072 0.463 . . . . 0.0 111.671 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.775 ' NH1' HG21 ' A' ' 6' ' ' THR . 2.6 ttp85 -78.08 106.5 10.0 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.827 HG12 HG13 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -103.88 130.08 55.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.81 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.736 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -131.06 126.12 35.0 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.795 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.882 HG22 HG22 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -101.86 102.94 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.319 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 108' ' ' THR . . . . . 1.063 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -70.76 67.24 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 122.131 -0.356 . . . . 0.0 111.398 -179.472 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.882 HG22 HG22 ' B' ' 107' ' ' VAL . 3.7 m -99.31 -124.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.536 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.661 ' HB2' ' O ' ' B' ' 109' ' ' VAL . 10.4 t0 157.02 -83.13 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.543 ' HA ' ' CD ' ' B' ' 115' ' ' GLN . 3.8 t -102.63 12.56 36.18 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.638 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 29' ' ' SER . 1.8 t0 -75.56 59.28 1.11 Allowed 'General case' 0 C--N 1.36 1.059 0 CA-C-N 120.191 1.359 . . . . 0.0 108.304 178.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 29' ' ' SER . 13.3 m 64.11 -20.55 0.07 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.177 -177.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.787 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -46.61 -60.33 2.45 Favored 'General case' 0 C--N 1.351 0.674 0 CA-C-O 121.383 0.611 . . . . 0.0 110.326 179.305 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.654 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.8 pt20 -49.53 -40.39 37.77 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.766 -1.107 . . . . 0.0 112.643 -177.507 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.708 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -55.55 -42.09 74.16 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.751 HD11 ' HG ' ' B' ' 127' ' ' LEU . 0.5 OUTLIER -59.03 -52.4 65.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.633 179.753 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.704 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.5 pttt -73.38 -30.45 63.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.209 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.478 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.48 -29.21 67.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.198 178.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.703 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -87.7 -41.64 13.21 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.475 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.519 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 155.1 24.01 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 176.786 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 121' ' ' ASP . 71.0 t -162.38 101.58 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.629 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 33.4 m-80 -53.14 -84.62 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.11 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -161.89 3.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 178.308 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.416 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -38.54 -63.5 0.5 Allowed 'General case' 0 C--O 1.241 0.658 0 CA-C-N 118.249 0.477 . . . . 0.0 110.691 -177.943 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -88.14 -29.91 18.61 Favored Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.234 178.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.751 ' HG ' HD11 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -58.6 -60.4 3.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.854 0.462 . . . . 0.0 111.127 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.11 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.3 t -55.16 -61.54 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.963 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.733 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.6 p -50.71 -42.17 56.8 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 178.127 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 16.5 m -67.82 -55.17 14.0 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.698 HG22 ' O ' ' B' ' 128' ' ' VAL . 1.8 t -53.55 -42.63 67.68 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.242 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.97 ' HE3' HG21 ' A' ' 24' ' ' ILE . 4.3 mtt -58.18 -54.93 41.38 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.587 178.394 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.17 -37.46 22.48 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.944 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -52.62 13.15 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.407 ' CB ' HD21 ' A' ' 17' ' ' LEU . 3.0 mp0 -69.45 -15.3 63.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.928 0.394 . . . . 0.0 110.343 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.625 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.96 -50.18 9.43 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.263 0.625 . . . . 0.0 109.512 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -54.33 29.59 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.718 0.77 . . . . 0.0 109.595 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 . . . . . 0 N--CA 1.441 -0.905 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.916 -178.99 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.685 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 46.1 tt0 -116.22 118.76 33.68 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.301 0.572 . . . . 0.0 110.601 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.945 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.18 105.9 10.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.206 -178.503 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.821 HD12 HD11 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -104.06 109.86 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.093 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.126 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -115.14 121.91 44.46 Favored 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.146 -176.587 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.872 HG13 HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.23 106.45 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 176.723 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.558 ' HB ' ' HB3' ' B' ' 102' ' ' LYS . 18.1 p -70.06 81.01 0.49 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.022 0.439 . . . . 0.0 110.601 -178.42 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 1.162 HG21 ' CD1' ' A' ' 14' ' ' TYR . 14.8 m -73.69 -141.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.627 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.644 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 27.4 t70 88.88 -12.45 0.41 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -124.53 -58.93 1.49 Allowed 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.664 ' HB2' ' OG ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.96 -98.59 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.546 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.5 OUTLIER -176.12 41.32 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.212 -0.93 . . . . 0.0 111.82 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 1.162 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -81.97 -41.49 20.71 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.94 0.896 . . . . 0.0 113.169 -179.474 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.536 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 1.8 mp0 -49.47 -46.59 48.25 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.391 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.522 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -50.02 -30.77 11.36 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.419 0.554 . . . . 0.0 111.917 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.045 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -78.14 -55.14 5.51 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.54 178.614 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.673 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -69.06 -25.54 64.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.335 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.54 -33.17 59.59 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.064 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.629 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 20.0 m-85 -88.87 -45.99 9.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.905 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.629 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 143.1 46.37 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 O-C-N 124.413 1.071 . . . . 0.0 110.824 178.85 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.596 ' HB ' HD22 ' A' ' 17' ' ' LEU . 7.5 t -128.24 73.45 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.333 -178.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.963 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -76.14 45.35 0.36 Allowed 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.983 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 39.91 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 118.316 2.71 . . . . 0.0 118.316 177.998 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . 1.039 ' HA ' HG22 ' B' ' 107' ' ' VAL . 3.1 p -39.35 -64.9 0.43 Allowed 'General case' 0 C--O 1.253 1.256 0 CA-C-N 119.272 0.942 . . . . 0.0 110.667 -177.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.416 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -80.53 -26.63 53.88 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.929 -0.653 . . . . 0.0 111.984 177.715 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.898 HD22 HD11 ' A' ' 17' ' ' LEU . 6.6 tp -66.2 -61.34 2.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.01 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.983 HG23 ' HB ' ' A' ' 24' ' ' ILE . 6.5 t -44.23 -66.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.486 ' HB3' ' O ' ' B' ' 112' ' ' ASP . 0.7 OUTLIER -50.03 -37.44 33.06 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 178.424 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.5 m -71.92 -58.5 3.4 Favored 'General case' 0 CA--C 1.507 -0.691 0 O-C-N 121.81 -0.556 . . . . 0.0 109.916 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.572 ' CG2' HD11 ' B' ' 127' ' ' LEU . 1.0 OUTLIER -54.47 -31.61 56.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.586 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.991 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.7 mmt -56.32 -57.26 13.02 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.083 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.581 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 2.6 tt0 -50.12 -34.16 21.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -72.33 -48.99 37.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.79 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.541 ' HB3' HD21 ' B' ' 117' ' ' LEU . 3.5 mm-40 -79.63 -15.25 57.97 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.754 0.312 . . . . 0.0 110.311 177.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.605 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -88.06 -29.96 20.27 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.159 0.584 . . . . 0.0 110.418 178.254 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -75.73 -55.41 5.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.582 0.706 . . . . 0.0 110.299 179.625 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 . . . . . 0 N--CA 1.442 -0.839 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.04 -178.527 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.558 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.566 ' HB3' HG23 ' A' ' 9' ' ' VAL . 28.8 tp60 -98.72 116.52 31.14 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.242 0.544 . . . . 0.0 111.048 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.447 ' HB2' HH11 ' B' ' 104' ' ' ARG . 0.0 OUTLIER -78.55 99.9 6.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.483 -178.399 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.872 HG12 HG13 ' A' ' 7' ' ' VAL . 0.4 OUTLIER -103.05 118.51 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.067 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.682 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -122.33 129.4 52.11 Favored 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.871 -176.916 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 1.039 HG22 ' HA ' ' A' ' 25' ' ' SER . 0.9 OUTLIER -99.04 96.06 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.868 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.945 HG22 ' HG3' ' A' ' 4' ' ' ARG . 46.6 p -70.01 67.65 0.29 Allowed 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.957 HG11 ' CB ' ' B' ' 114' ' ' TYR . 6.7 p -80.56 -117.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.264 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.685 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 35.6 t70 85.47 1.29 0.7 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -174.184 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.54 ' H ' HG22 ' B' ' 109' ' ' VAL . 0.4 OUTLIER -101.45 -67.02 0.88 Allowed 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.269 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -133.78 142.3 47.85 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -176.512 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.64 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 46.48 -23.79 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 118.824 2.898 . . . . 0.0 118.824 174.89 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.957 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.6 OUTLIER -52.13 -61.99 1.92 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 120.079 1.309 . . . . 0.0 111.6 -178.314 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.635 ' HA ' ' HE3' ' B' ' 118' ' ' LYS . 77.6 mt-30 -49.56 -37.62 28.02 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.113 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.49 -57.16 14.17 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.872 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.991 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -49.5 -45.67 47.37 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.187 0.518 . . . . 0.0 111.674 -178.176 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.685 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.4 pttp -80.26 -36.83 34.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.249 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.558 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -68.29 -23.88 64.8 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.914 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.745 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -87.76 -42.71 12.41 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.04 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.45 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 163.34 17.91 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.535 ' C ' ' H ' ' B' ' 124' ' ' ILE . 72.4 t -146.98 85.28 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.349 0 O-C-N 121.581 -0.699 . . . . 0.0 112.709 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.883 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.4 OUTLIER -69.11 50.21 0.08 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.557 0.694 . . . . 0.0 109.977 178.515 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.034 HG22 HD12 ' B' ' 127' ' ' LEU . 1.6 pp 33.28 0.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 120.103 3.372 . . . . 0.0 120.103 179.067 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.531 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.27 -62.47 0.58 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 118.525 0.602 . . . . 0.0 110.791 -178.944 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.403 ' N ' ' OG ' ' B' ' 125' ' ' SER . . . -80.66 -27.08 52.34 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.695 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 1.034 HD12 HG22 ' B' ' 124' ' ' ILE . 1.9 tm? -67.04 -61.49 1.91 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.929 0.365 . . . . 0.0 110.978 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.022 HG23 ' HB ' ' B' ' 124' ' ' ILE . 12.3 t -48.63 -68.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.249 0 C-N-CA 121.139 -0.224 . . . . 0.0 111.386 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.664 ' OG ' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -49.86 -31.27 11.65 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.0 m -71.65 -54.67 9.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.46 ' HA ' HD22 ' B' ' 134' ' ' ASN . 7.2 m -53.9 -36.47 62.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.183 178.298 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 132' ' ' MET . . . . . 1.045 ' SD ' HD12 ' A' ' 17' ' ' LEU . 5.3 mmm -53.15 -57.05 11.77 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.12 178.378 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.546 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -58.53 -36.01 73.2 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.109 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 134' ' ' ASN . . . . . 0.499 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.67 -48.42 22.12 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.087 -179.249 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.48 -19.25 60.45 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.692 177.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.522 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -72.37 -47.72 47.29 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 177.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.524 ' HA ' ' NE ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -65.84 -56.4 12.07 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-O 121.444 0.64 . . . . 0.0 109.912 178.22 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 . . . . . 0 N--CA 1.444 -0.766 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.32 -179.095 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.618 ' HE3' ' HA ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.584 0.706 . . . . 0.0 111.517 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.657 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 43.4 tp60 -117.69 109.15 16.28 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.373 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 1.062 ' HG3' HG23 ' B' ' 108' ' ' THR . 17.8 ttp-105 -79.31 111.58 15.69 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.819 179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.787 HD11 HG11 ' A' ' 28' ' ' VAL . 3.3 pt -102.34 127.8 55.61 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.771 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -131.71 124.73 30.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -177.791 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.622 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -99.43 105.56 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.206 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 14.5 p -70.19 89.72 0.65 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 178.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.852 HG11 ' CB ' ' A' ' 14' ' ' TYR . 3.8 p -108.36 -119.89 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.814 -177.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.681 ' N ' HG22 ' A' ' 9' ' ' VAL . 0.8 OUTLIER 77.41 10.25 2.41 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-O 122.491 1.138 . . . . 0.0 109.089 -174.747 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.443 ' OG ' ' NZ ' ' B' ' 102' ' ' LYS . 0.5 OUTLIER -128.46 -66.83 0.82 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.507 178.59 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.824 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 1.1 m-20 -51.74 -79.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -177.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.728 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 1.0 OUTLIER 177.28 40.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.39 0.995 . . . . 0.0 111.683 -178.513 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.852 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.67 -49.84 9.38 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.333 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.56 ' CD ' ' HA ' ' A' ' 10' ' ' ASP . 1.1 mp0 -49.33 -37.69 25.31 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.984 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.7 OUTLIER -56.61 -56.73 17.63 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.598 0.636 . . . . 0.0 111.687 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.786 ' HB2' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.48 -48.11 56.91 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.108 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.559 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 1.9 pttt -80.28 -35.59 35.65 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.475 -178.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.518 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -70.39 -22.64 62.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.256 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.532 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -87.83 -41.54 13.18 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.855 179.269 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.518 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 168.52 -7.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 177.382 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.685 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 72.2 t -122.08 85.95 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -177.291 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 1.028 ' O ' HD12 ' A' ' 24' ' ' ILE . 11.2 p30 -65.08 48.41 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.701 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.028 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 48.08 -15.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 117.203 2.298 . . . . 0.0 117.203 -179.546 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 23' ' ' ASN . 30.4 t -38.28 -62.84 0.54 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 119.137 0.88 . . . . 0.0 109.509 -178.315 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.483 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.28 -27.21 40.78 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.245 177.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.59 ' CD1' ' HG3' ' B' ' 132' ' ' MET . 0.1 OUTLIER -60.02 -62.24 2.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.972 0.386 . . . . 0.0 110.703 179.958 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.918 HG23 ' CG2' ' A' ' 24' ' ' ILE . 12.4 t -51.43 -66.38 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.775 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.535 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 15.5 p -47.2 -40.84 16.97 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.483 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -78.1 -47.82 17.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.558 1.072 . . . . 0.0 109.304 178.321 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.788 HG21 HG21 ' B' ' 131' ' ' THR . 9.0 m -53.24 -47.37 69.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.796 ' HA ' HD23 ' B' ' 117' ' ' LEU . 6.2 mmt -55.05 -46.83 75.4 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.656 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.528 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -57.3 -49.1 77.17 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.936 0.398 . . . . 0.0 110.336 178.445 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.477 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.64 -50.49 69.11 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.906 ' HB3' HD21 ' B' ' 117' ' ' LEU . 2.9 mm-40 -72.13 -8.59 55.53 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.808 178.208 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.612 ' HA ' ' HE2' ' B' ' 120' ' ' TYR . . . -88.39 -44.1 11.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 122.667 0.387 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -57.36 4.39 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.546 0.689 . . . . 0.0 110.004 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 . . . . . 0 N--CA 1.442 -0.873 0 CA-C-N 114.55 -1.204 . . . . 0.0 113.352 -178.204 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.443 ' NZ ' ' OG ' ' A' ' 11' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.668 0.271 . . . . 0.0 110.651 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.671 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 1.6 tp60 -114.2 121.77 44.75 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.146 0.498 . . . . 0.0 110.22 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.542 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 0.3 OUTLIER -78.83 112.39 15.93 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.071 -179.454 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 0.755 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -113.7 114.04 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.771 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -117.57 129.01 55.51 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.928 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.999 HG23 HG13 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -102.37 102.59 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 174.667 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 108' ' ' THR . . . . . 1.062 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -71.22 67.29 0.45 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.371 -0.531 . . . . 0.0 111.223 -179.18 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.999 HG13 HG23 ' B' ' 107' ' ' VAL . 4.7 m -96.14 -127.64 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.736 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.657 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 1.4 t70 154.12 -89.18 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 111' ' ' SER . . . . . 0.647 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 39.0 t -94.19 9.47 37.8 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 118.685 -0.674 . . . . 0.0 111.521 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.535 ' O ' ' HA ' ' A' ' 29' ' ' SER . 2.3 m-20 -74.64 56.2 0.69 Allowed 'General case' 0 C--N 1.365 1.277 0 CA-C-N 119.943 1.247 . . . . 0.0 109.271 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.55 ' HA ' HD12 ' B' ' 116' ' ' LEU . 0.9 OUTLIER 62.07 -14.78 0.05 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.983 -178.774 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.825 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.2 OUTLIER -53.87 -54.67 35.32 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.117 0.484 . . . . 0.0 110.135 178.974 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.657 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.38 -41.11 27.9 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.168 -178.17 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 3.9 mt -52.46 -53.89 39.56 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.044 -0.41 . . . . 0.0 111.433 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.906 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -53.12 -41.1 64.71 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.764 0.792 . . . . 0.0 111.727 179.785 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.825 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.6 pttt -79.81 -25.74 40.75 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.51 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -59.24 -23.36 62.27 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.643 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 2.1 m-85 -88.35 -37.88 15.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.987 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.643 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.2 t70 117.98 75.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.629 1.205 . . . . 0.0 111.948 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.848 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -166.8 -40.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.859 -179.306 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 65.59 -108.04 0.15 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 0.965 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -153.06 2.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 178.576 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.445 ' C ' ' O ' ' B' ' 124' ' ' ILE . 81.8 p -39.04 -63.26 0.55 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 126' ' ' GLY . . . . . 0.472 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.27 -31.52 19.37 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.303 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.723 ' HB3' HG22 ' B' ' 124' ' ' ILE . 8.4 tp -56.97 -62.2 1.91 Allowed 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 117.3 0.55 . . . . 0.0 111.52 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 0.965 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.5 t -53.48 -59.55 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.797 0.808 . . . . 0.0 109.079 178.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.824 ' HB3' ' CB ' ' A' ' 12' ' ' ASP . 3.5 m -48.29 -50.09 31.28 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.194 -1.366 . . . . 0.0 112.965 179.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 130' ' ' THR . . . . . 0.472 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -83.57 -50.3 8.37 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 122.163 -0.336 . . . . 0.0 111.587 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.788 HG21 HG21 ' A' ' 31' ' ' THR . 0.5 OUTLIER -55.62 -41.94 74.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -179.153 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.953 ' SD ' HG13 ' B' ' 128' ' ' VAL . 0.0 OUTLIER -60.73 -46.72 89.32 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.333 178.912 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.728 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.6 OUTLIER -49.26 -35.87 18.9 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.179 0.445 . . . . 0.0 110.526 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 134' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -70.71 -49.22 49.29 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.513 179.279 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.591 ' CB ' HD21 ' A' ' 17' ' ' LEU . 30.3 mm-40 -77.92 -13.67 59.8 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.964 0.411 . . . . 0.0 110.612 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.984 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -83.55 -34.64 25.18 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.371 0.669 . . . . 0.0 110.074 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.81 -50.89 8.18 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.985 0.898 . . . . 0.0 109.933 178.104 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 138' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.685 0 CA-C-N 113.849 -1.523 . . . . 0.0 114.143 -177.178 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.07 0.462 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.583 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 2.0 tt0 -108.8 112.38 24.62 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.531 0.681 . . . . 0.0 111.535 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.911 ' HG2' HG22 ' B' ' 106' ' ' THR . 8.3 ttm-85 -79.57 99.98 7.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.171 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.914 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -101.87 130.3 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.969 0 N-CA-C 106.787 -1.561 . . . . 0.0 106.787 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.974 ' HB ' HG23 ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.09 134.23 50.28 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.344 -0.942 . . . . 0.0 112.765 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 1.009 ' O ' HG23 ' B' ' 105' ' ' ILE . 0.9 OUTLIER -99.53 81.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.493 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.536 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 69.7 p -68.89 71.3 0.22 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.162 -0.961 . . . . 0.0 110.85 -178.191 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.852 HG21 ' HB3' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -77.89 -102.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.729 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.722 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 27.3 t0 113.88 14.09 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.363 0.665 . . . . 0.0 110.719 -178.183 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 177.73 -23.09 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.68 ' HB2' HG11 ' A' ' 9' ' ' VAL . 2.4 m-20 -72.27 56.01 0.34 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 -176.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.542 ' O ' ' HB3' ' B' ' 132' ' ' MET . 61.6 m 57.91 0.91 0.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.383 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.852 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.02 -49.31 62.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.507 ' HG3' ' CD2' ' A' ' 14' ' ' TYR . 4.5 mt-30 -49.41 -36.94 23.66 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -176.637 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -63.16 -56.37 17.35 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.736 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -46.47 -47.17 19.27 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 112.169 -178.159 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.518 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 1.4 pttt -79.57 -29.67 41.36 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.818 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.443 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -74.82 -25.35 58.96 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.019 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.512 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -87.9 -38.13 15.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.234 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.507 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 158.28 12.97 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 177.255 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.484 ' O ' HG12 ' A' ' 22' ' ' VAL . 75.8 t -134.34 79.91 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.584 -0.697 . . . . 0.0 111.716 -178.676 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.983 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.7 OUTLIER -66.66 52.92 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.945 0.403 . . . . 0.0 111.349 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.983 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER 41.6 -8.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 118.375 2.731 . . . . 0.0 118.375 178.887 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.996 ' HA ' HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.73 -62.48 0.61 Allowed 'General case' 0 C--O 1.245 0.837 0 CA-C-N 120.13 1.332 . . . . 0.0 109.852 -178.464 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.85 -24.89 57.31 Favored Glycine 0 CA--C 1.522 0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.621 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.7 ' HB3' HG22 ' A' ' 24' ' ' ILE . 7.8 tp -67.49 -61.5 1.87 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 117.207 0.503 . . . . 0.0 111.471 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.986 HG22 ' CG2' ' B' ' 128' ' ' VAL . 33.5 t -45.0 -63.0 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.61 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.444 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.778 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 7.4 p -48.78 -47.32 41.97 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.988 1.315 . . . . 0.0 113.091 177.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.6 m -61.5 -51.26 69.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.45 ' OG1' HG21 ' B' ' 131' ' ' THR . 7.1 m -59.11 -41.84 89.12 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.27 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.881 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -52.64 -52.23 56.54 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.174 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.471 ' HB2' ' CB ' ' B' ' 113' ' ' SER . 2.3 tt0 -62.79 -51.71 66.01 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.269 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -56.28 -51.35 68.47 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HG2' HD21 ' B' ' 127' ' ' LEU . 3.0 tp10 -65.8 -29.07 69.5 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.204 178.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.67 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -70.48 -44.31 67.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.116 0.484 . . . . 0.0 110.257 178.327 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -56.28 7.19 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.38 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.789 0 CA-C-N 114.704 -1.134 . . . . 0.0 113.646 -176.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 102' ' ' LYS . . . . . 0.722 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 121.069 0.461 . . . . 0.0 110.351 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 103' ' ' GLN . . . . . 0.478 ' CG ' ' HE2' ' A' ' 14' ' ' TYR . 57.6 tp60 -121.95 117.5 26.57 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.938 0.875 . . . . 0.0 110.553 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 104' ' ' ARG . . . . . 0.661 ' NH1' HG21 ' A' ' 6' ' ' THR . 39.6 ttt85 -79.26 109.43 13.59 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.095 -1.412 . . . . 0.0 112.899 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 105' ' ' ILE . . . . . 1.009 HG23 ' O ' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -96.58 116.87 39.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.892 0 N-CA-C 103.739 -2.689 . . . . 0.0 103.739 174.4 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.974 HG23 ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -118.52 112.18 19.57 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.593 -174.917 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 107' ' ' VAL . . . . . 0.996 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.0 OUTLIER -102.44 106.17 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.525 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 108' ' ' THR . . . . . 0.79 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 25.6 p -72.07 90.38 1.18 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.822 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.68 -146.75 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 118.882 -0.58 . . . . 0.0 111.832 -178.38 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 110' ' ' ASP . . . . . 0.591 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 8.7 t70 105.13 5.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 24.6 t -150.23 -41.18 0.13 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 113.66 -1.609 . . . . 0.0 110.414 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 112' ' ' ASP . . . . . 0.778 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.3 OUTLIER -74.71 33.78 0.1 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.501 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.471 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.2 OUTLIER 72.21 3.86 4.82 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 177.383 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 114' ' ' TYR . . . . . 0.914 ' CE1' HG21 ' A' ' 5' ' ' ILE . 1.9 t80 -57.75 -55.63 32.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.203 0.456 . . . . 0.0 111.507 179.693 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 115' ' ' GLN . . . . . 0.562 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 15.2 mt-30 -49.68 -42.7 46.27 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -177.414 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 116' ' ' LEU . . . . . 0.67 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -49.19 -30.66 7.21 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.692 0.282 . . . . 0.0 111.726 179.774 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 117' ' ' LEU . . . . . 0.697 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.56 -57.55 3.71 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.372 0.606 . . . . 0.0 111.574 178.314 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 118' ' ' LYS . . . . . 0.61 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -65.09 -25.48 67.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.995 -179.909 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 119' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.95 -27.98 47.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.079 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 120' ' ' TYR . . . . . 0.554 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.1 m-30 -88.21 -47.41 8.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.667 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.554 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 5.0 m-20 143.45 41.51 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.193 0.933 . . . . 0.0 110.52 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 122' ' ' VAL . . . . . 0.737 HG13 ' O ' ' B' ' 122' ' ' VAL . 6.1 p -160.25 87.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-O 121.661 0.743 . . . . 0.0 111.592 -177.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 123' ' ' ASN . . . . . 0.702 ' O ' ' HE1' ' A' ' 32' ' ' MET . 1.2 m120 -63.22 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 124' ' ' ILE . . . . . 1.025 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -146.86 4.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 125' ' ' SER . . . . . 0.872 ' HA ' HG22 ' A' ' 7' ' ' VAL . 1.2 t -39.51 -64.63 0.46 Allowed 'General case' 0 C--O 1.244 0.814 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.011 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.94 -21.53 45.98 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 127' ' ' LEU . . . . . 0.696 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -64.43 -56.72 12.38 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 122.73 0.412 . . . . 0.0 110.911 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 128' ' ' VAL . . . . . 1.025 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.2 t -56.67 -60.99 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 129' ' ' SER . . . . . 0.656 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.2 p -47.15 -38.8 12.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.147 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 93.1 m -70.96 -48.58 52.59 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 131' ' ' THR . . . . . 0.463 HG23 HD21 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -66.62 -31.86 72.81 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.124 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 132' ' ' MET . . . . . 0.736 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 4.7 mmt -65.39 -57.04 9.33 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 133' ' ' GLN . . . . . 0.51 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -48.79 -37.13 18.28 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 -75.05 -41.41 59.14 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.997 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.669 ' CB ' HD21 ' A' ' 17' ' ' LEU . 1.6 mm-40 -84.25 -12.75 54.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.81 0.338 . . . . 0.0 110.832 177.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 136' ' ' ALA . . . . . 0.622 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -87.34 -29.61 21.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.42 0.688 . . . . 0.0 109.313 178.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 137' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 2.1 mmt180 -81.45 -48.25 12.13 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.763 0.792 . . . . 0.0 110.102 178.489 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 113.958 -1.474 . . . . 0.0 112.969 -177.688 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.1 ttp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 120.303 0.096 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HD3' ' HB3' ' B' ' 110' ' ' ASP . 8.8 mmtm -78.46 179.89 6.76 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.739 -0.209 . . . . 0.0 110.84 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.485 ' O ' ' HA ' ' B' ' 108' ' ' THR . 7.5 tt0 -130.26 120.74 24.9 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.916 0.389 . . . . 0.0 111.795 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 1.041 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -81.95 116.99 21.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.885 ' CG1' HG13 ' B' ' 107' ' ' VAL . 0.5 OUTLIER -113.78 122.22 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.105 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.721 ' OG1' ' H72' ' C' ' 178' ' ' ' DT' . 0.5 OUTLIER -131.59 129.85 41.44 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.025 -1.07 . . . . 0.0 112.954 -177.888 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.674 HG22 HG12 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -100.22 103.54 14.93 Favored 'Isoleucine or valine' 0 C--N 1.346 0.421 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 175.381 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.77 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.1 OUTLIER -69.77 67.17 0.25 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 122.009 0.909 . . . . 0.0 109.774 -178.866 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.716 HG21 ' HB3' ' A' ' 12' ' ' ASP . 9.4 p -106.09 -132.32 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.389 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.635 ' H ' HG22 ' A' ' 9' ' ' VAL . 3.2 t70 148.34 -87.16 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 70.7 m -74.65 -5.67 44.34 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.716 ' HB3' HG21 ' A' ' 9' ' ' VAL . 4.2 t0 -79.68 56.76 2.32 Favored 'General case' 0 C--N 1.353 0.727 0 CA-C-N 120.437 1.471 . . . . 0.0 109.936 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' B' ' 132' ' ' MET . 13.2 m 65.25 -18.5 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.722 ' CE1' ' HB ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -50.63 -56.03 13.71 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 118.347 0.521 . . . . 0.0 110.777 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.745 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -50.75 -43.84 58.36 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.641 -0.708 . . . . 0.0 112.763 -177.906 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.641 HD13 ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -54.43 -40.59 68.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.905 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.93 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.665 0.745 . . . . 0.0 110.634 179.782 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 13.9 pttt -69.06 -25.78 64.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.655 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.17 -22.04 60.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 178.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.664 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 15.1 m-30 -87.84 -54.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.664 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 12.4 p-10 163.92 35.15 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.764 0.665 . . . . 0.0 112.117 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.655 HG13 ' O ' ' A' ' 22' ' ' VAL . 9.6 p -154.39 99.12 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.524 0.678 . . . . 0.0 112.622 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.7 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 16.0 m-20 -60.71 13.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.962 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.987 HG21 ' CE ' ' B' ' 132' ' ' MET . 1.7 pp 65.12 -5.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 N-CA-C 117.484 2.401 . . . . 0.0 117.484 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.757 ' HA ' ' HB ' ' B' ' 107' ' ' VAL . 9.8 p -38.49 -62.35 0.6 Allowed 'General case' 0 C--N 1.308 -1.233 0 O-C-N 123.243 0.339 . . . . 0.0 111.734 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.539 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -67.05 -38.72 92.74 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.663 -0.779 . . . . 0.0 113.059 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.492 ' CD2' HG22 ' A' ' 24' ' ' ILE . 3.5 tp -63.5 -61.44 2.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 117.208 0.504 . . . . 0.0 112.299 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.925 HG13 HG21 ' B' ' 124' ' ' ILE . 53.6 t -40.1 -73.4 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -178.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.735 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -57.71 -32.55 67.5 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.894 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.539 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.9 OUTLIER -66.54 -54.09 27.53 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 177.904 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.498 HG21 ' OG1' ' B' ' 131' ' ' THR . 9.4 m -51.78 -47.83 64.03 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.317 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.848 ' HE1' ' CG1' ' B' ' 124' ' ' ILE . 5.3 mtt -49.07 -48.99 43.68 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.242 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.15 -36.33 18.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.446 0.566 . . . . 0.0 110.394 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -67.8 -51.42 48.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.467 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.91 ' HB3' HD21 ' B' ' 117' ' ' LEU . 2.4 tp10 -75.34 -17.23 60.29 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.625 0.25 . . . . 0.0 110.84 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.815 ' O ' HD11 ' A' ' 39' ' ' LEU . . . -86.28 -25.74 25.33 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 123.193 0.597 . . . . 0.0 109.691 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.22 -47.83 12.0 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 121.858 0.837 . . . . 0.0 109.756 177.916 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.472 ' O ' ' C ' ' A' ' 39' ' ' LEU . 5.7 mtt85 -83.15 -36.06 25.06 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.414 -177.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.878 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.0 OUTLIER 12.29 82.15 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -177.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.528 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -89.61 -50.93 5.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.768 179.724 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.556 ' HB2' ' HA2' ' B' ' 151' ' ' GLY . . . 168.39 138.33 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.245 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -72.06 149.15 45.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.956 0.408 . . . . 0.0 110.99 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mmm180 -88.36 94.18 9.76 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.125 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -47.5 115.13 1.03 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.051 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -80.52 112.6 18.02 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.003 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.1 p -85.57 157.88 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.09 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.13 -170.89 1.9 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.973 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.75 47.62 0.44 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.043 0.449 . . . . 0.0 111.29 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -96.71 134.16 40.34 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.171 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.25 163.83 23.69 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.169 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -147.62 49.13 0.62 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.981 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.1 mtm -122.89 153.38 39.72 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.784 0.326 . . . . 0.0 111.316 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.4 p -159.0 157.12 3.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.304 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.79 -178.8 3.68 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.823 0.344 . . . . 0.0 111.481 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 84.0 t -132.42 -79.74 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-O 121.441 0.639 . . . . 0.0 111.529 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.434 ' O ' ' HD2' ' A' ' 57' ' ' ARG . . . 56.67 94.97 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.961 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.434 ' HD2' ' O ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -140.74 150.32 43.26 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.551 179.891 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.514 ' N ' ' CD1' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -170.46 97.15 0.25 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.153 0.501 . . . . 0.0 111.519 -179.698 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -92.89 -130.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.947 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.41 173.27 15.87 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.823 0.283 . . . . 0.0 111.308 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.67 100.41 2.97 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.006 0.432 . . . . 0.0 111.291 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -111.74 148.45 33.46 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.39 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.41 171.07 23.89 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.84 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 53.3 p -112.08 -175.5 2.7 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.784 0.326 . . . . 0.0 111.196 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -134.02 169.92 16.42 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.147 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -136.7 152.79 50.78 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.418 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.08 -76.25 0.51 Allowed 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.961 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 65.43 -176.02 0.18 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.806 0.336 . . . . 0.0 111.751 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -178.19 -99.11 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.024 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.4 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 178.72 -33.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -179.86 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.8 80.37 0.23 Allowed 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.46 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.071 -0.966 . . . . 0.0 111.086 -179.393 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.758 0 N-CA-C 110.877 -0.046 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.37 112.35 24.05 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 110.242 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.55 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 52.9 tp60 -105.58 113.32 26.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.772 0.796 . . . . 0.0 110.31 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.7 ' HB3' ' NH1' ' B' ' 104' ' ' ARG . 7.9 ttp-105 -79.31 103.55 9.31 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.712 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.722 ' HB ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.66 129.03 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.342 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.645 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -128.61 115.6 18.32 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.859 -177.868 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.885 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.14 98.72 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.701 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 108' ' ' THR . . . . . 1.041 HG22 ' HG3' ' A' ' 4' ' ' ARG . 41.6 p -68.13 84.3 0.24 Allowed 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.006 HG21 ' HB2' ' B' ' 114' ' ' TYR . 6.4 t -72.56 -116.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.413 -177.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.628 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 4.9 t70 75.63 -7.48 1.78 Allowed 'General case' 0 C--N 1.351 0.649 0 CA-C-O 121.443 0.64 . . . . 0.0 109.597 -176.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 2.4 m -127.18 -69.43 0.75 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.46 179.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.735 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 0.6 OUTLIER -42.36 -78.28 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.68 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.476 ' H ' ' HB2' ' A' ' 29' ' ' SER . 1.7 m 169.0 46.78 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.55 0.691 . . . . 0.0 110.662 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.006 ' HB2' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.89 -52.55 6.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.831 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.9 OUTLIER -48.69 -35.31 13.66 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -175.494 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.766 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -62.47 -57.03 12.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.632 0.651 . . . . 0.0 111.658 179.582 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.91 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -46.37 -48.76 18.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.506 0.67 . . . . 0.0 111.411 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.715 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 5.2 pttt -79.35 -27.88 42.03 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.004 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -58.45 -28.06 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.878 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -88.42 -45.81 9.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.254 177.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 157.04 22.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 175.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.567 ' O ' HG12 ' B' ' 122' ' ' VAL . 49.5 t -138.93 82.57 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -178.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 1.042 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -64.54 56.74 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.006 0.431 . . . . 0.0 111.489 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.042 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER 44.66 -11.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.474 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.1 OUTLIER -38.19 -60.64 0.75 Allowed 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.362 1.437 . . . . 0.0 110.542 -178.523 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -81.11 -27.84 47.73 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.608 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.668 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -66.95 -62.35 1.48 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.701 0.4 . . . . 0.0 111.101 -179.901 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.924 HG22 HG22 ' A' ' 28' ' ' VAL . 3.0 t -47.08 -66.6 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-O 121.144 0.497 . . . . 0.0 109.877 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.558 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 13.7 p -47.99 -34.97 10.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.267 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.7 m -73.77 -56.24 5.23 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.498 ' OG1' HG21 ' A' ' 31' ' ' THR . 0.7 OUTLIER -51.74 -39.16 58.0 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.365 -0.834 . . . . 0.0 108.914 178.668 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.987 ' CE ' HG21 ' A' ' 24' ' ' ILE . 19.0 mmt -52.91 -54.08 39.86 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.042 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.2 -46.85 79.29 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.34 -54.57 30.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.882 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.732 ' CB ' HD21 ' A' ' 17' ' ' LEU . 21.7 mm-40 -62.76 -27.14 69.08 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.282 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.641 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -72.31 -46.45 55.58 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.571 0.348 . . . . 0.0 110.72 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -56.59 5.77 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.213 0.53 . . . . 0.0 111.545 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.477 ' HD2' ' HG3' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -83.75 -34.35 24.85 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -176.635 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.583 ' CD1' ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 37.16 70.68 0.17 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -179.133 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' B' ' 138' ' ' ARG . 3.6 ptp180 171.34 -71.89 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 177.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 179.45 148.15 0.24 Allowed 'General case' 0 C--O 1.239 0.551 0 CA-C-O 120.764 0.316 . . . . 0.0 111.67 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.477 ' HG3' ' HD2' ' B' ' 138' ' ' ARG . 1.4 mp0 -137.92 177.31 7.97 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.514 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.93 137.66 16.13 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.08 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.421 ' O ' ' NZ ' ' B' ' 145' ' ' LYS . 0.0 OUTLIER -125.54 -151.43 0.48 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.715 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.421 ' NZ ' ' O ' ' B' ' 144' ' ' TRP . 8.6 mmtm -130.53 -163.78 1.35 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 21.2 m -47.17 142.63 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-O 120.936 0.398 . . . . 0.0 111.878 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -53.37 -41.08 65.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.85 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 55.15 30.69 14.91 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.693 0.282 . . . . 0.0 111.604 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -143.27 141.43 31.03 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.735 0.302 . . . . 0.0 111.077 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -82.46 139.22 34.08 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.387 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 151' ' ' GLY . . . . . 0.556 ' HA2' ' HB2' ' A' ' 41' ' ' ALA . . . -102.13 84.46 0.5 Allowed Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.966 -0.635 . . . . 0.0 113.228 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.1 tpt -115.1 67.01 0.69 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.859 0.361 . . . . 0.0 111.399 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 19.4 t -129.87 143.91 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.164 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.6 -175.06 2.8 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.932 0.396 . . . . 0.0 111.903 -179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.859 HG13 ' O ' ' B' ' 120' ' ' TYR . 12.0 t -114.7 -122.38 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.213 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.485 ' N ' HG12 ' B' ' 155' ' ' VAL . . . 71.69 34.73 1.54 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.805 0.442 . . . . 0.0 111.383 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 126.69 13.58 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.124 0.488 . . . . 0.0 112.007 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -151.32 80.94 1.3 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.263 0.554 . . . . 0.0 111.701 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 16.8 mt -148.92 -56.88 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.582 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -78.28 125.88 29.99 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.895 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 161' ' ' MET . . . . . 0.46 ' CE ' ' HA ' ' B' ' 161' ' ' MET . 2.4 mmt -163.21 107.74 1.07 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.851 0.357 . . . . 0.0 111.748 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 162' ' ' ASN . . . . . 0.454 ' HB3' " H4'" ' C' ' 178' ' ' ' DT' . 2.7 t-20 -176.53 -175.95 0.7 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 127.26 136.92 4.4 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.028 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.5 t -166.55 171.87 11.32 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.549 0.214 . . . . 0.0 111.203 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -179.81 129.95 0.09 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.39 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -139.02 106.91 5.66 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.293 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -76.78 121.78 23.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.032 0.444 . . . . 0.0 111.324 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -145.69 28.33 1.17 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.547 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 5.7 p30 176.26 -116.38 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.48 ' O ' ' CB ' ' B' ' 171' ' ' ASP . 0.0 OUTLIER 168.29 -33.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.072 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.48 ' CB ' ' O ' ' B' ' 170' ' ' LYS . 3.7 t0 98.05 88.87 0.01 OUTLIER 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.584 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.332 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.838 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.871 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C1'-C2' 107.152 0.956 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.871 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.748 0 P-O3'-C3' 120.93 1.025 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.584 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 C4'-C3'-C2' 104.092 0.892 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.77 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.846 0 C1'-O4'-C4' 106.908 -1.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.529 ' OP2' ' HA ' ' A' ' 7' ' ' VAL . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C4'-C3'-C2' 104.619 1.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.721 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.882 0 C3'-C2'-C1' 105.397 1.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.592 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.522 0 C3'-C2'-C1' 105.146 1.747 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.844 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 C3'-C2'-C1' 100.65 -1.465 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.844 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 O4'-C1'-C2' 107.024 0.84 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.581 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -0.964 0 C4'-C3'-C2' 104.674 1.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.586 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 106.923 0.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.586 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C4'-C3'-C2' 103.791 0.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C4'-C3'-C2' 100.882 -2.318 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.533 ' H73' " H2'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C4'-C3'-C2' 102.379 -0.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.533 " H2'" ' H73' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C1'-C2' 106.826 0.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.634 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.636 0 O4'-C4'-C3' 106.13 0.53 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.634 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 O4'-C1'-C2' 106.991 0.81 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.605 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.0 0 C3'-C2'-C1' 105.416 1.94 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.563 ' C4 ' ' C5 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 104.807 1.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.597 " O5'" ' H8 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C3'-C2'-C1' 106.318 2.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.503 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 N19-C1'-C2' 115.033 0.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.503 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.411 -0.728 0 C4'-C3'-C2' 104.464 1.264 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.416 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.078 0 C1'-O4'-C4' 106.756 -2.103 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.448 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C1'-O4'-C4' 111.075 0.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.751 0 C4'-C3'-C2' 103.987 0.787 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.584 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 102.077 -0.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.424 ' O ' ' C ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 110.84 -0.059 . . . . 0.0 110.84 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.583 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 7.4 mmmm -27.82 112.92 0.06 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' B' ' 109' ' ' VAL . 25.1 tt0 -95.31 115.97 28.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.24 0.543 . . . . 0.0 111.556 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.986 ' HG3' HG22 ' B' ' 108' ' ' THR . 7.9 ttm-85 -79.55 100.01 7.56 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.75 HG12 HG13 ' B' ' 107' ' ' VAL . 0.7 OUTLIER -103.28 130.54 53.37 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.842 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.367 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.833 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -130.05 127.66 40.36 Favored 'General case' 0 C--N 1.311 -1.083 0 C-N-CA 118.73 -1.188 . . . . 0.0 113.893 -177.1 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.868 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.1 t -101.02 112.54 34.26 Favored 'Isoleucine or valine' 0 C--N 1.347 0.49 0 C-N-CA 124.39 1.076 . . . . 0.0 108.789 176.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.417 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 2.0 p -70.92 85.17 0.69 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.826 0.739 . . . . 0.0 110.386 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.945 HG21 ' CD1' ' A' ' 14' ' ' TYR . 10.3 m -72.26 -162.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.981 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.567 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.6 t70 84.7 -23.59 0.17 Allowed 'General case' 0 C--N 1.351 0.636 0 C-N-CA 123.396 0.679 . . . . 0.0 109.365 -177.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.36 -75.52 0.53 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.294 177.471 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.914 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 1.0 OUTLIER -51.46 -87.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.981 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.516 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 5.2 t -176.85 41.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.256 0.935 . . . . 0.0 112.259 -178.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.945 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.2 -43.8 15.74 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.688 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 16.8 mt-30 -47.84 -37.8 14.66 Favored 'General case' 0 C--O 1.221 -0.418 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -174.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.892 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -58.42 -56.22 24.93 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.473 1.033 . . . . 0.0 111.693 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.796 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -48.05 -47.89 33.47 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.454 0.645 . . . . 0.0 111.63 -178.214 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -76.74 -27.16 55.27 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.41 178.969 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -66.03 -27.61 68.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.855 178.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.743 ' CD2' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.8 -40.48 14.01 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.57 178.482 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.545 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.8 OUTLIER 151.21 21.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.267 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.469 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 68.4 t -155.9 89.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.515 0 C-N-CA 120.886 -0.326 . . . . 0.0 111.833 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.467 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 1.1 m120 -61.2 -100.28 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.064 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -146.26 4.79 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.431 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 89.5 p -44.38 -64.82 0.61 Allowed 'General case' 0 C--O 1.244 0.794 0 C-N-CA 119.395 -0.922 . . . . 0.0 108.826 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.4 -28.65 29.58 Favored Glycine 0 CA--C 1.519 0.319 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.593 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.913 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -58.74 -59.6 5.16 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 122.198 0.199 . . . . 0.0 110.858 179.489 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.064 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.1 t -52.31 -61.65 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.835 ' HB3' ' CB ' ' B' ' 112' ' ' ASP . 12.1 p -50.55 -42.73 55.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 89.3 m -71.34 -53.29 14.68 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.47 -41.46 89.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.129 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.968 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -56.0 -52.99 62.24 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.446 178.433 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.444 ' HG3' ' HB3' ' B' ' 113' ' ' SER . 53.2 mt-30 -53.68 -56.68 15.17 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.35 -53.27 56.11 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.955 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -66.83 -23.33 66.02 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.145 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.775 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -72.19 -47.57 49.66 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.79 -51.58 66.52 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -60.73 -52.14 66.36 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.151 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.842 HD21 ' HB2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 34.59 81.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.953 0.901 . . . . 0.0 113.008 178.882 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.8 mtt180 69.58 50.02 0.53 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.398 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.52 -57.92 1.72 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.0 158.86 10.2 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.015 0.436 . . . . 0.0 111.963 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -99.57 -58.67 1.88 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.962 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.9 t-105 -171.15 173.69 4.9 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.5 0.19 . . . . 0.0 110.827 -179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HB3' ' HB2' ' B' ' 142' ' ' GLU . 1.8 mtmp? -147.25 164.46 33.14 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.539 0.209 . . . . 0.0 111.143 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.437 ' HB ' ' O ' ' B' ' 143' ' ' ARG . 21.8 t -129.06 -102.66 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.615 ' O ' ' HB2' ' A' ' 48' ' ' ASN . 18.2 mt-10 -149.07 90.95 1.8 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -178.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.785 ' HB3' ' HB3' ' B' ' 144' ' ' TRP . 10.0 t-20 134.36 -125.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.47 1.108 . . . . 0.0 112.077 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.614 ' O ' ' HB2' ' B' ' 144' ' ' TRP . 23.7 mt-30 -122.76 -176.07 3.31 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-O 120.983 0.421 . . . . 0.0 111.87 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.441 ' H ' ' CD ' ' A' ' 50' ' ' GLU . 1.8 pm0 -73.93 138.97 44.59 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.978 0.418 . . . . 0.0 111.603 -179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.581 ' HA3' ' CZ3' ' B' ' 144' ' ' TRP . . . 174.66 -147.88 9.4 Favored Glycine 0 C--N 1.336 0.563 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.059 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.608 ' O ' HG12 ' A' ' 53' ' ' VAL . 4.8 ttt -72.26 -39.99 67.98 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.608 HG12 ' O ' ' A' ' 52' ' ' MET . 2.8 p 50.9 24.26 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -93.01 135.04 34.53 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.761 0.315 . . . . 0.0 111.365 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.4 t -137.12 -125.66 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.376 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -174.23 -101.28 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.401 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 39.6 mmt-85 -156.74 170.64 21.96 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.96 0.41 . . . . 0.0 111.862 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -177.97 103.47 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.374 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 32.2 mm -140.9 106.8 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.038 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -101.62 156.75 17.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.435 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 12.9 mtm -137.12 109.32 7.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.148 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -141.33 149.0 40.62 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.291 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -138.39 -162.73 9.31 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.123 -0.56 . . . . 0.0 112.833 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.5 t -161.74 177.76 9.62 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.861 0.362 . . . . 0.0 111.411 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -136.9 164.23 28.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.336 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -147.5 151.33 36.19 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.136 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -128.4 -79.09 0.57 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.355 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.83 -163.07 0.83 Allowed 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.661 0.267 . . . . 0.0 111.461 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -154.4 -71.27 0.13 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.987 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.49 ' NZ ' ' O ' ' A' ' 71' ' ' ASP . 0.1 OUTLIER -179.92 -37.0 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.49 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.1 t70 86.28 179.89 0.03 OUTLIER 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.131 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.141 -0.933 . . . . 0.0 111.566 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.414 ' O ' ' C ' ' B' ' 102' ' ' LYS . 4.7 mpp? . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 120.276 0.084 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.473 ' HE2' " H3'" ' C' ' 175' ' ' ' DA' . 12.3 mptt -29.11 114.7 0.09 Allowed 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.445 0.466 . . . . 0.0 111.997 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.821 ' HB3' HG23 ' A' ' 9' ' ' VAL . 3.5 tp60 -99.36 125.06 44.96 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.976 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.472 ' NE ' ' O4 ' ' C' ' 178' ' ' ' DT' . 0.3 OUTLIER -77.91 114.61 16.94 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.279 -177.911 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 1.04 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -102.89 108.98 25.48 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.949 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 177.899 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.833 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -115.25 114.02 24.65 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.986 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.75 HG13 HG12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.21 101.35 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 176.849 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.986 HG22 ' HG3' ' A' ' 4' ' ' ARG . 77.0 p -68.61 95.2 0.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.01 HG21 ' CG ' ' B' ' 114' ' ' TYR . 16.5 m -91.29 -148.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.613 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.529 ' N ' HG23 ' B' ' 109' ' ' VAL . 15.9 t70 88.84 -13.33 0.39 Allowed 'General case' 0 C--N 1.346 0.445 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 -176.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.4 t -114.46 -62.48 1.59 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.835 ' CB ' ' HB3' ' A' ' 29' ' ' SER . 0.6 OUTLIER -48.66 -89.34 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 O-C-N 123.591 0.557 . . . . 0.0 111.865 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.444 ' HB3' ' HG3' ' A' ' 33' ' ' GLN . 1.3 m 176.04 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.865 0.757 . . . . 0.0 111.438 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.01 ' CG ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.37 -44.36 16.23 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.312 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.578 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 4.4 mt-30 -48.78 -42.63 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.775 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.8 OUTLIER -52.32 -30.19 27.11 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.955 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -77.5 -53.62 7.41 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 121.599 0.714 . . . . 0.0 111.204 179.534 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.625 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -70.43 -28.83 65.35 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.556 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -60.57 -28.13 68.23 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.864 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.842 ' HB2' HD21 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -89.16 -36.81 15.48 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.022 179.097 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.719 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 33.2 t70 146.83 25.36 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 176.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.582 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 61.8 t -159.67 101.13 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 O-C-N 121.841 -0.537 . . . . 0.0 112.396 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.557 ' O ' ' HE1' ' A' ' 32' ' ' MET . 67.8 m-80 -58.9 -92.51 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 177.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.011 HG22 ' HB3' ' B' ' 127' ' ' LEU . 0.1 OUTLIER -154.84 6.76 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.727 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.868 ' HA ' HG22 ' A' ' 7' ' ' VAL . 54.0 p -38.6 -64.27 0.45 Allowed 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.076 -177.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.588 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.25 -20.25 46.41 Favored Glycine 0 CA--C 1.522 0.471 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.834 177.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 1.011 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.82 -61.21 2.56 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.061 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.913 HG22 HG21 ' A' ' 24' ' ' ILE . 26.0 t -55.15 -65.16 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 CA-C-O 121.687 0.755 . . . . 0.0 109.136 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.914 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 3.0 p -49.44 -47.96 47.8 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.588 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -81.14 -48.53 12.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.441 1.019 . . . . 0.0 111.198 -178.404 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.736 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.98 -37.91 69.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.102 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.913 ' SD ' HD12 ' A' ' 27' ' ' LEU . 1.6 mmt -64.21 -48.19 76.83 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.389 178.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 26.1 tt0 -48.79 -42.13 34.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.096 0.407 . . . . 0.0 110.659 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 134' ' ' ASN . . . . . 0.712 ' HB3' ' HG2' ' B' ' 142' ' ' GLU . 1.5 m-20 -63.51 -55.68 22.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.177 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.631 ' O ' ' HA ' ' B' ' 139' ' ' LEU . 23.9 tp10 -71.31 -9.76 58.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.102 178.07 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.892 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.19 -46.93 8.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.985 0.421 . . . . 0.0 109.925 178.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -63.3 -56.17 18.65 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.623 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.607 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 2.8 tpt85 -83.06 -41.35 18.72 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.236 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.743 HD11 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 57.21 58.38 3.95 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.445 0.64 . . . . 0.0 112.417 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.51 ' HG2' ' C ' ' B' ' 139' ' ' LEU . 2.0 ptt-85 167.45 -50.64 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.241 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' B' ' 138' ' ' ARG . . . -170.46 130.44 0.89 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 122.47 0.308 . . . . 0.0 110.542 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.712 ' HG2' ' HB3' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -105.07 131.81 52.11 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.247 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.611 ' HB3' ' O ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 171.36 -64.03 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.785 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 2.1 t90 -88.3 -128.7 0.06 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.142 0.177 . . . . 0.0 111.296 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' B' ' 145' ' ' LYS . 0.0 OUTLIER -134.73 -174.32 3.55 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.813 0.34 . . . . 0.0 111.194 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 5.9 p -82.33 139.3 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 120.914 0.388 . . . . 0.0 111.849 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -162.75 162.09 26.57 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.063 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -90.11 133.69 34.71 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.13 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.08 58.03 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.12 -174.79 3.03 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.892 0.377 . . . . 0.0 111.511 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 147.76 35.86 0.05 OUTLIER Glycine 0 CA--C 1.523 0.571 0 CA-C-N 115.977 -0.556 . . . . 0.0 113.71 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' MET . . . . . 0.439 ' O ' HG13 ' B' ' 153' ' ' VAL . 2.6 ttp -86.26 48.63 1.65 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.45 0.625 . . . . 0.0 111.626 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.439 HG13 ' O ' ' B' ' 152' ' ' MET . 0.7 OUTLIER -157.35 130.2 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.709 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.3 151.68 19.5 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.856 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.2 t -125.5 -4.49 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 54.62 56.13 7.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.209 0.528 . . . . 0.0 111.364 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.84 97.01 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.906 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.88 82.63 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.072 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 67.4 mt -141.5 -61.14 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.002 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.05 122.09 32.04 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.756 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 5.0 ttt -113.92 -13.2 12.57 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.077 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 70.46 179.72 0.24 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.0 0.429 . . . . 0.0 111.755 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 175.06 -150.48 11.15 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 121.048 -0.596 . . . . 0.0 112.716 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 20.9 t -164.49 172.81 12.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.599 0.238 . . . . 0.0 111.365 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -175.66 119.92 0.17 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.459 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -160.09 139.66 11.17 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.095 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -120.05 92.58 3.81 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.21 0.529 . . . . 0.0 111.765 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -143.17 71.56 1.34 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.593 0.711 . . . . 0.0 109.947 179.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -115.04 171.36 7.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.744 -179.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.16 -34.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 71.33 -59.98 0.53 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.798 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 8.4 m95 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.852 179.502 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.518 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.568 0 O4'-C1'-N19 108.264 0.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.551 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 C3'-C2'-C1' 100.726 -1.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.572 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 O4'-C1'-C2' 107.326 1.115 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.574 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.406 -1.082 0 C1'-O4'-C4' 107.134 -1.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.58 ' OP1' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.426 -0.891 0 C3'-C2'-C1' 104.54 1.314 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.649 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.847 0 C4'-C3'-C2' 104.616 1.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.8 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.552 0 C3'-C2'-C1' 104.468 1.263 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.8 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.514 -0.532 0 C3'-C2'-C1' 101.296 -1.003 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C1'-O4'-C4' 110.913 0.866 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.524 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.931 0 C4'-C3'-C2' 104.748 1.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.524 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.704 0 C4'-C3'-C2' 104.193 0.993 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.423 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 101.651 -0.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 C4'-C3'-C2' 100.856 -2.344 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 N19-C1'-C2' 115.598 0.874 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.587 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 C3'-C2'-C1' 102.131 -0.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.587 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C1'-O4'-C4' 110.783 0.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.489 H2'' " O5'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.795 0 C1'-O4'-C4' 106.952 -1.963 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.733 ' C8 ' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C4'-C3'-C2' 104.797 1.597 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.733 ' H72' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.828 0 C4'-C3'-C2' 103.92 0.72 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.428 " H2'" ' C7 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 C3'-C2'-C1' 106.386 2.633 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.528 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.656 0 N19-C1'-C2' 115.868 1.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.528 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C3'-C2'-C1' 105.762 2.187 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.524 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.811 0 C4'-C3'-C2' 104.382 1.182 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.451 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 C4'-C3'-C2' 104.139 0.939 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.428 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 N19-C1'-C2' 115.472 0.795 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.572 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C4'-C3'-C2' 103.713 0.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.416 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 62.2 mtm . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 120.805 0.336 . . . . 0.0 110.999 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 3.5 mptt 70.02 111.54 0.05 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.986 -178.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.446 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 29.7 tp60 -104.64 109.62 21.61 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.13 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.856 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 2.3 ttm105 -78.91 104.6 9.65 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.331 -179.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.656 HG12 HG13 ' B' ' 107' ' ' VAL . 0.2 OUTLIER -104.08 130.21 55.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 177.786 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.7 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.36 128.41 39.6 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 119.117 -1.033 . . . . 0.0 112.901 -177.951 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.69 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -100.1 107.64 21.33 Favored 'Isoleucine or valine' 0 C--N 1.35 0.598 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 6.2 p -71.23 98.34 1.71 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.94 -0.475 . . . . 0.0 110.442 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.005 HG21 ' HB3' ' A' ' 14' ' ' TYR . 3.8 t -92.35 -130.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 119.094 -0.479 . . . . 0.0 112.077 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.541 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 31.4 t70 85.18 -9.23 0.84 Allowed 'General case' 0 C--N 1.351 0.641 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.4 m -132.23 -56.54 0.97 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.856 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.8 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 2.8 m-20 -49.86 -98.36 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -177.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 41.3 t -178.41 36.78 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.376 -0.828 . . . . 0.0 110.606 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.005 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.79 -45.71 14.0 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.794 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.685 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.1 -39.24 27.4 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -176.014 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.795 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -59.14 -56.84 17.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.439 0.563 . . . . 0.0 112.284 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.95 HD12 ' HA ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -59.61 -39.46 84.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 120.027 -0.669 . . . . 0.0 112.744 -177.471 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.685 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -80.14 -35.47 36.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.041 0.448 . . . . 0.0 112.123 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.569 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -73.66 -21.57 60.23 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.896 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.057 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -87.79 -40.08 14.36 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 118.913 -0.565 . . . . 0.0 109.642 178.799 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.602 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 7.0 t70 171.52 -5.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.81 ' HB ' HD22 ' A' ' 17' ' ' LEU . 74.4 t -121.57 82.0 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -177.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.025 ' O ' HD12 ' A' ' 24' ' ' ILE . 45.5 p30 -67.19 51.44 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 111.068 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.025 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 46.11 -15.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -37.99 -63.01 0.51 Allowed 'General case' 0 C--O 1.238 0.486 0 CA-C-N 120.166 1.348 . . . . 0.0 110.838 -177.688 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.52 -29.16 30.69 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.473 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.796 ' CD1' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -58.0 -62.33 1.9 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.463 179.511 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.015 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.8 t -48.48 -63.48 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.382 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.828 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 94.2 p -49.55 -38.73 32.05 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 81.3 m -67.31 -54.41 20.96 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.586 HG22 HD11 ' B' ' 127' ' ' LEU . 93.0 m -58.15 -40.85 82.45 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.257 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.948 ' SD ' HD12 ' B' ' 117' ' ' LEU . 8.1 mmt -53.52 -54.27 39.63 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.974 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? -62.73 -45.11 94.22 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.935 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.47 -50.72 71.62 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.554 ' HG2' ' CD1' ' B' ' 127' ' ' LEU . 5.6 tp10 -64.57 -37.93 89.24 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.922 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -56.11 -43.5 78.18 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 177.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -53.24 19.86 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -37.04 71.3 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.187 -1.369 . . . . 0.0 113.224 -177.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -26.29 -48.25 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 113.912 1.079 . . . . 0.0 113.912 -178.574 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.403 ' O ' ' NH1' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -70.46 60.74 0.22 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.228 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.56 125.65 2.88 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.749 0.309 . . . . 0.0 111.493 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -74.56 59.3 0.82 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 112.31 13.14 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.988 0.423 . . . . 0.0 110.754 178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -129.72 -174.94 3.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.541 -179.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.6 mtmm -130.44 162.65 28.69 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.626 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.7 m -138.47 45.58 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.034 0.445 . . . . 0.0 111.066 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -138.57 60.29 1.61 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.218 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.482 ' HB3' ' OE1' ' A' ' 49' ' ' GLN . 4.2 m120 -120.48 -94.75 0.5 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.542 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' OE1' ' HB3' ' A' ' 48' ' ' ASN . 2.2 pm0 -131.87 56.09 1.84 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.284 0.564 . . . . 0.0 110.806 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.04 -163.27 0.85 Allowed 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.294 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -175.8 121.64 0.82 Allowed Glycine 0 C--N 1.334 0.443 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.782 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 87.8 mtp -73.69 70.23 1.35 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.971 0.415 . . . . 0.0 110.895 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.5 p -58.93 131.99 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.878 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -107.1 -172.72 2.13 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.337 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 6.1 t -99.26 -3.59 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' ' 55' ' ' VAL . . . 71.21 -57.99 0.59 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.234 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -128.6 138.33 52.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.282 179.481 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -142.31 75.59 1.5 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.666 0.746 . . . . 0.0 112.245 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 38.4 mm -112.84 91.81 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.767 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -76.44 132.91 39.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.864 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -129.27 -54.97 1.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.4 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -134.08 -160.4 1.05 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.976 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.51 -112.08 0.46 Allowed Glycine 0 C--N 1.338 0.664 0 C-N-CA 120.873 -0.68 . . . . 0.0 113.152 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 65' ' ' PHE . 48.4 t 60.89 -149.91 0.41 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.643 0.259 . . . . 0.0 110.772 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.419 ' N ' ' OG ' ' A' ' 64' ' ' SER . 0.4 OUTLIER -111.01 -53.54 2.69 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.536 0.207 . . . . 0.0 111.219 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.27 40.3 3.75 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 36.11 73.11 0.09 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.221 0.534 . . . . 0.0 112.387 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -67.61 124.8 24.25 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.876 0.37 . . . . 0.0 110.616 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -82.94 -52.93 6.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.643 -179.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER 174.27 -29.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.533 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 4.5 t70 84.57 122.47 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.553 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.837 -1.078 . . . . 0.0 110.633 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 mmm . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 111.218 0.081 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.516 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 12.0 mmmt -148.31 174.59 11.87 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.529 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 33.8 tp60 -121.15 112.53 18.78 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.535 0.683 . . . . 0.0 112.121 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.488 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 5.5 ttm105 -79.55 111.91 16.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.895 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.7 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.8 OUTLIER -101.47 130.06 51.61 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.758 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.255 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.66 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.96 116.56 17.3 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.281 -177.96 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.793 HG22 HG22 ' B' ' 109' ' ' VAL . 0.8 OUTLIER -101.66 104.54 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 174.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.856 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 8.9 p -70.02 95.29 0.94 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.855 HG11 ' HB3' ' B' ' 114' ' ' TYR . 0.9 OUTLIER -93.2 -145.3 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.992 -178.632 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 28.2 t0 92.69 -10.62 0.18 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -175.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.46 -64.35 1.26 Allowed 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.354 177.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.828 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -44.0 -94.44 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.436 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -177.59 42.33 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.699 -0.625 . . . . 0.0 110.94 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.855 ' HB3' HG11 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.13 -45.52 15.05 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.055 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.548 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 3.9 mt-30 -49.86 -43.67 49.26 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.922 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -50.43 -33.82 22.29 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 1.057 HD12 HD22 ' B' ' 127' ' ' LEU . 0.4 OUTLIER -78.1 -53.94 6.83 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.894 -0.722 . . . . 0.0 111.771 178.594 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.548 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.1 OUTLIER -63.44 -25.49 68.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.995 178.621 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.62 -26.18 31.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.775 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.63 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 97.4 m-85 -87.64 -49.11 7.37 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.295 178.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.63 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 25.0 p-10 136.46 34.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 124.844 1.34 . . . . 0.0 112.078 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.599 ' CG1' HD13 ' B' ' 117' ' ' LEU . 5.5 p -120.76 -39.7 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.419 ' O ' ' HE1' ' A' ' 32' ' ' MET . 36.8 m-80 59.95 -119.64 0.92 Allowed 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 0.87 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -139.21 4.02 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 179.477 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.69 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.4 OUTLIER -40.53 -64.96 0.46 Allowed 'General case' 0 C--O 1.243 0.744 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.466 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.445 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.5 -23.13 51.95 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.128 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 1.057 HD22 HD12 ' B' ' 117' ' ' LEU . 7.0 tp -63.99 -61.27 2.38 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-N 116.843 0.322 . . . . 0.0 111.187 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.87 HG23 ' CG2' ' B' ' 124' ' ' ILE . 24.8 t -51.83 -61.19 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.8 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.8 p -48.41 -49.08 36.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.445 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.5 OUTLIER -77.04 -43.73 33.45 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.61 0.641 . . . . 0.0 110.496 179.776 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -63.14 -39.89 96.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.647 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.95 ' HA ' HD12 ' A' ' 17' ' ' LEU . 4.8 mmt -63.48 -57.05 11.45 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.62 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.442 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 5.3 tp60 -48.82 -37.52 19.55 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.962 0.164 . . . . 0.0 111.225 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -65.18 -57.47 8.45 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.769 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.928 ' HB2' HD11 ' A' ' 17' ' ' LEU . 1.3 mm-40 -75.81 -8.56 57.17 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.569 0.223 . . . . 0.0 111.053 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.795 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.23 -32.48 19.75 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.39 -46.77 13.11 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.898 0.856 . . . . 0.0 110.326 178.245 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 11.4 mtt180 -78.39 -17.47 56.39 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 113.617 -1.629 . . . . 0.0 114.614 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.057 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -36.32 124.24 0.78 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 118.678 0.672 . . . . 0.0 111.841 -178.458 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.402 ' HE ' ' CG ' ' B' ' 142' ' ' GLU . 1.1 ptt180 81.79 143.76 0.07 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.022 -179.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.39 113.05 1.6 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.777 0.322 . . . . 0.0 110.833 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.402 ' CG ' ' HE ' ' B' ' 140' ' ' ARG . 2.1 mm-40 -142.64 167.9 20.99 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.148 0.499 . . . . 0.0 112.1 -179.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.51 41.46 0.7 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.364 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -92.87 175.88 6.64 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.088 0.47 . . . . 0.0 111.83 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.99 -69.6 0.6 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.444 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 13.5 p -172.99 154.98 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.119 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -99.41 109.58 22.15 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.105 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -178.7 -51.16 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.174 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.14 123.8 0.72 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.881 0.372 . . . . 0.0 111.204 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -92.85 45.36 1.18 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.044 0.45 . . . . 0.0 111.19 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -105.07 85.22 0.45 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 121.238 -0.506 . . . . 0.0 112.709 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 1.1 ttt -69.96 86.95 0.54 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.954 0.407 . . . . 0.0 111.153 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 15.3 t -122.19 137.06 57.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.115 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -102.2 171.84 7.25 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.057 0.456 . . . . 0.0 111.419 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.4 t -133.37 -125.53 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.082 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 60.84 93.01 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.005 0.431 . . . . 0.0 112.14 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 5.0 ptt180 -81.7 153.56 26.51 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.917 0.389 . . . . 0.0 111.302 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -103.96 56.86 0.73 Allowed 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.641 0.734 . . . . 0.0 110.544 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 7.8 mm -123.93 88.74 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.493 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -149.16 163.96 36.09 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.852 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 77.9 mtp 49.34 59.35 4.54 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.068 0.461 . . . . 0.0 111.302 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -133.6 170.1 16.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.616 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 101.86 -164.15 17.34 Favored Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.017 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 34.0 t -153.78 165.77 34.98 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.963 0.411 . . . . 0.0 111.519 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.97 24.64 0.5 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.616 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -179.26 80.68 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.91 0.386 . . . . 0.0 111.198 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -94.26 -52.98 4.12 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.384 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 65.28 -151.55 0.26 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.413 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 70.2 -107.08 0.06 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 122.283 0.233 . . . . 0.0 110.825 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.466 ' NZ ' ' O ' ' B' ' 171' ' ' ASP . 0.4 OUTLIER 175.42 -32.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.466 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 2.0 t0 86.24 177.82 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.381 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.493 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.279 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.405 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.487 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.643 0 C1'-O4'-C4' 110.487 0.562 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.487 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 101.593 -0.79 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.576 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-C2' 107.392 1.175 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.02 0 C1'-O4'-C4' 106.427 -2.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.485 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.912 0 C4'-C3'-C2' 104.755 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.627 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.941 0 C4'-C3'-C2' 104.619 1.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.546 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.566 0 C3'-C2'-C1' 105.209 1.792 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.922 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C3'-C2'-C1' 100.703 -1.426 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.922 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 C1'-O4'-C4' 110.61 0.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.424 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.527 0.865 0 C3'-C2'-C1' 105.327 1.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.437 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-C2' 106.877 0.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.437 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 C4'-C3'-C2' 104.41 1.21 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 C4'-C3'-C2' 100.937 -2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.577 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.872 0 O4'-C1'-N19 109.12 1.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.577 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 P--O3' 1.614 0.553 0 C4'-C3'-C2' 104.337 1.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.735 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C3'-C2'-C1' 102.101 -0.428 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.749 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C4'-C3'-C2' 102.362 -0.838 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.749 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -1.013 0 C4'-C3'-C2' 104.752 1.552 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.638 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C5'-C4'-O4' 108.492 -0.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.59 ' N7 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C3'-C2'-C1' 104.252 1.108 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.512 -0.623 0 C4'-C3'-C2' 104.006 0.806 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.494 ' C5 ' ' C5 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.811 0 C4'-C3'-C2' 104.66 1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.494 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.967 0 C1'-O4'-C4' 107.306 -1.71 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.636 0 C4'-C3'-C2' 104.07 0.87 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 O4'-C1'-C2' 105.218 -0.802 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.576 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 O4'-C4'-C3' 105.968 0.368 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.492 ' O ' ' HD2' ' A' ' 2' ' ' LYS . 30.7 mtt . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 120.038 -0.029 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.579 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 1.7 mmmt -143.35 174.84 10.38 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 123.425 0.453 . . . . 0.0 110.598 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.715 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -119.28 107.64 13.64 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.312 0.577 . . . . 0.0 111.796 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.893 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.94 109.79 14.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.534 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.909 HD13 HG13 ' B' ' 107' ' ' VAL . 0.0 OUTLIER -121.28 112.93 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 177.396 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.787 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.0 OUTLIER -123.46 132.92 54.08 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.84 -177.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.834 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.41 112.27 32.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 176.928 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.402 HG23 ' NH1' ' B' ' 104' ' ' ARG . 6.5 p -67.06 92.76 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.623 -0.673 . . . . 0.0 110.07 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.813 HG11 ' CB ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -97.64 -155.13 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.404 -178.235 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 24.7 t0 113.22 5.27 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.597 1.159 . . . . 0.0 108.837 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.7 t -152.18 -38.8 0.11 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.756 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.726 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -73.3 32.64 0.07 Allowed 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -177.306 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER 70.71 1.71 3.83 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 120.692 -1.255 . . . . 0.0 113.856 178.202 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.034 ' CZ ' HG21 ' B' ' 105' ' ' ILE . 0.7 OUTLIER -55.92 -53.6 54.88 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.919 0.39 . . . . 0.0 110.919 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.622 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 3.0 mp0 -49.91 -41.55 46.21 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -177.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.726 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -51.08 -29.71 13.88 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.836 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.94 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.65 -59.8 2.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.466 0.651 . . . . 0.0 110.919 178.2 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 4.4 pttt -63.63 -25.91 68.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.799 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.464 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.25 -25.64 34.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.098 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.61 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 21.0 m-85 -88.32 -50.24 6.46 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.565 178.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.61 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 19.7 t0 143.34 50.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.216 0.947 . . . . 0.0 110.166 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 22' ' ' VAL . 1.4 p -176.05 96.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.738 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -60.83 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.109 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.974 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -146.38 5.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.444 ' HB3' ' P ' ' D' ' 190' ' ' ' DG' . 36.2 p -39.11 -62.99 0.58 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.455 -177.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.18 -30.04 32.12 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.098 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.816 HD23 HG23 ' A' ' 24' ' ' ILE . 22.0 tp -60.56 -56.3 22.95 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.193 0.197 . . . . 0.0 111.28 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.992 HG22 HG21 ' B' ' 124' ' ' ILE . 3.1 t -53.96 -64.43 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.439 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.687 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.75 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 10.8 p -49.73 -42.19 45.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.411 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.11 -46.15 52.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.436 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.784 ' HB ' HD21 ' B' ' 127' ' ' LEU . 22.9 m -63.21 -36.13 82.63 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.981 179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' MET . . . . . 1.071 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -54.57 -47.86 72.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.184 179.071 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.5 -36.85 76.84 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 120.475 0.179 . . . . 0.0 111.182 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.43 -44.8 50.21 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.767 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.2 tp10 -69.86 -26.63 64.3 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.045 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.764 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.34 -44.72 64.54 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -55.55 11.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.509 0.671 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -82.08 -40.84 21.38 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 114.668 -1.151 . . . . 0.0 114.046 -176.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.571 HD11 ' CD2' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 48.58 -174.8 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -178.772 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.05 177.25 0.06 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.79 -179.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -76.71 164.6 25.72 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.004 0.43 . . . . 0.0 112.033 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.47 ' O ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -105.97 -176.04 2.96 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.132 0.492 . . . . 0.0 112.154 -179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.47 ' HD2' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -134.91 -164.67 1.55 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.361 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -137.97 163.88 30.42 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 120.751 0.31 . . . . 0.0 111.554 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -170.37 165.97 8.66 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.395 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.498 HG22 ' H ' ' A' ' 47' ' ' GLU . 2.0 p -109.6 170.66 2.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.169 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.732 ' OE2' ' H71' ' C' ' 176' ' ' ' DT' . 0.0 OUTLIER -159.94 159.58 32.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.135 0.493 . . . . 0.0 112.116 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 23.7 t-20 170.41 154.37 0.05 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.89 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 176.02 151.08 0.14 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.107 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -124.4 148.92 47.25 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.812 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -164.92 128.31 1.77 Allowed Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.436 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.12 59.08 0.52 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.26 0.553 . . . . 0.0 110.827 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.629 HG11 H5'' ' D' ' 193' ' ' ' DT' . 9.4 p -69.81 120.7 17.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.881 -179.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.3 77.35 1.85 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.273 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.603 HG13 ' H ' ' A' ' 56' ' ' ALA . 7.5 p -86.27 -117.28 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.051 -179.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.603 ' H ' HG13 ' A' ' 55' ' ' VAL . . . 69.93 52.44 0.4 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.121 0.486 . . . . 0.0 111.415 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.11 166.25 16.48 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.558 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -178.98 97.55 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.489 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.567 HG22 ' N ' ' A' ' 60' ' ' GLU . 22.8 mm -149.8 -89.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.409 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.567 ' N ' HG22 ' A' ' 59' ' ' ILE . 4.1 tp10 -160.55 166.18 29.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.505 0.322 . . . . 0.0 110.411 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.5 -84.92 0.2 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 176.94 -175.37 0.13 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.932 0.396 . . . . 0.0 111.788 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -100.51 119.16 6.41 Favored Glycine 0 C--N 1.336 0.537 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.414 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 73.7 m -62.73 80.6 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.929 0.395 . . . . 0.0 112.026 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -140.63 98.27 3.37 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.873 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -146.13 101.92 3.57 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.681 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -76.43 -56.29 4.76 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.664 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 57.02 72.27 0.52 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.08 0.467 . . . . 0.0 111.465 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -85.98 -104.17 0.06 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.32 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.35 -36.57 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 74.81 -78.19 0.05 OUTLIER 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 114.452 -1.249 . . . . 0.0 111.52 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 34.2 m0 . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.666 179.539 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 120.729 0.3 . . . . 0.0 111.751 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.681 ' CG ' ' HB3' ' A' ' 47' ' ' GLU . 1.8 mmtp -152.86 123.96 7.51 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.007 0.432 . . . . 0.0 111.982 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.487 ' HG2' HG22 ' B' ' 105' ' ' ILE . 2.0 tt0 -113.54 110.6 20.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.965 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.711 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 11.8 ttm-85 -79.23 99.14 6.91 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.183 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 1.034 HG21 ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -104.82 112.29 37.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.587 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.787 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -107.33 125.1 50.75 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.447 -175.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.909 HG13 HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -99.33 93.3 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.576 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.893 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.3 p -66.31 67.64 0.05 Allowed 'General case' 0 CA--C 1.523 -0.079 0 CA-C-O 122.276 1.036 . . . . 0.0 109.526 -177.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.061 HG11 ' CB ' ' B' ' 114' ' ' TYR . 7.1 p -69.92 -127.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.848 -178.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.715 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 3.6 t70 83.44 -3.35 1.19 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.914 0.864 . . . . 0.0 109.082 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 38.0 m -127.06 -64.66 0.99 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.358 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.75 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.64 -85.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.712 0 O-C-N 123.696 0.623 . . . . 0.0 112.258 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.497 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.6 t 174.64 43.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.364 0.602 . . . . 0.0 110.881 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.061 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.4 OUTLIER -84.06 -42.27 16.31 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.57 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.42 -42.24 21.86 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -175.629 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.764 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -52.54 -49.79 64.18 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.996 0.816 . . . . 0.0 111.362 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.899 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.41 -48.98 78.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.819 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.571 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -71.27 -26.13 62.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.238 0.542 . . . . 0.0 110.529 179.534 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.16 -24.04 62.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.82 178.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.601 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 10.4 m-30 -87.98 -43.64 11.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.601 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 1.9 p-10 121.72 19.36 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.137 0 O-C-N 125.007 1.442 . . . . 0.0 111.81 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 79.2 t -101.7 -40.64 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.25 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.605 ' O ' HD12 ' B' ' 117' ' ' LEU . 5.3 m-80 61.54 -124.96 0.84 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.071 HG23 ' HE2' ' A' ' 32' ' ' MET . 0.3 OUTLIER -131.51 3.59 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.425 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.5 OUTLIER -39.43 -64.33 0.48 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.253 -178.444 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.426 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -87.23 -25.39 33.92 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.387 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.784 HD21 ' HB ' ' A' ' 31' ' ' THR . 6.1 tt -59.38 -61.44 2.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.188 0.518 . . . . 0.0 110.222 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.011 HG13 ' HE3' ' B' ' 132' ' ' MET . 3.4 t -50.67 -63.54 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.443 178.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.726 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 92.4 p -48.58 -46.9 39.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.438 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.6 OUTLIER -70.17 -48.01 59.14 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.689 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -65.02 -33.72 76.72 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.817 179.949 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.011 ' HE3' HG13 ' B' ' 128' ' ' VAL . 2.1 mmt -56.13 -52.92 62.62 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.187 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -58.16 -36.86 73.64 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.622 0.231 . . . . 0.0 111.622 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 134' ' ' ASN . . . . . 0.462 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.44 -51.05 13.95 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.774 ' HB3' HD21 ' A' ' 17' ' ' LEU . 12.0 tp10 -67.47 -24.46 65.6 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.965 -0.384 . . . . 0.0 109.965 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.726 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -69.41 -46.28 67.2 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -53.45 12.96 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.853 178.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.47 ' O ' ' C ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER -82.43 -17.8 44.11 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -175.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.597 HD12 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -2.85 95.9 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -179.218 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.49 151.74 19.12 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.205 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.17 63.29 0.7 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.892 0.377 . . . . 0.0 111.517 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 59.35 168.86 0.07 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.63 94.09 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.389 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 43.5 p-90 -170.1 170.21 7.56 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.774 0.321 . . . . 0.0 111.811 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.92 145.54 1.89 Allowed 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.734 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.8 p -125.18 144.2 36.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 120.847 0.356 . . . . 0.0 111.834 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -129.09 130.57 46.66 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -132.3 154.83 49.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.182 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -93.12 131.23 38.35 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.034 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -84.71 150.92 24.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.276 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -143.72 139.56 8.87 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.698 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 26.9 mmt -92.39 162.75 14.12 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.791 0.329 . . . . 0.0 111.269 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -133.89 -77.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.831 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.16 -159.71 0.73 Allowed 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 111.544 0.202 . . . . 0.0 111.544 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 4.5 t -108.43 -122.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.027 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -143.03 -49.52 0.33 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.93 128.54 33.59 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.63 0.253 . . . . 0.0 110.801 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.491 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -162.83 93.72 0.82 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.299 0.571 . . . . 0.0 111.668 -179.587 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 4.1 mt -91.26 -131.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.736 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -135.94 164.27 28.36 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.029 0.443 . . . . 0.0 111.386 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 2.1 ttp -150.77 -60.82 0.19 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.123 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.92 152.23 7.68 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.027 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 102.89 82.3 1.62 Allowed Glycine 0 C--N 1.333 0.386 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.568 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 164' ' ' SER . . . . . 0.475 ' O ' ' HB2' ' B' ' 165' ' ' PHE . 6.3 p -67.17 -48.49 67.81 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.475 ' HB2' ' O ' ' B' ' 164' ' ' SER . 39.8 m-85 71.04 172.61 0.31 Allowed 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.365 0.416 . . . . 0.0 111.541 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -157.02 173.94 16.26 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.51 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.78 77.1 0.86 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.219 0.533 . . . . 0.0 111.374 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.52 -174.8 5.37 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.76 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -153.62 168.3 26.65 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.87 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.427 ' HE3' ' HB3' ' B' ' 170' ' ' LYS . 7.7 mtpp -161.29 27.63 0.13 Allowed 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 25.42 83.98 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.81 -1.086 . . . . 0.0 112.952 -178.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.167 0 CA-C-O 118.546 -0.74 . . . . 0.0 111.134 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.442 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.709 0 C5'-C4'-O4' 108.649 -0.469 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.68 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C3'-C2'-C1' 101.685 -0.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.68 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C3'-C2'-C1' 104.47 1.264 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.732 ' H71' ' OE2' ' A' ' 47' ' ' GLU . . . . . . . . 0 C3'--C2' 1.528 0.985 0 C1'-O4'-C4' 107.331 -1.692 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.489 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.404 -1.245 0 C3'-C2'-C1' 105.151 1.751 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.556 ' H73' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O5'--C5' 1.431 -0.54 0 C4'-C3'-C2' 103.94 0.74 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.579 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 C3'-C2'-C1' 105.06 1.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.579 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 C3'-C2'-C1' 101.474 -0.876 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 C1'-O4'-C4' 110.48 0.557 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.551 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -1.009 0 C4'-C3'-C2' 104.689 1.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.551 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 C1'-O4'-C4' 110.421 0.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C1'-O4'-C4' 110.493 0.567 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C4'-C3'-C2' 100.97 -2.23 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.402 " C2'" " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 N19-C1'-C2' 115.639 0.9 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.402 " O5'" " C2'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C4'-C3'-C2' 104.676 1.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.461 ' P ' ' HD3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 O4'-C1'-C2' 107.411 1.192 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.495 H2'' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.411 -0.724 0 C4'-C3'-C2' 104.736 1.536 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.565 ' C8 ' ' C7 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.937 0 C1'-O4'-C4' 107.456 -1.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.565 ' C7 ' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.773 0 C1'-O4'-C4' 106.933 -1.976 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.603 H2'' " O5'" ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 106.856 2.968 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.629 H5'' HG11 ' A' ' 53' ' ' VAL . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 104.281 1.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.536 ' OP1' HG11 ' A' ' 55' ' ' VAL . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 C1'-O4'-C4' 110.711 0.722 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.493 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.954 0 C1'-O4'-C4' 107.251 -1.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.414 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.628 0 O4'-C1'-C2' 107.26 1.055 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.414 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.5 0.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C5'-C4'-O4' 108.809 -0.369 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.037 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -143.52 140.53 30.32 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.861 0.362 . . . . 0.0 110.45 178.862 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.64 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 43.2 tp60 -124.96 116.28 21.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.148 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.858 ' HG3' HG22 ' B' ' 108' ' ' THR . 2.0 ttm105 -79.11 114.3 17.94 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.668 0.747 . . . . 0.0 111.667 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.949 HD13 ' CD1' ' B' ' 114' ' ' TYR . 4.4 pt -114.62 128.91 71.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.717 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.56 131.73 41.82 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.285 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.715 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.22 103.45 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 106.914 -1.514 . . . . 0.0 106.914 174.208 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.655 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 9.7 p -70.36 69.08 0.37 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.715 0.769 . . . . 0.0 109.837 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.9 HG11 ' HB2' ' A' ' 14' ' ' TYR . 14.3 p -85.89 -135.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.384 -1.28 . . . . 0.0 111.468 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.782 ' H ' HG22 ' A' ' 9' ' ' VAL . 20.4 t70 108.39 20.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.171 0.986 . . . . 0.0 109.607 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.552 ' H ' HG22 ' A' ' 9' ' ' VAL . 4.3 t -160.7 -45.69 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.5 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.751 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -79.05 61.39 3.2 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 119.61 -0.836 . . . . 0.0 113.165 -177.317 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.534 ' HB2' ' O ' ' B' ' 129' ' ' SER . 3.7 m 68.19 -7.78 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 177.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.9 ' HB2' HG11 ' A' ' 9' ' ' VAL . 1.1 t80 -50.29 -57.61 7.48 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.674 1.125 . . . . 0.0 110.348 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.582 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 39.5 mt-30 -49.77 -38.81 35.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.878 -178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.79 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -51.32 -33.09 27.62 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.942 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.67 -52.55 8.79 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.245 0.545 . . . . 0.0 111.317 178.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.691 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -66.28 -25.5 66.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.388 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 -28.21 62.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.411 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.717 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 6.8 m-30 -88.29 -40.78 13.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.888 178.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.717 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 120.39 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 125.203 1.565 . . . . 0.0 109.496 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.8 t -141.71 -48.15 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.04 0 CA-C-N 114.421 -1.263 . . . . 0.0 111.068 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.406 ' OD1' ' HB3' ' A' ' 18' ' ' LYS . 18.3 m-80 67.39 -113.71 0.17 Allowed 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -178.313 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.053 HG23 ' HE2' ' B' ' 132' ' ' MET . 0.1 OUTLIER -143.04 -1.27 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 178.628 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.621 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 63.0 p -39.52 -64.9 0.43 Allowed 'General case' 0 C--O 1.245 0.853 0 CA-C-N 118.901 0.773 . . . . 0.0 110.468 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.537 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -79.0 -29.11 52.65 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.432 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.919 HD22 ' HG ' ' A' ' 17' ' ' LEU . 16.7 tp -62.41 -58.41 7.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.87 HG23 ' CG2' ' A' ' 24' ' ' ILE . 4.0 t -52.17 -71.39 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.396 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.81 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 93.7 p -47.37 -39.36 15.0 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.3 m -69.67 -48.0 61.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.251 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.3 m -65.34 -32.13 73.62 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.694 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.801 ' HE2' HG23 ' B' ' 124' ' ' ILE . 11.5 mmt -59.43 -57.42 13.04 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.959 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -55.56 -34.99 65.25 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.547 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -49.38 21.26 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 1.107 ' HB3' HD21 ' B' ' 117' ' ' LEU . 3.4 tp10 -72.15 -21.75 61.41 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.083 0.468 . . . . 0.0 109.776 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.612 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -70.38 -45.35 66.18 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.244 0.545 . . . . 0.0 109.628 178.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -55.02 5.12 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.883 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.17 -35.98 58.9 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.895 -1.048 . . . . 0.0 113.747 -176.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.668 HD23 ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER 28.6 50.56 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.599 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 171.39 107.17 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.622 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -133.37 148.81 51.85 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.181 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -74.84 -159.92 0.1 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.683 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -149.26 81.27 1.42 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.435 ' CE3' ' HA ' ' A' ' 44' ' ' TRP . 1.3 t-105 -112.18 162.78 15.08 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.852 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -88.57 -68.88 0.74 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.874 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.413 HG13 ' O ' ' A' ' 46' ' ' VAL . 7.4 p 32.1 76.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.14 0.576 . . . . 0.0 112.403 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -157.7 110.75 2.46 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.437 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 169.18 59.89 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.123 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -140.4 154.25 46.63 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.11 0.481 . . . . 0.0 111.79 -179.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.68 87.49 2.46 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.741 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.68 -131.67 4.26 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.749 -0.738 . . . . 0.0 113.283 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.51 ' HA ' ' O ' ' B' ' 142' ' ' GLU . 0.9 OUTLIER -151.19 141.78 22.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.486 0.184 . . . . 0.0 110.908 -179.759 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.594 HG21 HG23 ' B' ' 146' ' ' VAL . 0.6 OUTLIER 58.99 -157.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.71 -179.703 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.534 ' H ' HG12 ' A' ' 53' ' ' VAL . 1.0 OUTLIER -167.16 138.99 3.28 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 122.178 -0.326 . . . . 0.0 111.374 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.617 HG21 ' HB2' ' B' ' 147' ' ' GLU . 6.7 t -110.0 -6.04 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 66.22 101.51 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.28 133.92 50.23 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.822 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -177.94 104.38 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.133 0.492 . . . . 0.0 111.779 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.1 mt -91.96 -36.81 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.669 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 56.62 -102.21 0.15 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.77 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 76.06 150.57 0.11 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.072 0.463 . . . . 0.0 111.604 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -138.16 145.62 41.76 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.443 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -90.35 -107.78 1.33 Allowed Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.627 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.0 m -179.81 166.86 1.34 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.699 0.285 . . . . 0.0 111.405 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.2 t80 77.54 153.1 0.14 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.958 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -161.47 131.52 4.9 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.099 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -111.63 69.08 0.68 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.039 0.447 . . . . 0.0 111.821 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.24 -173.99 0.13 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.385 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.07 144.67 47.35 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.151 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.424 ' NZ ' ' O ' ' A' ' 72' ' ' TRP . 0.0 OUTLIER 177.34 39.75 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.562 0.696 . . . . 0.0 109.165 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 35.59 67.4 0.28 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.112 -1.403 . . . . 0.0 112.823 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.424 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 44.0 m95 . . . . . 0 C--O 1.252 1.214 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.863 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 N-CA-C 111.401 0.148 . . . . 0.0 111.401 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.42 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 7.4 mptt -97.23 160.82 14.11 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.733 0.302 . . . . 0.0 110.937 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.727 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 7.7 tt0 -97.22 108.87 21.69 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.237 0.542 . . . . 0.0 110.942 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.757 ' NH2' HG21 ' B' ' 106' ' ' THR . 0.3 OUTLIER -78.34 99.09 6.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.428 0.632 . . . . 0.0 110.163 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.863 HD11 HG11 ' B' ' 128' ' ' VAL . 3.9 pt -100.34 126.93 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.757 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -131.75 122.85 26.53 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -175.669 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.732 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.01 106.73 19.94 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.499 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.858 HG22 ' HG3' ' A' ' 4' ' ' ARG . 76.8 p -70.07 98.7 1.35 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.282 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.908 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.73 -124.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.85 -178.22 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.64 ' HB2' ' N ' ' A' ' 3' ' ' GLN . 26.0 t0 95.84 9.99 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 122.098 0.952 . . . . 0.0 108.845 -175.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.4 t -164.51 -43.13 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.985 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.829 ' HB2' HG12 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -68.47 52.58 0.08 Allowed 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.153 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.632 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.1 m 56.03 7.97 0.34 Allowed 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.949 ' CD1' HD13 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -63.99 -54.6 31.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.973 0.416 . . . . 0.0 111.491 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.578 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.95 -34.17 12.39 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.609 -176.421 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.609 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -52.15 -56.19 16.12 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.145 0.498 . . . . 0.0 110.781 178.857 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 1.107 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.5 OUTLIER -55.11 -50.85 68.18 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.031 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.606 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -71.85 -25.6 62.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.36 -179.386 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -58.1 -26.03 62.09 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.063 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.686 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 4.6 m-30 -88.27 -44.43 10.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.65 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.686 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.8 m-20 129.68 38.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.884 1.365 . . . . 0.0 111.284 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 91.0 t -122.74 -44.11 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.011 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.436 ' OD1' ' HE1' ' B' ' 114' ' ' TYR . 0.6 OUTLIER 61.55 -132.61 0.65 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 -178.253 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.016 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -134.07 8.48 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.744 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.516 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.9 OUTLIER -39.72 -63.99 0.53 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 120.235 -0.586 . . . . 0.0 109.944 -178.023 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.474 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.0 -30.78 13.4 Favored Glycine 0 C--O 1.225 -0.439 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.712 177.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.822 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -52.57 -61.11 2.49 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.638 0.375 . . . . 0.0 110.61 179.038 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.016 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.4 t -54.27 -64.35 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.544 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.751 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 4.9 p -49.22 -44.8 43.71 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.75 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.474 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -69.91 -53.72 16.67 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 121.767 -0.583 . . . . 0.0 109.843 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.5 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -57.9 -37.81 74.7 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.52 -179.63 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.053 ' HE2' HG23 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -49.19 -46.46 45.58 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.328 179.138 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -48.37 80.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.584 0.23 . . . . 0.0 111.35 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -58.14 -56.54 20.73 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.485 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.579 ' O ' HD12 ' B' ' 139' ' ' LEU . 1.7 mm-40 -59.98 -40.13 88.06 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.79 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -60.04 -44.33 94.73 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.605 178.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -56.51 7.7 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.315 0.579 . . . . 0.0 111.339 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' B' ' 140' ' ' ARG . 0.0 OUTLIER -68.05 -18.02 64.56 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.125 -177.39 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.713 HD13 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -54.8 75.6 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -179.548 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.479 ' N ' ' O ' ' B' ' 138' ' ' ARG . 0.2 OUTLIER -174.84 -59.29 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.417 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -179.68 154.87 0.62 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.966 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.51 ' O ' ' HA ' ' A' ' 52' ' ' MET . 0.4 OUTLIER -108.06 111.04 22.88 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.865 0.364 . . . . 0.0 111.22 -179.964 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.51 ' HB3' ' O ' ' A' ' 53' ' ' VAL . 0.0 OUTLIER 77.7 -161.6 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.37 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.481 ' CD1' ' HG2' ' B' ' 145' ' ' LYS . 0.1 OUTLIER -168.4 140.2 2.79 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -178.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.481 ' HG2' ' CD1' ' B' ' 144' ' ' TRP . 3.6 mmtp 73.01 96.1 0.07 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.995 179.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.594 HG23 HG21 ' A' ' 53' ' ' VAL . 8.7 p -102.94 127.43 56.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.052 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.617 ' HB2' HG21 ' A' ' 55' ' ' VAL . 1.0 OUTLIER -155.13 155.0 33.2 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.201 -179.601 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 178.39 101.63 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.703 0.287 . . . . 0.0 111.68 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -135.37 107.76 7.32 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.898 0.38 . . . . 0.0 111.162 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.16 170.81 15.96 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.756 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 167.86 158.61 12.21 Favored Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.425 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 1.6 mtm -145.89 166.07 27.05 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.734 0.302 . . . . 0.0 111.227 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 9.6 p -152.5 153.46 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.635 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -116.24 -171.5 2.01 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.09 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 2.9 t -117.47 -125.59 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.631 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -179.88 102.38 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.871 0.367 . . . . 0.0 111.454 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -98.21 130.07 44.95 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.212 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -178.05 105.35 0.05 OUTLIER 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.09 0.471 . . . . 0.0 110.735 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -105.73 -132.35 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.805 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -147.74 167.18 25.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 32.2 ttp -128.19 -48.22 1.33 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.331 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.3 -167.65 0.19 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.711 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 175.83 -176.79 47.6 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 120.692 -0.765 . . . . 0.0 113.129 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.2 m -178.17 162.45 1.58 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.624 0.25 . . . . 0.0 111.358 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -154.9 170.39 21.8 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.262 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -145.16 172.53 12.98 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.989 0.424 . . . . 0.0 111.595 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -97.73 -125.43 0.14 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.437 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -147.16 24.98 1.13 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 169' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' B' ' 170' ' ' LYS . 0.1 OUTLIER 56.01 -93.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 122.615 0.366 . . . . 0.0 111.962 179.533 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.489 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 0.1 OUTLIER 169.16 -30.28 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.423 0.63 . . . . 0.0 109.352 -179.654 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 15.7 m-20 76.66 -87.58 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.016 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 2.8 t-105 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.594 -0.717 . . . . 0.0 111.052 179.196 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.487 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-N19 108.193 0.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.667 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.494 0 C4'-C3'-C2' 102.52 -0.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.667 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.433 -0.443 0 C3'-C2'-C1' 104.512 1.294 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.655 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.742 0 C4'-C3'-C2' 104.293 1.093 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.516 ' OP1' ' HB2' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.427 -0.792 0 C3'-C2'-C1' 104.218 1.084 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.496 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.804 0 C4'-C3'-C2' 104.721 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.669 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.559 0 C3'-C2'-C1' 104.704 1.432 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.768 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 C3'-C2'-C1' 101.007 -1.209 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.768 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C1'-O4'-C4' 110.649 0.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.642 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.826 0 C3'-C2'-C1' 104.951 1.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.642 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 O4'-C1'-C2' 106.799 0.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.446 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.709 0 N19-C1'-C2' 115.065 0.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 C4'-C3'-C2' 100.896 -2.304 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 N19-C1'-C2' 115.347 0.717 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 C3'-C2'-C1' 105.227 1.805 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.486 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 C4'-C3'-C2' 102.637 -0.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.615 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C4'-C3' 103.822 -1.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.621 ' OP1' ' HA ' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.409 -0.852 0 C4'-C3'-C2' 104.607 1.407 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.709 ' H72' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.512 -0.657 0 C5'-C4'-O4' 108.316 -0.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.45 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.703 0 C3'-C2'-C1' 105.184 1.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.505 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 N19-C1'-C2' 115.525 0.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.877 0 C3'-C2'-C1' 105.148 1.748 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.894 0 C4'-C3'-C2' 104.552 1.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.647 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 O4'-C1'-C2' 107.037 0.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.647 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 N19-C1'-C2' 115.459 0.787 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 102.143 -0.398 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.828 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.473 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 11.1 mmtm -36.79 129.6 0.81 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.254 0.346 . . . . 0.0 111.509 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.4 tp60 -101.75 118.46 36.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.631 0.729 . . . . 0.0 112.087 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.931 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.39 101.03 7.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.94 -179.532 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.917 HD13 ' CD2' ' B' ' 114' ' ' TYR . 8.3 pt -104.52 128.79 57.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.788 HG21 ' CZ ' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -131.56 124.59 30.35 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.882 -177.273 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.925 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -101.25 105.0 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 174.792 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.469 ' OG1' ' C6 ' ' C' ' 176' ' ' ' DT' . 9.9 p -69.14 87.77 0.41 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -178.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.925 HG22 HG22 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -86.78 -139.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.16 -178.605 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.67 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 2.4 t70 87.22 -5.15 0.64 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -175.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.53 -67.7 0.94 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.117 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.848 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 1.1 m-20 -49.55 -87.45 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m -177.43 42.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.174 0.897 . . . . 0.0 111.751 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.982 ' CD1' HD13 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -82.53 -44.56 15.76 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.664 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.67 -40.39 39.71 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -176.27 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.735 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -57.09 -54.0 51.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.736 0.698 . . . . 0.0 111.995 -179.503 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.881 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -49.54 -48.06 48.6 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.282 0.563 . . . . 0.0 111.387 -178.871 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.664 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.13 -30.41 43.68 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.045 179.274 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -63.78 -27.43 69.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.175 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.097 ' CB ' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.69 -44.77 10.93 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-O 118.765 -0.636 . . . . 0.0 109.399 178.816 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.604 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 157.28 16.46 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 177.028 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.515 ' O ' HD12 ' A' ' 17' ' ' LEU . 70.9 t -156.85 90.37 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 118.265 0.484 . . . . 0.0 111.973 -177.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.578 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 1.3 p30 -56.78 -100.1 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.013 HG23 ' HE2' ' B' ' 132' ' ' MET . 0.3 OUTLIER -139.97 1.26 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.537 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 88.0 p -41.89 -65.26 0.47 Allowed 'General case' 0 C--O 1.239 0.519 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.866 -178.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.93 -25.88 43.54 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.813 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.746 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -62.17 -59.41 5.08 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.945 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -52.77 -66.25 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.713 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.779 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 18.1 p -48.74 -35.59 14.51 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.5 m -72.88 -56.26 5.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 28' ' ' VAL . 3.1 t -58.74 -36.64 74.67 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.126 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' MET . . . . . 1.092 ' SD ' HD12 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -55.53 -55.37 32.65 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.641 178.775 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -56.19 -53.49 56.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.589 0.233 . . . . 0.0 110.782 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -57.69 -46.91 83.69 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB3' HD11 ' B' ' 117' ' ' LEU . 3.2 tp10 -70.23 -19.89 63.12 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.353 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.738 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -77.38 -44.48 29.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -54.74 7.61 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.564 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.33 -36.46 24.39 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.741 -176.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.535 HD21 HG11 ' B' ' 122' ' ' VAL . 0.3 OUTLIER 36.46 46.92 0.46 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.812 0.445 . . . . 0.0 112.178 -178.366 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -177.69 48.86 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.046 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -77.8 153.16 33.09 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.055 0.455 . . . . 0.0 112.018 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -93.37 173.32 7.77 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.686 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.73 122.66 48.41 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.657 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -99.94 164.57 11.95 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.803 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.88 135.58 26.18 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.888 0.375 . . . . 0.0 111.654 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.493 ' H ' ' HG3' ' B' ' 137' ' ' ARG . 12.5 t -153.79 154.35 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.551 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -61.91 151.93 33.38 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.593 0.235 . . . . 0.0 110.658 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -74.62 -80.1 0.08 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.46 -179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.526 ' O ' ' HB3' ' B' ' 141' ' ' ALA . 0.0 OUTLIER 56.3 86.94 0.06 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -100.17 128.76 46.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.189 0.518 . . . . 0.0 111.652 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.53 -167.12 24.88 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.859 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.577 ' O ' ' HB ' ' A' ' 53' ' ' VAL . 0.7 OUTLIER -125.66 -72.82 0.65 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.557 0.178 . . . . 0.0 111.156 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.577 ' HB ' ' O ' ' A' ' 52' ' ' MET . 14.6 p 165.3 151.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 120.964 0.411 . . . . 0.0 111.622 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.424 ' HB3' ' CE3' ' B' ' 144' ' ' TRP . 8.7 pt-20 -122.77 139.32 54.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.662 178.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.0 t -135.16 -122.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 121.227 -0.189 . . . . 0.0 111.466 -178.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 67.85 73.57 0.31 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.109 0.48 . . . . 0.0 111.645 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.52 139.93 33.36 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.173 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -159.11 97.84 1.41 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.6 0.714 . . . . 0.0 110.818 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 27.8 mm -141.81 82.83 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.106 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -135.52 65.92 1.53 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.833 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 12.4 ptm -159.77 167.63 27.79 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.504 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 76.9 165.96 0.25 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.693 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -148.72 -134.54 2.41 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.819 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.5 t -173.43 -161.73 0.14 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.659 0.229 . . . . 0.0 111.44 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 71.07 -179.49 0.23 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.725 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -132.26 36.7 3.6 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.792 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.39 72.53 10.22 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.085 0.469 . . . . 0.0 110.181 179.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 64.87 -171.05 0.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.348 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.443 ' O ' ' HB3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -175.12 -87.33 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER 176.43 -31.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.196 0.522 . . . . 0.0 109.896 -179.33 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 85.2 -53.9 0.09 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.572 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.6 m0 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.262 179.767 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.483 ' O ' ' C ' ' B' ' 102' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 111.381 0.141 . . . . 0.0 111.381 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.483 ' C ' ' O ' ' B' ' 101' ' ' MET . 0.0 OUTLIER -7.56 100.22 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -179.502 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.67 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 17.1 tt0 -98.41 115.18 27.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.799 178.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.788 ' CZ ' HG21 ' A' ' 6' ' ' THR . 28.7 ttt-85 -77.52 101.93 6.7 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.226 -0.589 . . . . 0.0 110.461 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.982 HD13 ' CD1' ' A' ' 14' ' ' TYR . 1.8 pt -102.62 130.21 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.657 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.77 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.4 OUTLIER -131.26 121.59 25.04 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.056 -0.657 . . . . 0.0 111.823 -176.954 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.67 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.8 OUTLIER -101.28 91.59 2.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.085 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 176.127 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.931 HG22 ' HG3' ' A' ' 4' ' ' ARG . 31.9 p -60.85 90.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.505 0.669 . . . . 0.0 110.385 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.018 HG21 ' CD1' ' B' ' 114' ' ' TYR . 31.6 m -87.5 -148.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.885 -177.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 23.7 t70 96.04 -10.33 0.09 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.371 1.069 . . . . 0.0 108.342 -176.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.417 ' HG ' ' HZ2' ' A' ' 2' ' ' LYS . 58.4 m -118.15 -62.9 1.49 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.779 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.4 OUTLIER -42.03 -92.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.662 0.601 . . . . 0.0 112.34 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.48 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.2 m -180.0 41.18 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.724 -0.61 . . . . 0.0 110.765 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.018 ' CD1' HG21 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -83.04 -45.2 14.32 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.617 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.7 mp0 -49.18 -45.27 43.83 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.738 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -51.8 -28.02 14.22 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.759 0.709 . . . . 0.0 112.356 -179.914 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 1.092 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.6 OUTLIER -78.33 -57.25 3.88 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 120.113 -0.635 . . . . 0.0 111.329 178.111 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -62.36 -25.43 67.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.337 178.979 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.39 -27.06 34.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.004 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.62 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.5 m-30 -88.18 -49.56 6.93 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.644 178.343 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.9 m-20 139.4 46.14 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 O-C-N 124.407 1.067 . . . . 0.0 110.675 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.743 HG13 ' O ' ' B' ' 122' ' ' VAL . 4.0 p -163.14 89.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.725 0.774 . . . . 0.0 110.783 -178.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.725 ' O ' ' HE1' ' A' ' 32' ' ' MET . 74.6 m-80 -58.41 -98.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.722 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.091 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -152.55 9.73 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.546 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 2.1 p -39.59 -64.7 0.45 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.144 -177.085 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.609 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.13 -28.5 20.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.705 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -55.48 -61.43 2.35 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.485 0.314 . . . . 0.0 110.783 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.091 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -53.59 -62.7 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.602 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.808 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.848 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 2.3 p -50.13 -43.69 51.99 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.609 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.5 OUTLIER -70.16 -50.27 42.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.457 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.442 ' N ' ' CG2' ' B' ' 130' ' ' THR . 54.8 m -55.9 -43.46 77.29 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.51 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.013 ' HE2' HG23 ' A' ' 24' ' ' ILE . 4.6 mtt -61.08 -57.63 11.74 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.897 178.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -40.39 37.21 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.067 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -56.04 12.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.242 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.566 ' HB2' HD21 ' A' ' 17' ' ' LEU . 14.0 mm-40 -69.41 -13.45 62.37 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.544 0.211 . . . . 0.0 111.293 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.735 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -86.49 -38.18 17.52 Favored 'General case' 0 C--O 1.227 -0.1 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.493 ' HG3' ' H ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -72.75 -47.61 45.4 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.506 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.3 ttp85 -55.83 -29.47 59.87 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.075 -1.42 . . . . 0.0 110.613 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.097 HD11 ' CB ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -35.81 96.06 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.8 0.84 . . . . 0.0 111.521 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.2 123.68 24.14 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -178.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 49' ' ' GLN . . . -164.5 -174.14 3.33 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.438 ' HA ' ' NE2' ' A' ' 49' ' ' GLN . 0.4 OUTLIER -135.99 -98.92 0.22 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -179.407 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.409 ' NE ' ' OE1' ' A' ' 49' ' ' GLN . 9.1 mtm180 -162.19 126.28 3.17 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.493 0.187 . . . . 0.0 111.366 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.424 ' CE3' ' HB3' ' A' ' 54' ' ' GLU . 2.5 t90 69.7 132.3 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.704 179.538 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.503 ' HG3' ' HB2' ' A' ' 52' ' ' MET . 0.2 OUTLIER -161.31 116.58 2.09 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -152.34 154.79 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.804 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.54 173.9 14.14 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.969 0.414 . . . . 0.0 112.041 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.5 105.71 1.28 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.689 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.8 pm0 -102.95 138.29 40.02 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.683 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -149.6 164.8 34.15 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.185 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 152.57 126.55 1.2 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 120.838 -0.696 . . . . 0.0 113.104 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.7 ttt -153.28 134.12 13.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.512 0.196 . . . . 0.0 111.096 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 32.7 t -141.94 140.22 30.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.784 0.326 . . . . 0.0 111.505 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -153.91 154.35 33.7 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.971 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.524 ' O ' ' HB2' ' B' ' 156' ' ' ALA . 3.3 t -131.4 -125.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 116.741 -0.209 . . . . 0.0 110.764 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' B' ' 155' ' ' VAL . . . 168.68 105.99 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 122.73 0.412 . . . . 0.0 111.253 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -90.56 153.65 20.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.221 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -164.22 98.42 0.82 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.29 0.567 . . . . 0.0 111.271 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 9.9 mm -120.87 95.31 3.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.428 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -134.71 167.06 21.53 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.072 0.463 . . . . 0.0 111.985 -179.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 20.1 ttp -148.8 -53.63 0.18 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.026 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 70.92 -178.65 0.22 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.915 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 156.74 165.06 14.22 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.574 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.4 t -155.19 148.36 24.79 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.812 0.339 . . . . 0.0 111.684 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -171.85 143.5 1.64 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.876 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -153.07 117.95 5.08 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.347 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -72.6 -53.13 12.72 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.344 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 55.32 36.31 26.79 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.038 0.447 . . . . 0.0 111.565 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -115.12 121.66 43.73 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.483 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.467 ' NZ ' ' O ' ' B' ' 172' ' ' TRP . 10.2 tptt -167.34 -39.12 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 9.1 t70 79.74 -68.69 0.12 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.326 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.467 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.267 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.008 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 C5'-C4'-O4' 108.701 -0.437 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.576 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C3'-C2'-C1' 101.346 -0.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.576 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 C3'-C2'-C1' 104.232 1.094 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.47 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.802 0 C3'-C2'-C1' 104.914 1.582 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.546 ' P ' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 C3'-C2'-C1' 105.11 1.721 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.535 ' C7 ' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.776 0 C4'-C3'-C2' 104.69 1.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.721 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 C3'-C2'-C1' 104.221 1.086 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.613 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 C3'-C2'-C1' 100.826 -1.339 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.43 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C1'-O4'-C4' 110.903 0.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.54 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 105.488 1.991 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.54 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-C2' 107.2 1.0 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.504 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C1'-O4'-C4' 110.388 0.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C4'-C3'-C2' 100.878 -2.322 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.458 H2'' ' OP1' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 O4'-C1'-C2' 107.289 1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.458 ' OP1' H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 OP1-P-O3' 110.545 0.983 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.495 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.755 0 C4'-C3'-C2' 102.119 -1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.765 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.43 0.79 0 O4'-C4'-C3' 103.99 -1.61 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.929 ' C8 ' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.921 0 C1'-O4'-C4' 107.727 -1.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.929 ' H72' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C4'-C3'-C2' 103.989 0.789 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.473 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 106.358 2.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.526 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 C1'-O4'-C4' 110.345 0.461 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.472 ' C5 ' ' C5 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 C4'-C3'-C2' 104.301 1.101 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.472 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.99 0 C1'-O4'-C4' 107.108 -1.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.484 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 104.412 1.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.882 0 O4'-C1'-C2' 104.749 -1.229 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.571 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C1'-O4'-C4' 110.333 0.452 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.611 ' HG3' ' HG2' ' A' ' 2' ' ' LYS . 9.6 ptm . . . . . 0 N--CA 1.498 1.93 0 CA-C-O 119.685 -0.198 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.611 ' HG2' ' HG3' ' A' ' 1' ' ' MET . 36.3 mmtt 79.88 174.41 0.14 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.485 0.314 . . . . 0.0 110.5 -179.343 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.621 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.5 OUTLIER -102.72 101.8 11.93 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.711 0.767 . . . . 0.0 112.07 -179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.89 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.2 ttp-105 -79.68 98.85 7.13 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.919 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 1.113 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -107.42 108.77 26.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.727 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.264 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.63 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -103.77 123.9 47.91 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.068 -176.33 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.691 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -100.63 105.83 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.397 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.2 p -70.23 90.63 0.69 Allowed 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.013 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.942 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.7 t -83.28 -134.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.494 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 26.8 t70 90.56 -5.79 0.3 Allowed 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.23 -58.56 0.59 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.27 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.734 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -43.65 -92.08 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.51 ' O ' ' HB2' ' B' ' 132' ' ' MET . 0.6 OUTLIER -179.02 37.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.388 0.995 . . . . 0.0 112.034 -179.396 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.942 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.76 -43.75 16.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.083 0.953 . . . . 0.0 112.56 179.472 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.626 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 38.6 mt-30 -50.05 -44.12 51.4 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.924 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.2 mt -48.1 -30.4 4.46 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.267 0.485 . . . . 0.0 112.291 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.8 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -78.26 -57.35 3.83 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.408 177.518 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.626 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -63.18 -25.49 68.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.842 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.428 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -26.31 33.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.335 178.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.922 ' CD2' HD22 ' B' ' 139' ' ' LEU . 9.6 m-30 -87.85 -40.62 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.557 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.3 t0 120.91 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 122.34 1.067 . . . . 0.0 111.086 177.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.7 ' CG1' HD12 ' A' ' 17' ' ' LEU . 8.1 p -151.49 92.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.852 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.888 ' O ' HD12 ' A' ' 24' ' ' ILE . 1.7 m120 -65.75 48.8 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.46 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.05 HG21 ' SD ' ' B' ' 132' ' ' MET . 1.3 pp 31.68 9.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.642 ' HA ' HG22 ' B' ' 107' ' ' VAL . 67.2 m -36.47 -63.06 0.42 Allowed 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.036 0.446 . . . . 0.0 111.252 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -17.38 70.27 Favored Glycine 0 C--N 1.335 0.493 0 CA-C-N 115.848 -0.614 . . . . 0.0 112.62 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.788 ' CB ' HG22 ' A' ' 24' ' ' ILE . 2.3 tm? -67.54 -61.21 2.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.749 HG22 HG22 ' B' ' 128' ' ' VAL . 87.2 t -45.02 -67.67 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.361 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.565 ' HA ' ' HG2' ' A' ' 32' ' ' MET . 1.2 p -48.43 -36.92 15.81 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.581 0.752 . . . . 0.0 112.396 178.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.6 m -68.54 -52.75 28.55 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.421 HG21 HG21 ' B' ' 131' ' ' THR . 15.7 m -55.95 -35.71 66.98 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.756 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.864 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 1.3 mmt -56.94 -55.03 39.91 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.983 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.533 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -56.09 -49.91 72.5 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.745 0.307 . . . . 0.0 111.259 179.844 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -59.6 -51.44 69.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.871 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.815 ' HB3' HD11 ' B' ' 117' ' ' LEU . 5.2 tp10 -74.13 -14.89 61.03 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.392 178.238 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.959 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -84.26 -32.7 24.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -52.03 13.31 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.772 0.796 . . . . 0.0 109.475 178.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.427 ' NE ' ' HB3' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -82.96 -40.21 20.36 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.506 -178.147 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.876 HD23 ' CD2' ' B' ' 120' ' ' TYR . 1.2 mp 46.46 61.49 2.74 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.233 0.613 . . . . 0.0 110.933 -178.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.427 ' HB3' ' NE ' ' A' ' 38' ' ' ARG . 0.1 OUTLIER 173.61 76.39 0.0 OUTLIER 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.88 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -142.56 130.39 21.65 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 112.039 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -143.93 132.17 21.91 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.173 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.543 ' O ' HG23 ' B' ' 130' ' ' THR . 1.4 ptm180 -172.08 115.56 0.35 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.554 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -146.63 125.53 12.73 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.883 0.373 . . . . 0.0 111.509 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.22 127.35 0.56 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.31 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.3 t 77.67 150.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 121.248 0.547 . . . . 0.0 111.904 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -142.42 -175.62 4.52 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.73 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.487 ' OD1' ' HG ' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -152.5 140.15 19.83 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 120.789 0.328 . . . . 0.0 111.325 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.542 ' O ' ' CB ' ' A' ' 50' ' ' GLU . 0.3 OUTLIER -95.16 -174.38 3.21 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.41 179.042 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.542 ' CB ' ' O ' ' A' ' 49' ' ' GLN . 1.1 pp20? 113.9 164.29 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.896 1.279 . . . . 0.0 112.008 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 170.9 154.59 9.75 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.951 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.68 -175.89 3.26 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.344 0.257 . . . . 0.0 110.907 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.7 m -134.32 134.02 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 120.795 0.331 . . . . 0.0 111.723 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -120.61 144.39 48.15 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.061 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.481 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 3.8 t -128.13 -123.87 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.017 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 55' ' ' VAL . . . 75.06 103.99 0.07 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.011 0.434 . . . . 0.0 111.449 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -101.6 138.4 38.64 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.88 0.371 . . . . 0.0 111.795 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -178.38 106.86 0.05 OUTLIER 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.763 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 35.1 mm -131.5 102.79 6.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.494 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.499 ' HB3' ' OP1' ' C' ' 182' ' ' ' DC' . 1.5 tt0 -139.66 122.17 16.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.715 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.53 156.66 46.41 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.372 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -102.34 177.04 4.98 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.38 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -94.51 -147.0 21.7 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.968 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 82.9 p -165.12 174.77 9.99 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.719 0.295 . . . . 0.0 111.028 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.34 151.76 35.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.035 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.9 145.74 44.42 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.414 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.79 -72.53 0.71 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 53.19 70.39 0.59 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.011 0.434 . . . . 0.0 111.727 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -104.71 179.4 4.28 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.194 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -162.1 -42.07 0.04 OUTLIER 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 69.73 -65.89 0.29 Allowed 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 113.92 -1.491 . . . . 0.0 112.015 178.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 2.4 m0 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.891 179.883 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.458 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.481 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 1.4 mmpt? 74.18 127.97 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 122.678 0.391 . . . . 0.0 110.868 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.774 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 4.5 tp60 -115.27 116.52 28.45 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.208 0.528 . . . . 0.0 110.648 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.453 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.02 111.08 14.86 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.083 -178.607 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.862 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -115.31 118.84 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 175.844 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.662 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -123.98 131.19 53.53 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 120.285 -0.566 . . . . 0.0 111.722 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.691 HG12 HG12 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -101.23 86.45 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.89 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 68.2 p -64.88 77.1 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 -179.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.723 HG11 ' HB2' ' B' ' 114' ' ' TYR . 7.2 p -108.92 -120.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.893 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.621 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 1.1 t70 94.47 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.963 1.363 . . . . 0.0 109.506 -176.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.672 ' H ' HG22 ' B' ' 109' ' ' VAL . 45.7 t -154.46 -52.45 0.09 Allowed 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 112.507 -2.133 . . . . 0.0 111.845 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.523 ' O ' ' HB2' ' A' ' 29' ' ' SER . 55.1 m-20 -75.33 54.14 0.7 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -177.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.533 ' OG ' ' HB2' ' A' ' 33' ' ' GLN . 2.4 m 70.48 -3.31 1.92 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.113 ' CE1' HG21 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -55.1 -53.92 49.75 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.482 0.583 . . . . 0.0 111.204 179.491 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.541 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 14.3 mt-30 -49.85 -42.79 48.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -177.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.959 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -52.09 -31.38 30.32 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.428 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.815 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -77.75 -53.69 7.23 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.603 179.403 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.6 -28.11 68.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.57 -29.87 66.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.213 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.876 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -88.5 -43.02 11.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.372 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.607 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 151.39 31.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 176.902 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 121' ' ' ASP . 74.5 t -162.37 97.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.407 0.146 . . . . 0.0 111.08 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.801 ' O ' ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.1 -83.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 178.09 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.023 HD11 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -165.2 3.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 178.543 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.712 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 7.0 p -38.24 -63.74 0.47 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.39 0.995 . . . . 0.0 111.19 -177.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -84.81 -29.47 29.0 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.195 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.712 HD22 HD22 ' B' ' 117' ' ' LEU . 14.2 tp -59.72 -59.87 4.75 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.956 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -50.97 -59.69 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.734 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.1 m -50.03 -40.32 44.53 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.543 HG23 ' O ' ' A' ' 43' ' ' ARG . 17.7 m -71.07 -53.01 16.18 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.364 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.536 HG22 ' HA ' ' B' ' 128' ' ' VAL . 4.9 t -59.6 -36.97 77.34 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.857 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.05 ' SD ' HG21 ' A' ' 24' ' ' ILE . 3.5 mmt -60.6 -58.3 9.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.892 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.487 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 1.8 tt0 -55.67 -39.99 71.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.445 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -49.63 55.74 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.311 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.478 ' HA ' ' OE1' ' B' ' 135' ' ' GLU . 3.7 mm-40 -69.87 -26.99 64.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.924 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -63.93 -48.17 77.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 176.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -53.92 49.0 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.276 -0.875 . . . . 0.0 108.833 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -38.5 60.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.289 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.922 HD22 ' CD2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -51.67 -22.32 3.35 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.286 178.908 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.547 ' HB2' ' O ' ' B' ' 139' ' ' LEU . 24.8 mmt85 86.85 111.92 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.595 0.758 . . . . 0.0 112.118 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -145.15 90.73 2.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.77 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -149.52 -69.09 0.21 Allowed 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.654 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.515 ' C ' ' HD3' ' B' ' 143' ' ' ARG . 0.0 OUTLIER 69.65 -59.85 0.49 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.499 -179.246 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.5 ' HB2' ' HD3' ' B' ' 143' ' ' ARG . 0.3 OUTLIER 173.99 -177.4 0.08 Allowed 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.679 0.276 . . . . 0.0 111.212 -179.48 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 79.98 139.95 0.07 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.132 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -154.83 -56.53 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.335 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.03 -152.46 0.16 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.75 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -125.74 145.81 50.03 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.617 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -66.9 169.47 8.1 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 120.923 0.392 . . . . 0.0 111.268 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 150' ' ' GLU . . . . . 0.435 ' HG2' ' N ' ' B' ' 151' ' ' GLY . 1.7 pm0 -64.98 -39.08 92.94 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.532 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 151' ' ' GLY . . . . . 0.435 ' N ' ' HG2' ' B' ' 150' ' ' GLU . . . 94.59 -93.66 1.68 Allowed Glycine 0 C--N 1.335 0.483 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.117 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.43 166.31 31.28 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.661 0.267 . . . . 0.0 111.318 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 66.6 t -142.06 120.22 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.486 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -62.18 122.02 14.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.409 ' O ' ' HB3' ' B' ' 156' ' ' ALA . 2.1 t -76.59 -3.69 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' B' ' 155' ' ' VAL . . . 70.8 29.57 3.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.653 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.86 112.08 13.08 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.08 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -118.5 28.62 8.22 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 111.663 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.478 HG22 ' N ' ' B' ' 160' ' ' GLU . 55.7 mt -145.02 -109.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.606 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 160' ' ' GLU . . . . . 0.478 ' N ' HG22 ' B' ' 159' ' ' ILE . 0.9 OUTLIER -168.2 159.98 11.29 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.917 0.389 . . . . 0.0 111.197 -179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 3.5 mtm -126.91 -52.56 1.43 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.32 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 174.9 70.73 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.75 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -114.54 70.3 0.25 Allowed Glycine 0 C--N 1.333 0.374 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.936 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 23.3 t -145.12 -164.45 1.94 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.771 0.319 . . . . 0.0 111.32 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -125.53 101.4 6.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.266 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -168.89 -78.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.889 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 62.1 -71.71 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 69.26 169.44 0.29 Allowed 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.185 0.517 . . . . 0.0 111.292 -179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 169' ' ' ASN . . . . . 0.602 ' O ' ' HB2' ' B' ' 170' ' ' LYS . 44.0 m-80 -131.51 -98.36 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' B' ' 169' ' ' ASN . 0.0 OUTLIER 163.35 -26.88 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.296 0.638 . . . . 0.0 109.424 178.69 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 13.7 t70 85.4 -58.21 0.08 Allowed 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.917 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.107 -0.949 . . . . 0.0 111.183 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.521 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C4'-C3' 106.148 0.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.521 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 C3'-C2'-C1' 101.539 -0.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.473 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 O4'-C1'-C2' 107.421 1.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.593 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.969 0 C1'-O4'-C4' 106.448 -2.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.712 ' P ' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O4'--C1' 1.406 -1.045 0 C3'-C2'-C1' 105.108 1.72 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.691 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C4'-C3'-C2' 104.401 1.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.814 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 106.845 2.961 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.814 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 C4'-C3'-C2' 102.471 -0.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.647 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-C2' 107.183 0.984 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.499 ' OP1' ' HB3' ' A' ' 60' ' ' GLU . . . . . . . . 0 O4'--C1' 1.409 -0.878 0 C3'-C2'-C1' 105.372 1.908 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.627 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O4'-C1'-C2' 107.274 1.067 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.627 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 C4'-C3'-C2' 104.073 0.873 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 C4'-C3'-C2' 100.929 -2.271 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.65 ' H72' ' C5 ' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 C1'-O4'-C4' 110.896 0.854 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.65 ' C5 ' ' H72' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 C4'-C3'-C2' 102.689 -0.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.639 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 O4'-C1'-C2' 107.291 1.083 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.639 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.594 0 C1'-O4'-C4' 110.428 0.52 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.561 ' OP2' ' HA ' ' B' ' 107' ' ' VAL . . . . . . . . 0 O4'--C1' 1.406 -1.056 0 C3'-C2'-C1' 104.868 1.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.551 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-C2' 107.25 1.045 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.472 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 107.372 1.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.434 ' C4 ' ' C5 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 O4'-C4'-C3' 106.285 0.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.457 ' C5 ' ' C5 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.802 0 C4'-C3'-C2' 104.715 1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.457 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.995 0 C1'-O4'-C4' 107.463 -1.598 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 C1'-O4'-C4' 110.874 0.839 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.796 0 C4'-C3'-C2' 104.26 1.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.418 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C1'-O4'-C4' 110.339 0.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 120.451 0.167 . . . . 0.0 111.396 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 10.0 mmtt -96.27 -173.7 2.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.857 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.483 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -110.41 106.38 15.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.1 ttm105 -78.62 102.32 7.91 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.247 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 1.106 HD13 ' CD2' ' B' ' 114' ' ' TYR . 4.5 pt -104.0 130.12 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.837 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.06 126.07 34.88 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.052 0.453 . . . . 0.0 111.681 -176.787 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.608 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -99.67 106.7 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.62 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' B' ' 102' ' ' LYS . 1.8 p -70.21 73.93 0.49 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.418 0.628 . . . . 0.0 109.388 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.054 HG21 ' HB3' ' A' ' 14' ' ' TYR . 7.3 p -76.85 -135.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.411 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.824 ' H ' HG22 ' A' ' 9' ' ' VAL . 16.0 t70 89.07 -7.31 0.44 Allowed 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.064 1.302 . . . . 0.0 108.964 -176.004 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 67.8 m -132.13 -54.77 0.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.404 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.762 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -46.14 -93.39 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.515 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.2 OUTLIER -178.32 38.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 118.964 0.802 . . . . 0.0 111.288 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.054 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.2 -41.85 17.95 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.318 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.7 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.6 mm100 -48.79 -40.6 29.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -173.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.901 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -57.58 -52.12 66.69 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 119.031 0.832 . . . . 0.0 112.141 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.096 HD22 ' HA ' ' B' ' 132' ' ' MET . 1.5 tp -61.66 -36.48 80.95 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 119.805 -0.758 . . . . 0.0 112.971 -177.214 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.7 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -79.89 -29.3 39.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.509 0.671 . . . . 0.0 110.737 177.71 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.495 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -75.19 -32.16 61.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.851 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.015 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -87.63 -41.92 13.06 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.655 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.622 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 165.42 12.36 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 176.973 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.435 HG23 ' C ' ' A' ' 21' ' ' ASP . 78.6 t -155.79 86.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 118.377 0.535 . . . . 0.0 111.354 -177.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.455 ' O ' ' CE ' ' B' ' 132' ' ' MET . 4.9 p30 -58.9 -95.1 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.116 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.81 -0.31 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 177.825 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.604 ' HB3' ' P ' ' D' ' 190' ' ' ' DG' . 73.7 p -41.38 -64.36 0.57 Allowed 'General case' 0 C--O 1.244 0.796 0 C-N-CA 119.126 -1.029 . . . . 0.0 109.22 -179.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.46 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.06 -29.0 24.11 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.121 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.644 ' CD1' HD23 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -56.06 -61.86 2.1 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 116.812 0.306 . . . . 0.0 110.81 179.518 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.116 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.5 t -52.33 -61.6 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.163 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.723 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.5 p -50.25 -48.62 54.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.46 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.11 -51.3 25.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.65 ' OG1' HG21 ' B' ' 131' ' ' THR . 2.6 m -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.311 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' MET . . . . . 1.017 ' HE2' HG23 ' B' ' 124' ' ' ILE . 16.7 mtt -61.65 -49.95 74.47 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.986 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.476 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.69 -43.58 80.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.334 0.515 . . . . 0.0 109.862 178.731 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.476 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -66.07 -48.06 72.21 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.238 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.651 ' HB3' ' CD2' ' B' ' 117' ' ' LEU . 3.9 tp10 -64.37 -30.05 71.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.887 177.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.623 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -69.47 -49.52 54.1 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 177.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.39 -51.47 66.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.736 0.779 . . . . 0.0 109.004 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.547 ' O ' ' HG3' ' A' ' 40' ' ' ARG . 2.0 mtm-85 -63.01 -58.35 7.6 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 113.918 -1.492 . . . . 0.0 111.406 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.798 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 15.1 64.87 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.555 1.142 . . . . 0.0 113.798 179.918 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.56 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER 158.43 60.88 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.898 0.879 . . . . 0.0 110.699 178.825 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.08 135.14 53.96 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.01 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -124.03 134.56 53.4 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.207 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.43 165.41 3.24 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.819 0.342 . . . . 0.0 111.638 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.504 ' CE3' ' HA ' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -104.39 -163.17 0.95 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.98 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.16 137.35 32.43 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.79 0.328 . . . . 0.0 111.472 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.0 p -167.07 142.12 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.517 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.12 162.89 0.18 Allowed 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.685 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -175.53 -68.69 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.478 ' HB3' ' NH1' ' B' ' 137' ' ' ARG . 5.5 mt-30 68.74 168.21 0.28 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.152 0.501 . . . . 0.0 111.575 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.19 177.1 7.93 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.806 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.442 ' O ' ' NH2' ' B' ' 137' ' ' ARG . . . 69.36 -168.74 45.07 Favored Glycine 0 C--N 1.335 0.503 0 CA-C-N 115.83 -0.623 . . . . 0.0 113.646 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.3 ttt -146.8 145.5 29.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.622 0.249 . . . . 0.0 110.793 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.48 ' CG1' ' HB2' ' B' ' 142' ' ' GLU . 48.5 t -123.27 146.77 28.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.335 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.5 -179.27 7.12 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.16 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 1.077 ' HA ' ' HB3' ' B' ' 141' ' ' ALA . 11.5 t -105.25 -120.5 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.876 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.899 ' HB1' ' CD1' ' B' ' 144' ' ' TRP . . . 79.81 -57.53 0.37 Allowed 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.0 0.52 . . . . 0.0 112.203 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.781 ' O ' ' HB1' ' B' ' 141' ' ' ALA . 0.0 OUTLIER -143.82 -152.86 0.44 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.089 -179.455 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.578 ' O ' HD13 ' A' ' 59' ' ' ILE . 2.3 t80 179.45 56.62 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.384 0.611 . . . . 0.0 110.409 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.578 HD13 ' O ' ' A' ' 58' ' ' PHE . 22.7 mm -130.32 52.81 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.628 -179.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 55.28 156.95 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.001 1.111 . . . . 0.0 114.001 178.297 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 11.3 tpt 71.03 147.09 0.07 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.057 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.564 ' HA ' ' HG3' ' B' ' 142' ' ' GLU . 21.5 m-80 -82.49 149.68 27.42 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.418 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -93.28 174.52 35.36 Favored Glycine 0 C--N 1.333 0.387 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.906 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 17.1 t -166.23 130.92 2.22 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.631 0.253 . . . . 0.0 111.157 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.599 ' O ' ' HB3' ' A' ' 66' ' ' ALA . 0.2 OUTLIER 67.36 -179.03 0.21 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.678 179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' A' ' 65' ' ' PHE . . . 98.54 127.86 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.416 0.686 . . . . 0.0 111.982 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.29 -59.19 0.17 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.094 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -143.45 -178.75 6.03 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.428 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -150.18 -75.22 0.16 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.936 -0.12 . . . . 0.0 111.27 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -177.37 -33.58 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.321 0.581 . . . . 0.0 109.7 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.436 ' HB3' ' O ' ' A' ' 70' ' ' LYS . 23.8 t70 74.26 -67.64 0.25 Allowed 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.154 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.972 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.723 0 N-CA-C 111.35 0.13 . . . . 0.0 111.35 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.575 ' HE3' ' HA ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -48.06 151.85 0.9 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.87 0.367 . . . . 0.0 111.122 179.52 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.575 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 4.9 tp60 -100.5 110.02 22.17 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.532 0.682 . . . . 0.0 111.111 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.639 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 0.1 OUTLIER -79.4 101.48 8.17 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.362 -178.897 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.809 HD13 ' CD2' ' A' ' 14' ' ' TYR . 5.5 pt -108.0 122.53 62.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.837 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.0 125.0 32.15 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.966 -178.176 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.61 HG13 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -100.75 101.8 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.949 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.839 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.1 p -66.81 86.23 0.12 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.384 0.611 . . . . 0.0 110.83 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.036 HG21 ' CD1' ' B' ' 114' ' ' TYR . 28.6 m -81.71 -141.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.849 -178.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.691 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.8 t70 93.1 -7.24 0.15 Allowed 'General case' 0 C--N 1.356 0.86 0 CA-C-O 121.97 0.89 . . . . 0.0 108.757 -176.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.04 -58.16 1.01 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.283 177.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.723 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.07 -89.69 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.395 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.8 m 179.91 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.266 0.939 . . . . 0.0 112.03 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.106 ' CD2' HD13 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -82.7 -40.8 20.12 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.742 0.817 . . . . 0.0 113.18 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.662 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 3.8 mt-30 -48.84 -42.03 34.98 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -175.082 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.623 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -58.42 -45.95 87.43 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.015 1.28 . . . . 0.0 112.091 -179.383 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.924 HD23 ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -55.39 -45.63 76.61 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.532 0.682 . . . . 0.0 111.132 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.662 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.18 -34.37 43.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 179.98 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.52 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -60.3 -28.45 68.12 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.701 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.798 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.32 -45.34 10.1 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.52 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.5 m-20 147.63 41.82 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 176.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.448 ' HB ' ' CD1' ' B' ' 117' ' ' LEU . 24.6 t -150.87 -37.92 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' B' ' 122' ' ' VAL . 17.0 m-80 64.26 -112.16 0.31 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.05 HG21 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.5 -0.99 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 179.169 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.449 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.1 OUTLIER -40.01 -64.39 0.5 Allowed 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.769 -178.706 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.22 -31.48 16.78 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.01 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.613 HD12 ' HG ' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.07 -61.18 2.39 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.562 0.345 . . . . 0.0 110.143 178.673 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.991 HG22 HG21 ' A' ' 24' ' ' ILE . 2.4 t -52.58 -61.31 0.82 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.121 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.762 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 28.8 t -48.92 -45.21 41.18 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -71.93 -51.42 22.23 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.65 HG21 ' OG1' ' A' ' 31' ' ' THR . 21.0 m -58.58 -47.81 83.03 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.027 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.096 ' HA ' HD22 ' A' ' 17' ' ' LEU . 5.5 mmt -56.25 -57.75 10.89 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.131 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.447 ' HA ' ' HB3' ' B' ' 136' ' ' ALA . 42.0 tt0 -51.66 -37.52 50.82 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.485 0.183 . . . . 0.0 111.301 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -55.38 14.43 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.639 ' HB3' HD11 ' A' ' 17' ' ' LEU . 3.2 mt-10 -74.92 -9.69 58.78 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.736 0.303 . . . . 0.0 110.72 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.901 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.33 -29.62 21.43 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.478 ' NH1' ' HB3' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -82.13 -48.34 11.45 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 122.153 0.977 . . . . 0.0 109.027 178.127 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -57.11 -28.42 62.66 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.103 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.015 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -49.89 -21.0 1.02 Allowed 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.263 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.433 ' N ' HD12 ' B' ' 139' ' ' LEU . 5.8 ppt_? -42.91 119.13 1.41 Allowed 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 1.077 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . . . -135.37 -55.35 0.8 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.139 178.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.605 ' O ' ' HB2' ' B' ' 143' ' ' ARG . 5.7 tp10 63.24 169.74 0.15 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 177.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.605 ' HB2' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER 85.65 120.76 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.666 178.57 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.899 ' CD1' ' HB1' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -168.26 134.24 1.9 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.806 178.945 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.39 145.99 11.68 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 120.676 0.274 . . . . 0.0 111.399 -179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.8 p -107.18 160.34 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.466 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -99.91 151.3 21.46 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.982 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -169.37 161.37 9.89 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 120.757 0.313 . . . . 0.0 111.613 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -143.65 -72.7 0.28 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.716 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 68.64 -176.54 0.2 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.864 0.364 . . . . 0.0 111.591 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 144.79 46.99 0.04 OUTLIER Glycine 0 CA--C 1.523 0.536 0 C-N-CA 121.264 -0.493 . . . . 0.0 113.262 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 2.2 ttt -84.59 146.67 27.39 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.859 0.33 . . . . 0.0 111.2 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 5.0 p -155.8 160.71 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.61 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.42 -175.01 2.59 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.85 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' B' ' 156' ' ' ALA . 3.3 t -102.65 -124.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.834 -0.166 . . . . 0.0 110.777 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' B' ' 155' ' ' VAL . . . 174.79 104.72 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.894 0.378 . . . . 0.0 111.486 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.52 163.11 23.98 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.031 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -159.0 96.45 1.34 Allowed 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 121.149 0.499 . . . . 0.0 110.707 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 30.9 mm -138.47 104.09 2.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.484 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -93.26 160.36 14.86 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.18 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 7.2 ptt? -163.07 146.73 10.92 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.485 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -130.22 -63.31 0.9 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.317 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 103.58 -137.43 13.48 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.69 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 36.8 p -162.76 139.11 7.42 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.595 0.236 . . . . 0.0 111.069 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -122.05 124.04 43.03 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.2 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -161.45 128.8 4.06 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.397 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -162.7 115.51 1.64 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.167 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -130.61 150.49 51.78 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.029 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -166.6 176.47 7.24 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.898 0.38 . . . . 0.0 111.522 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.426 ' HE2' ' HB2' ' B' ' 170' ' ' LYS . 0.2 OUTLIER -166.94 -39.22 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 172' ' ' TRP . 2.0 t70 89.72 102.23 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.007 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.432 ' HB2' ' O ' ' B' ' 171' ' ' ASP . 64.0 m95 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.655 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.61 " H3'" ' H73' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 C3'-C2'-C1' 105.498 1.999 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.788 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 C4'-C3'-C2' 102.055 -1.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.788 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.528 0.497 0 O4'-C4'-C3' 104.511 -1.089 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.543 ' C6 ' H2'' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 C3'-C2'-C1' 104.906 1.576 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.56 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.923 0 C4'-C3'-C2' 104.753 1.553 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.783 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.914 0 C4'-C3'-C2' 104.551 1.351 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.619 " H2'" ' H72' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.511 0 C3'-C2'-C1' 105.089 1.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.619 ' H72' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.571 0 C3'-C2'-C1' 100.862 -1.313 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.577 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 O4'-C1'-C2' 107.245 1.041 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.678 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.754 0 C3'-C2'-C1' 105.265 1.832 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.678 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.559 0 O4'-C1'-C2' 107.104 0.912 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.507 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 N19-C1'-C2' 115.316 0.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 100.907 -2.293 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.662 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.406 -1.065 0 O4'-C1'-N19 109.166 1.707 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.662 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 P--O3' 1.616 0.73 0 O4'-C1'-C2' 107.345 1.132 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.742 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.735 0 C3'-C2'-C1' 104.484 1.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.742 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 O4'-C1'-C2' 107.089 0.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.604 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O5'--C5' 1.426 -0.901 0 C1'-O4'-C4' 106.327 -2.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.565 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 C2'--C1' 1.531 0.711 0 C3'-C2'-C1' 104.837 1.526 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.499 ' H62' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.647 0 C3'-C2'-C1' 106.382 2.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.639 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C1'-O4'-C4' 110.903 0.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.493 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 C1'-O4'-C4' 110.746 0.747 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.473 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 C1'-O4'-C4' 107.94 -1.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.56 ' C8 ' ' H72' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O4'-C1'-C2' 106.871 0.701 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.56 ' H72' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C5'-C4'-C3' 115.722 0.682 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 C1'-O4'-C4' 110.341 0.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.3 mtt . . . . . 0 N--CA 1.494 1.774 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.6 mtmm -105.0 177.16 4.93 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 123.065 0.228 . . . . 0.0 110.561 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.678 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -126.62 122.74 35.87 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.39 0.614 . . . . 0.0 112.488 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.92 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.72 111.46 14.85 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.697 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -111.75 122.91 66.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.435 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.717 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.04 128.8 41.02 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 119.99 -0.684 . . . . 0.0 112.641 -177.385 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.652 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.86 109.91 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 175.614 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.654 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 1.4 p -70.59 77.47 0.59 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.79 0.805 . . . . 0.0 109.392 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.888 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.9 p -92.51 -147.45 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-N 114.044 -1.435 . . . . 0.0 111.086 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.729 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 20.1 t70 106.7 13.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.477 1.132 . . . . 0.0 109.658 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -160.22 -40.3 0.05 Allowed 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.529 -1.668 . . . . 0.0 109.911 179.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.845 ' HB2' HG23 ' A' ' 9' ' ' VAL . 0.6 OUTLIER -69.81 35.11 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.53 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 28.7 m 72.18 4.08 4.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 177.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.001 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -58.0 -55.09 39.45 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.167 0.508 . . . . 0.0 111.959 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.551 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.6 mt-30 -49.74 -40.38 40.63 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -176.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.823 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -54.86 -32.49 60.8 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.917 HD22 HD22 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -77.35 -51.78 10.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.645 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.671 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -68.16 -26.09 65.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.398 0.618 . . . . 0.0 109.788 178.478 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -60.63 -30.61 69.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.749 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.954 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.4 OUTLIER -88.35 -44.32 10.87 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 118.677 -0.677 . . . . 0.0 110.041 178.704 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.597 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 160.4 24.22 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.533 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.662 ' O ' HD23 ' A' ' 17' ' ' LEU . 68.1 t -160.65 101.22 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.671 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 1.5 m120 -58.77 -82.92 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 106.287 -1.745 . . . . 0.0 106.287 177.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.872 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -161.04 -1.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.647 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.597 ' HB2' ' P ' ' D' ' 190' ' ' ' DG' . 0.5 OUTLIER -38.81 -62.87 0.57 Allowed 'General case' 0 C--O 1.241 0.617 0 CA-C-N 118.872 0.76 . . . . 0.0 109.686 -178.483 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.34 -33.44 31.89 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.802 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.917 HD22 HD22 ' A' ' 17' ' ' LEU . 26.5 tp -59.13 -60.93 3.07 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.031 0.416 . . . . 0.0 111.21 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.921 HG13 ' HE2' ' A' ' 32' ' ' MET . 3.2 t -48.91 -68.49 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 O-C-N 123.351 0.407 . . . . 0.0 109.995 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.712 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -47.16 -41.49 17.93 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.183 0.593 . . . . 0.0 112.561 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -69.94 -50.04 45.92 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.856 0.836 . . . . 0.0 108.981 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.758 HG22 HD11 ' B' ' 127' ' ' LEU . 8.1 m -63.77 -28.83 70.14 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.205 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.921 ' HE2' HG13 ' A' ' 28' ' ' VAL . 4.0 mmt -55.87 -47.42 77.39 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.649 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -56.42 -57.17 13.44 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.521 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 2.8 t-20 -50.65 -51.31 50.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.013 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 1.024 ' HG2' HD13 ' B' ' 127' ' ' LEU . 2.0 tp10 -68.57 -36.94 79.43 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.653 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -57.93 -42.95 85.92 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -52.13 18.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.17 178.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -52.93 -37.81 61.27 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.92 -177.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -25.86 89.85 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.192 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.431 ' HG3' ' N ' ' A' ' 41' ' ' ALA . 0.5 OUTLIER -168.85 179.73 4.04 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.118 -179.477 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.431 ' N ' ' HG3' ' A' ' 40' ' ' ARG . . . -90.88 -128.22 0.09 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.344 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.1 -165.3 0.17 Allowed 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -160.43 -47.33 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 63.83 51.6 2.34 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.184 0.516 . . . . 0.0 111.046 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.46 66.01 1.8 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.346 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.484 HG13 ' O ' ' A' ' 46' ' ' VAL . 7.3 p -140.16 107.23 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 120.99 0.424 . . . . 0.0 111.341 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -145.26 161.44 39.57 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.333 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.75 31.55 3.64 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.227 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -94.73 95.32 8.65 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.087 0.47 . . . . 0.0 111.335 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -135.82 -76.03 0.44 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.12 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -148.45 159.21 27.95 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 121.257 -0.496 . . . . 0.0 112.465 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.0 ttm -157.82 148.99 21.3 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.788 0.327 . . . . 0.0 111.411 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.657 HG13 HG23 ' A' ' 55' ' ' VAL . 6.3 p -69.99 144.89 13.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.871 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.43 93.7 0.35 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.204 0.526 . . . . 0.0 111.774 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.657 HG23 HG13 ' A' ' 53' ' ' VAL . 4.6 t -132.36 -124.53 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.736 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 39.7 79.05 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.3 mmm-85 -45.6 103.2 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.771 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.88 9.35 43.65 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.7 mm -81.92 67.17 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.17 0.509 . . . . 0.0 110.546 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -137.06 -151.56 0.4 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.962 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.437 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 1.6 mtp -133.38 147.35 51.78 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.816 0.341 . . . . 0.0 111.639 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 61' ' ' MET . 1.1 m120 74.86 149.91 0.11 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.406 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -150.63 57.37 0.45 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.919 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' B' ' 143' ' ' ARG . 20.9 t -98.49 -163.2 1.02 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.805 0.336 . . . . 0.0 111.456 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -138.9 127.38 23.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.602 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.789 ' HB1' ' HB2' ' B' ' 149' ' ' GLN . . . -166.81 146.95 5.72 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.854 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -85.25 125.68 33.08 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.174 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.436 ' OE1' ' NZ ' ' B' ' 145' ' ' LYS . 1.4 tp10 -74.57 150.28 39.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.954 0.406 . . . . 0.0 111.326 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.419 ' O ' ' HB3' ' A' ' 70' ' ' LYS . 74.0 m-80 -65.76 -66.52 0.54 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.16 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 0.1 OUTLIER 172.26 -31.22 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 87.49 139.91 0.05 OUTLIER 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.636 -1.165 . . . . 0.0 111.297 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.146 -0.93 . . . . 0.0 111.38 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.493 ' O ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 110.606 -0.146 . . . . 0.0 110.606 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.495 ' O ' ' NZ ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -111.25 96.42 6.11 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.941 0.401 . . . . 0.0 111.413 179.518 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.729 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.0 tp60 -98.3 109.73 22.44 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.468 0.652 . . . . 0.0 109.815 178.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.602 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 0.1 OUTLIER -78.83 99.82 6.89 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.283 -178.304 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.811 HD13 ' CD1' ' A' ' 14' ' ' TYR . 7.2 pt -102.41 123.41 55.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.717 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.6 OUTLIER -131.24 123.35 28.23 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.914 -177.518 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.619 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.05 96.82 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 175.464 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.92 HG22 ' HG3' ' A' ' 4' ' ' ARG . 67.3 p -68.79 94.31 0.6 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.291 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.727 HG21 ' HB2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -116.49 -108.78 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.401 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.678 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 2.4 t0 81.95 25.51 0.2 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 123.211 1.481 . . . . 0.0 107.844 -174.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.8 p -151.21 -57.77 0.16 Allowed 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 112.005 -2.362 . . . . 0.0 111.196 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.712 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 65.3 m-20 -72.87 59.14 0.48 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.56 ' O ' ' HB3' ' A' ' 32' ' ' MET . 64.8 m 60.68 2.65 0.52 Allowed 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.84 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -59.97 -49.91 75.82 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.473 0.654 . . . . 0.0 109.584 178.715 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.716 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -49.46 -39.56 33.79 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.66 -177.663 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.653 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -54.99 -45.62 75.07 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.134 0.879 . . . . 0.0 110.238 179.578 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.93 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.3 OUTLIER -56.51 -53.89 52.2 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.843 179.208 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.716 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 17.8 pttt -68.92 -25.29 64.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.537 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -55.66 -28.0 53.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.3 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.568 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 87.6 m-85 -87.92 -42.75 12.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 177.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.568 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.6 t70 118.27 61.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.648 178.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.918 ' CG1' HD12 ' B' ' 117' ' ' LEU . 3.2 p -151.62 -33.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.46 -178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.433 ' OD1' ' HB3' ' B' ' 118' ' ' LYS . 67.9 m-80 61.83 -123.38 0.78 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -178.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 0.884 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -137.28 9.93 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.598 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.55 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 91.9 p -38.84 -63.42 0.52 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.107 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.07 -34.64 14.19 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.681 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 1.024 HD13 ' HG2' ' A' ' 35' ' ' GLU . 34.0 tp -52.85 -61.64 2.16 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 117.33 0.565 . . . . 0.0 110.993 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.884 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.6 t -50.05 -63.86 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.251 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.835 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.81 -47.0 42.58 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 123.773 0.829 . . . . 0.0 112.916 178.085 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -65.46 -56.83 10.28 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.547 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -55.49 -40.48 71.77 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.835 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.001 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 31.6 mtt -58.94 -53.76 54.77 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.816 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.53 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -53.32 -45.14 68.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.438 0.563 . . . . 0.0 110.843 178.978 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -65.41 -56.95 9.69 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.085 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -64.22 -24.14 67.56 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.823 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -71.76 -49.42 39.14 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.045 0.45 . . . . 0.0 109.863 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -52.23 64.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.706 0.765 . . . . 0.0 109.83 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.574 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -62.25 -47.1 85.87 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.905 -178.373 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.954 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 17.29 82.92 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.029 0.831 . . . . 0.0 112.347 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.502 ' HD2' ' O ' ' B' ' 140' ' ' ARG . 0.0 OUTLIER -149.17 159.9 43.84 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.026 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -145.63 46.49 1.28 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.715 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.548 ' HG2' ' N ' ' B' ' 143' ' ' ARG . 0.7 OUTLIER -150.19 152.16 34.22 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.746 -179.384 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.548 ' N ' ' HG2' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -142.17 -165.07 1.94 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.673 0.273 . . . . 0.0 111.326 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.458 ' O ' ' HG2' ' B' ' 145' ' ' LYS . 40.4 t90 -132.22 93.61 3.3 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 120.805 0.336 . . . . 0.0 111.682 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 145' ' ' LYS . 3.5 mmmt -177.5 172.42 1.81 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.461 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.576 HG23 ' H ' ' B' ' 147' ' ' GLU . 0.8 OUTLIER -70.37 -94.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -179.391 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.576 ' H ' HG23 ' B' ' 146' ' ' VAL . 0.0 OUTLIER -104.6 171.06 7.53 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.976 0.417 . . . . 0.0 111.481 -179.7 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -81.24 122.3 27.23 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.188 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' GLN . . . . . 0.789 ' HB2' ' HB1' ' A' ' 66' ' ' ALA . 13.1 mm100 -135.78 59.27 1.72 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.776 179.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -116.15 110.27 18.6 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.776 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -139.43 57.83 0.61 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.801 -0.714 . . . . 0.0 113.253 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.3 mtt -144.79 117.76 8.82 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 120.759 0.314 . . . . 0.0 111.088 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 12.2 t -112.39 134.03 56.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.423 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -90.03 146.62 24.21 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.073 0.464 . . . . 0.0 111.466 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.507 ' O ' ' HB3' ' B' ' 156' ' ' ALA . 5.1 t -138.35 -122.17 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.155 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' B' ' 155' ' ' VAL . . . 77.49 106.81 0.08 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.291 0.567 . . . . 0.0 112.366 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 157' ' ' ARG . . . . . 0.568 ' HA ' HD11 ' B' ' 116' ' ' LEU . 0.4 OUTLIER -96.5 160.94 14.13 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.864 179.327 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.498 ' H ' HD21 ' B' ' 116' ' ' LEU . 0.2 OUTLIER -143.75 86.97 1.89 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.379 0.609 . . . . 0.0 111.028 179.414 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 10.1 mm -132.34 102.43 5.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.398 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.11 137.17 50.02 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.103 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 1.1 mmt -156.57 53.26 0.53 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.132 0.491 . . . . 0.0 111.143 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.62 86.06 1.19 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.435 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -114.13 -178.86 19.1 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.137 -0.554 . . . . 0.0 112.936 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 13.6 t -160.88 -179.53 7.64 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.859 0.361 . . . . 0.0 111.525 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -168.88 142.09 2.87 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.265 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 166' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' B' ' 167' ' ' ASP . . . -159.63 -75.71 0.07 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.397 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' B' ' 166' ' ' ALA . 1.0 OUTLIER 70.36 132.17 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.633 0.583 . . . . 0.0 111.66 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.51 -175.32 4.03 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.548 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -69.85 159.95 32.68 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.314 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.454 ' HB2' ' HE3' ' B' ' 170' ' ' LYS . 0.3 OUTLIER -163.95 -43.07 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.806 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 6.2 t70 83.12 88.15 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 113.962 -1.472 . . . . 0.0 111.181 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.769 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.734 " C3'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.448 1.309 0 C2'-C3'-O3' 115.14 1.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.734 H5'' " C3'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.849 0 C3'-C2'-C1' 106.084 2.417 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.653 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 O4'-C1'-N19 107.238 -0.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.654 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 C1'-O4'-C4' 107.386 -1.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.633 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C3'-C2'-C1' 105.005 1.646 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.633 ' H71' " H2'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.762 0 C4'-C3'-C2' 104.385 1.185 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.52 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.58 0 C3'-C2'-C1' 105.123 1.731 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.52 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 C3'-C2'-C1' 100.924 -1.269 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.449 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 O4'-C1'-C2' 107.144 0.949 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.409 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.801 0 C4'-C3'-C2' 104.571 1.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.409 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 C3'-C2'-C1' 101.782 -0.656 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.593 0 C3'-C2'-C1' 102.091 -0.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C4'-C3'-C2' 100.983 -2.217 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.474 " H4'" " C5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C4'-C3'-C2' 101.761 -1.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.474 " C5'" " H4'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.687 0 C4'-C3'-C2' 104.16 0.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-C2' 107.037 0.852 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.408 ' C6 ' ' C6 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 101.792 -0.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.597 ' P ' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O5'--C5' 1.424 -0.997 0 C1'-O4'-C4' 106.797 -2.073 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.551 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C3'-C2'-C1' 104.734 1.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.422 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 C3'-C2'-C1' 106.433 2.666 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.602 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C1'-O4'-C4' 110.294 0.424 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.431 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C4'-C3'-C2' 104.39 1.19 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.878 0 C1'-O4'-C4' 106.996 -1.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.505 ' C8 ' ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 104.315 1.115 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.505 ' H71' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C4'-C3'-C2' 104.086 0.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.4 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 N19-C1'-C2' 114.99 0.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.444 ' O ' ' C ' ' A' ' 2' ' ' LYS . 19.3 tpp . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 119.922 -0.085 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' A' ' 1' ' ' MET . 8.4 mtmm -28.6 119.01 0.12 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.359 0.412 . . . . 0.0 111.216 -179.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.573 ' O ' ' HA ' ' B' ' 108' ' ' THR . 44.4 tt0 -100.19 118.73 37.11 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.218 0.533 . . . . 0.0 111.833 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.982 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.12 103.12 7.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.67 0.748 . . . . 0.0 111.594 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.811 HD13 ' CD1' ' B' ' 114' ' ' TYR . 2.6 pt -108.08 122.83 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.662 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.39 125.97 32.07 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.859 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.646 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.69 109.83 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.393 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.683 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 3.3 p -70.34 85.93 0.59 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.37 0.605 . . . . 0.0 110.484 -179.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.204 HG21 ' CD1' ' A' ' 14' ' ' TYR . 26.6 m -77.98 -146.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.088 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.664 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 22.9 t0 91.95 -7.88 0.22 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.777 0.799 . . . . 0.0 109.153 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.5 t -130.91 -59.72 0.99 Allowed 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.053 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.769 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.7 OUTLIER -44.4 -94.26 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -178.443 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.538 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 3.1 m -179.8 38.15 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 118.978 0.808 . . . . 0.0 111.526 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.204 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.92 -44.29 15.53 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.655 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 3.4 mt-30 -48.78 -38.78 22.92 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.809 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -53.74 -57.18 11.79 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.673 0.67 . . . . 0.0 112.331 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.923 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -54.25 -42.68 70.18 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 120.211 -0.596 . . . . 0.0 112.437 -178.05 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.655 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.7 -28.4 40.65 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.371 179.615 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -56.29 -24.86 45.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.587 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.834 ' CD2' HD23 ' B' ' 139' ' ' LEU . 2.8 m-85 -87.98 -49.15 7.25 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.146 -0.934 . . . . 0.0 108.82 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.562 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 3.8 m-20 143.46 37.15 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 O-C-N 124.443 1.089 . . . . 0.0 110.504 178.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 t -147.87 77.74 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.652 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.537 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 18.9 m-80 -59.0 -105.17 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.053 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -147.62 7.4 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.597 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 31.0 p -41.86 -64.42 0.58 Allowed 'General case' 0 C--O 1.24 0.594 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.335 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.8 -30.85 13.79 Favored Glycine 0 C--N 1.333 0.39 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.991 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.674 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -52.3 -61.5 2.24 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 122.486 0.315 . . . . 0.0 110.226 178.786 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.053 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -51.23 -58.7 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.749 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 9.7 p -48.67 -42.4 34.56 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.403 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -79.59 -45.12 19.76 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.13 0.49 . . . . 0.0 110.256 179.826 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.575 HG22 HD21 ' B' ' 127' ' ' LEU . 3.2 m -59.3 -44.64 92.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.803 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.933 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.16 -48.52 61.84 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.436 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -61.38 -37.42 83.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.825 -0.17 . . . . 0.0 111.315 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -51.31 42.0 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.712 ' HG2' HD13 ' B' ' 127' ' ' LEU . 20.5 tp10 -65.77 -34.45 78.21 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.645 ' O ' HD12 ' A' ' 39' ' ' LEU . . . -62.45 -45.16 94.33 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -50.42 71.77 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 122.121 0.962 . . . . 0.0 108.785 177.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.555 ' NH1' ' O ' ' A' ' 40' ' ' ARG . 7.2 ttp85 -60.58 -56.36 22.21 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 113.322 -1.763 . . . . 0.0 113.673 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.763 HD11 ' CE2' ' B' ' 120' ' ' TYR . 15.0 mt 8.73 76.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.458 1.103 . . . . 0.0 113.523 -178.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.555 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -178.87 154.31 0.71 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.694 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB3' ' O ' ' A' ' 40' ' ' ARG . . . 75.06 131.31 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.398 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -129.05 -76.02 0.55 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.219 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -176.16 155.83 1.58 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.814 0.34 . . . . 0.0 111.668 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -151.91 177.29 10.59 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.181 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.497 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -127.18 144.61 51.0 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.402 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 3.7 p -157.82 157.5 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 120.774 0.321 . . . . 0.0 111.394 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 48' ' ' ASN . 1.7 mm-40 -87.71 54.62 3.18 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.189 0.519 . . . . 0.0 111.585 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 42.5 t30 176.51 152.42 0.18 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.274 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.19 107.13 4.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.42 153.15 36.97 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.198 -179.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.28 90.05 0.25 Allowed Glycine 0 C--N 1.337 0.614 0 CA-C-N 115.844 -0.617 . . . . 0.0 113.025 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.604 ' O ' HG22 ' A' ' 53' ' ' VAL . 4.3 tpt -116.2 136.68 52.79 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 52' ' ' MET . 5.5 m 50.64 -162.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.534 179.696 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -109.74 148.53 31.26 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.862 0.363 . . . . 0.0 111.147 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.87 -123.82 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.671 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -147.45 86.45 1.61 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.145 0.498 . . . . 0.0 111.434 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -111.16 125.44 53.79 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.442 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -158.65 44.29 0.28 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.19 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.562 HG22 ' N ' ' A' ' 60' ' ' GLU . 16.8 mm -125.24 -91.59 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.752 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.562 ' N ' HG22 ' A' ' 59' ' ' ILE . 2.0 mm-40 -112.91 173.09 6.55 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 63.3 ttp -168.95 89.79 0.22 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.821 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.488 ' OD1' ' NH2' ' A' ' 40' ' ' ARG . 78.6 m-20 -124.09 -91.51 0.54 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.576 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -178.74 49.26 0.09 OUTLIER Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.682 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.3 t 59.18 -148.77 0.46 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.596 0.236 . . . . 0.0 111.186 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -134.82 131.46 37.48 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.025 0.441 . . . . 0.0 111.459 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -169.25 102.36 0.36 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.689 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.13 -83.28 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.736 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -93.18 82.87 4.56 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.018 0.437 . . . . 0.0 110.796 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -125.8 -3.91 7.08 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.556 ' HD3' ' O ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER 177.86 -30.22 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.557 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.556 ' O ' ' HD3' ' A' ' 70' ' ' LYS . 2.5 m-20 78.76 155.22 0.15 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.108 0.963 . . . . 0.0 113.015 178.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.445 ' CZ2' ' HE3' ' A' ' 70' ' ' LYS . 19.2 m-90 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.898 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 1.8 mpt? . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 119.674 -0.203 . . . . 0.0 110.763 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.664 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER 78.14 134.5 0.06 Allowed 'General case' 0 C--N 1.343 0.29 0 CA-C-O 121.204 0.526 . . . . 0.0 111.122 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.683 ' HB3' HG23 ' A' ' 9' ' ' VAL . 13.9 tt0 -105.21 107.63 18.72 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.823 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.639 ' NH1' ' H73' ' D' ' 193' ' ' ' DT' . 5.2 ttm105 -78.6 101.48 7.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.393 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 1.092 HD13 ' CD2' ' A' ' 14' ' ' TYR . 20.0 pt -102.94 116.6 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.65 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.752 ' OG1' ' H72' ' D' ' 191' ' ' ' DT' . 0.2 OUTLIER -115.92 119.19 35.12 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.223 -177.844 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.795 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.63 92.21 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 176.03 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.982 HG22 ' HG3' ' A' ' 4' ' ' ARG . 81.7 p -62.08 90.87 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.089 0.471 . . . . 0.0 110.412 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.911 HG21 ' HB2' ' B' ' 114' ' ' TYR . 2.1 t -84.12 -136.43 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.04 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.7 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 90.14 -12.26 0.32 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -175.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 39.5 t -122.31 -63.11 1.32 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.161 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.749 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -43.49 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.365 0.416 . . . . 0.0 112.071 -179.018 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER 176.24 44.24 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.744 0.702 . . . . 0.0 110.671 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.911 ' HB2' HG21 ' B' ' 109' ' ' VAL . 0.3 OUTLIER -83.1 -41.9 18.03 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.471 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.616 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.58 -43.62 36.06 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -176.445 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.586 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -48.83 -30.61 5.96 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.713 0.688 . . . . 0.0 112.163 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.933 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.34 -60.11 2.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.374 178.351 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.616 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.1 OUTLIER -63.38 -25.8 68.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.241 179.754 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.407 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.93 -29.17 55.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.518 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.763 ' CE2' HD11 ' A' ' 39' ' ' LEU . 14.4 m-30 -94.23 -42.32 9.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.594 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 27.6 t70 125.15 54.7 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 122.343 1.068 . . . . 0.0 110.177 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.891 ' CG1' HD13 ' B' ' 117' ' ' LEU . 4.8 p -142.84 -38.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 CA-C-N 113.846 -1.525 . . . . 0.0 111.856 -177.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.708 ' O ' HD12 ' B' ' 117' ' ' LEU . 21.9 m-80 54.65 -117.05 1.12 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 0.995 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.78 5.86 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -179.296 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.529 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.2 OUTLIER -39.18 -63.78 0.51 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.978 -178.471 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.419 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -85.98 -31.24 21.02 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.347 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.739 HD23 HG23 ' B' ' 124' ' ' ILE . 20.3 tp -55.5 -61.67 2.19 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 116.824 0.312 . . . . 0.0 110.664 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.995 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.2 t -52.76 -63.22 0.5 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.974 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.057 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.769 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 11.3 p -49.52 -46.78 48.91 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -72.74 -47.4 47.21 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.537 HG21 ' OG1' ' A' ' 31' ' ' THR . 16.7 m -57.78 -53.98 52.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.4 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.923 ' SD ' HD12 ' A' ' 17' ' ' LEU . 6.1 mmt -50.06 -52.65 32.78 Favored 'General case' 0 C--O 1.205 -1.246 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.118 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.538 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 3.6 tt0 -53.96 -49.1 69.5 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 117.735 0.243 . . . . 0.0 111.369 179.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -65.04 -43.42 92.43 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.568 ' O ' ' HG ' ' B' ' 139' ' ' LEU . 2.2 tt0 -76.19 -8.65 57.5 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.124 177.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.809 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.43 -47.21 8.95 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 123.158 0.583 . . . . 0.0 109.909 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -56.82 6.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.486 0.66 . . . . 0.0 109.867 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.617 ' HD2' ' HA ' ' B' ' 142' ' ' GLU . 0.5 OUTLIER -84.37 -37.62 21.32 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.579 -1.191 . . . . 0.0 114.126 -177.601 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.834 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 42.79 41.18 2.39 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.256 0.623 . . . . 0.0 111.776 -177.124 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -168.15 -52.79 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.504 ' O ' ' HD2' ' B' ' 138' ' ' ARG . . . -175.35 92.56 0.06 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.84 0.352 . . . . 0.0 111.939 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.617 ' HA ' ' HD2' ' B' ' 138' ' ' ARG . 5.1 tp10 -102.12 142.66 33.04 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.428 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.7 47.91 1.56 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.817 0.341 . . . . 0.0 110.874 179.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 39.5 p90 39.16 -140.98 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.551 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.45 137.11 53.99 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.836 0.351 . . . . 0.0 110.532 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 2.9 t -79.55 145.34 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-O 120.891 0.377 . . . . 0.0 111.708 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -117.07 -90.85 0.55 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.913 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -159.89 177.33 10.9 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.945 0.402 . . . . 0.0 111.427 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.49 152.35 19.97 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.873 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.31 165.84 13.23 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.726 0.298 . . . . 0.0 111.21 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -138.7 61.7 0.57 Allowed Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.637 -0.792 . . . . 0.0 113.466 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.15 161.74 15.27 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.848 0.356 . . . . 0.0 111.023 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.521 ' O ' HG23 ' B' ' 155' ' ' VAL . 3.8 m -63.55 131.82 29.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 120.814 0.34 . . . . 0.0 111.458 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -67.17 85.08 0.14 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.31 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.521 HG23 ' O ' ' B' ' 153' ' ' VAL . 11.6 t -94.99 -2.58 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' B' ' 155' ' ' VAL . . . 73.35 104.79 0.07 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.468 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 157' ' ' ARG . . . . . 0.452 ' O ' ' CB ' ' B' ' 158' ' ' PHE . 0.2 OUTLIER -119.48 -179.06 3.76 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.395 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.452 ' CB ' ' O ' ' B' ' 157' ' ' ARG . 1.2 t80 88.8 110.18 0.04 OUTLIER 'General case' 0 C--N 1.34 0.173 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.423 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 1.2 mp -98.56 -69.96 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.51 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -144.86 147.73 33.14 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.866 0.365 . . . . 0.0 111.269 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 10.8 ttp -158.33 55.32 0.45 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.065 0.46 . . . . 0.0 111.131 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -141.72 156.1 45.62 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.166 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -80.18 151.46 33.26 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.022 -0.609 . . . . 0.0 113.041 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 21.3 t -104.93 152.64 22.42 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.796 0.331 . . . . 0.0 111.301 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -169.68 -65.36 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.219 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -162.41 153.46 17.61 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.29 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -107.52 -67.6 0.95 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.088 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 60.72 65.22 1.06 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.023 0.44 . . . . 0.0 111.842 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -95.07 164.28 12.95 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.051 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -175.58 -33.56 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.953 0.406 . . . . 0.0 110.044 -179.804 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 32.7 m-20 80.47 102.13 0.06 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.707 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.6 t90 . . . . . 0 C--O 1.251 1.182 0 CA-C-O 118.165 -0.922 . . . . 0.0 111.297 179.932 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.682 " H1'" ' H73' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.271 0 C3'-C2'-C1' 106.188 2.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.822 H2'' " O5'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.838 0 C3'-C2'-C1' 104.859 1.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.822 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 P--O3' 1.613 0.533 0 O4'-C1'-C2' 107.064 0.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.683 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.768 0 C4'-C3'-C2' 104.604 1.404 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.681 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.405 -1.159 0 C3'-C2'-C1' 105.426 1.947 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.681 ' H71' " H2'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C4'-C3'-C2' 104.192 0.992 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.47 ' H8 ' H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.555 0 C3'-C2'-C1' 105.714 2.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.434 ' C6 ' " C2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.711 0 C3'-C2'-C1' 100.242 -1.756 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.642 ' C2 ' ' C2 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 C3'-C2'-C1' 104.119 1.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.576 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.753 0 C3'-C2'-C1' 105.258 1.827 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.576 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 O4'-C1'-C2' 107.018 0.834 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.8 0 C3'-C2'-C1' 104.992 1.637 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.622 0 C4'-C3'-C2' 100.946 -2.254 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.5 ' OP3' " H3'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.563 0 N19-C1'-C2' 115.529 0.831 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.45 ' H6 ' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 O4'-C1'-C2' 107.187 0.988 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.638 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 O4'-C4'-C3' 106.209 0.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.638 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 O4'-C1'-C2' 107.003 0.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.597 ' OP1' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.023 0 C4'-C3'-C2' 104.669 1.469 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.752 ' H72' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.788 0 C1'-O4'-C4' 106.95 -1.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.642 ' C2 ' ' C2 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C3'-C2'-C1' 105.097 1.712 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.639 ' H73' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 N19-C1'-C2' 115.844 1.028 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.517 H2'' " O5'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.845 0 C3'-C2'-C1' 105.243 1.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.517 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C1'-O4'-C4' 108.176 -1.089 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-C2' 106.937 0.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 C4'-C3'-C2' 104.113 0.913 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 N19-C1'-C2' 115.343 0.715 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.425 ' O ' ' NZ ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.851 0 CA-C-O 120.204 0.049 . . . . 0.0 111.016 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.2 mmtm -141.85 103.49 4.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.114 0.483 . . . . 0.0 110.149 178.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.508 ' HG2' ' CG2' ' A' ' 5' ' ' ILE . 1.0 OUTLIER -88.88 114.62 25.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.489 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.975 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -78.94 98.57 6.46 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.936 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 1.115 HG21 ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -114.67 109.8 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.526 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.799 HG23 ' H72' ' C' ' 178' ' ' ' DT' . 0.3 OUTLIER -108.87 133.81 52.39 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.582 -177.252 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.725 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -99.44 101.18 11.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.0 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.438 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 25.9 p -62.39 88.46 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.632 0.73 . . . . 0.0 110.189 -178.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.236 HG21 ' CD2' ' A' ' 14' ' ' TYR . 28.7 m -80.05 -137.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 114.258 -1.337 . . . . 0.0 112.032 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.548 ' N ' HG23 ' A' ' 9' ' ' VAL . 24.6 t0 81.82 -10.54 1.13 Allowed 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -177.087 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.0 m -120.49 -69.68 0.83 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.674 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.7 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 0.2 OUTLIER -51.32 -89.41 0.0 OUTLIER 'General case' 0 C--N 1.353 0.747 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.146 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.514 ' HB3' ' O ' ' B' ' 129' ' ' SER . 29.2 t -177.14 47.55 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.249 0.931 . . . . 0.0 111.529 -178.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.236 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -80.35 -46.8 15.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -179.796 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.64 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 2.3 mm100 -49.18 -39.78 30.65 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -176.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.529 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.7 OUTLIER -56.01 -56.15 24.26 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.704 HD21 ' CG ' ' B' ' 135' ' ' GLU . 0.2 OUTLIER -45.5 -52.91 9.66 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.804 0.812 . . . . 0.0 111.508 -177.695 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.729 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 5.8 pttt -78.99 -26.58 43.35 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.772 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -62.2 -22.84 66.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.251 177.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.982 ' CB ' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.83 -43.37 11.88 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 118.666 -0.683 . . . . 0.0 109.441 178.322 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.608 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 164.34 21.79 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 177.786 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.519 ' H ' ' HA ' ' A' ' 18' ' ' LYS . 59.0 t -153.54 101.82 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.824 ' O ' HD12 ' A' ' 24' ' ' ILE . 46.8 m-80 -66.25 52.37 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.141 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.083 HG21 ' HE3' ' B' ' 132' ' ' MET . 1.9 pp 35.61 -2.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 120.068 3.359 . . . . 0.0 120.068 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.566 ' HB2' ' OP2' ' D' ' 190' ' ' ' DG' . 0.0 OUTLIER -38.05 -57.66 1.03 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 118.917 0.78 . . . . 0.0 110.204 -179.537 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.61 -29.55 43.25 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.868 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.754 HD12 ' CG2' ' A' ' 24' ' ' ILE . 1.1 tm? -60.83 -56.13 24.82 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.943 HG12 ' SD ' ' A' ' 32' ' ' MET . 90.7 t -45.52 -67.95 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 109.987 178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.628 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.1 p -50.57 -42.24 55.28 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.577 0.751 . . . . 0.0 112.71 178.059 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.2 m -66.46 -57.44 7.36 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.456 ' HA ' HD22 ' A' ' 34' ' ' ASN . 0.8 OUTLIER -52.85 -41.64 64.46 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.038 178.887 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.943 ' SD ' HG12 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -48.68 -49.59 37.0 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.389 178.713 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.42 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -57.68 -45.49 85.55 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.361 179.556 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.456 HD22 ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -65.6 -51.79 57.02 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.185 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.881 ' HG3' HD21 ' B' ' 127' ' ' LEU . 1.4 mm-40 -64.5 -28.31 69.57 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.576 178.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.569 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.61 -45.57 61.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.002 0.43 . . . . 0.0 110.491 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.562 ' NH2' HG21 ' A' ' 55' ' ' VAL . 1.3 mtp180 -73.23 -56.54 4.94 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.088 0.471 . . . . 0.0 111.233 179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.409 ' HG3' ' CZ2' ' B' ' 144' ' ' TRP . 0.0 OUTLIER -83.42 -32.97 25.81 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -176.916 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.54 ' CD1' ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 36.86 36.85 0.06 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -178.238 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.2 93.65 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.799 0.333 . . . . 0.0 111.458 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -134.16 147.0 50.72 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.154 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -94.17 -114.89 0.1 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -165.51 -169.35 1.55 Allowed 'General case' 0 CA--C 1.537 0.464 0 O-C-N 122.226 -0.296 . . . . 0.0 111.315 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.481 ' O ' ' HE2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER 68.02 95.78 0.06 Allowed 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 179.44 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' A' ' 44' ' ' TRP . 11.9 mmtt -150.43 145.93 26.36 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.444 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.63 HG13 ' N ' ' A' ' 47' ' ' GLU . 1.3 p -87.39 -158.79 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.145 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.686 ' HA ' ' NH1' ' B' ' 140' ' ' ARG . 0.3 OUTLIER -73.52 144.82 45.98 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.302 0.573 . . . . 0.0 112.38 -179.157 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -179.78 169.87 1.28 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.568 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.436 ' O ' ' HD2' ' B' ' 143' ' ' ARG . 18.2 pt20 -114.0 171.27 7.7 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.778 0.323 . . . . 0.0 111.513 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.433 ' HA ' ' HB2' ' B' ' 143' ' ' ARG . 1.3 pm0 -77.18 169.51 18.2 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.639 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 147.81 97.21 0.19 Allowed Glycine 0 C--N 1.336 0.54 0 C-N-CA 121.102 -0.57 . . . . 0.0 112.798 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.87 169.02 8.85 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.866 0.365 . . . . 0.0 111.44 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 42.3 t -129.64 138.7 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.991 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.49 129.24 38.73 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.938 0.399 . . . . 0.0 111.659 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.562 HG21 ' NH2' ' A' ' 37' ' ' ARG . 17.3 t -146.06 -120.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.517 179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.48 ' N ' HG12 ' A' ' 55' ' ' VAL . . . -171.24 -100.45 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.23 0.212 . . . . 0.0 110.947 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 70.89 141.22 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -173.51 78.37 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.421 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 22.7 mm -146.6 109.25 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.386 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -134.63 -67.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.83 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 68.09 -176.6 0.2 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.197 0.523 . . . . 0.0 112.071 179.329 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -149.46 166.0 30.43 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.878 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -151.1 150.84 22.86 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 120.525 -0.845 . . . . 0.0 113.749 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.2 m 179.16 -89.02 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.809 0.444 . . . . 0.0 110.581 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.8 t80 68.31 164.09 0.22 Allowed 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.28 0.562 . . . . 0.0 112.402 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -146.3 84.86 1.64 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.038 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.47 115.92 23.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.027 -178.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' A' ' 70' ' ' LYS . 6.6 tp10 -129.85 119.68 23.72 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.961 178.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -178.73 163.42 1.45 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.962 0.41 . . . . 0.0 111.26 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.411 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 1.1 pttt 179.13 -32.4 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.437 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 81.67 -52.76 0.26 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.082 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 . . . . . 0 C--O 1.253 1.251 0 CA-C-O 118.492 -0.766 . . . . 0.0 110.992 179.559 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.454 ' N ' ' OD2' ' A' ' 10' ' ' ASP . 2.9 mmt . . . . . 0 N--CA 1.496 1.853 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.525 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.6 OUTLIER -167.58 139.24 3.09 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.654 179.577 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.807 ' HB3' HG23 ' A' ' 9' ' ' VAL . 12.5 tp60 -114.62 116.98 29.61 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.324 0.583 . . . . 0.0 111.472 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.676 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.38 106.49 11.45 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.29 -0.868 . . . . 0.0 112.042 -179.124 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.883 HD13 ' CD1' ' A' ' 14' ' ' TYR . 2.8 pt -115.03 115.65 50.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.788 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -124.46 132.12 53.5 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.612 -177.521 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 1.055 HG13 HD11 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.37 99.28 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 174.676 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.975 HG22 ' HG3' ' A' ' 4' ' ' ARG . 71.8 p -69.15 71.92 0.27 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.773 HG21 ' HB3' ' B' ' 112' ' ' ASP . 14.4 p -101.81 -131.56 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.919 -176.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.754 ' H ' HG22 ' B' ' 109' ' ' VAL . 1.0 OUTLIER 155.38 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -178.335 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 8.3 t -80.43 -1.23 40.58 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.773 ' HB3' HG21 ' B' ' 109' ' ' VAL . 4.9 t0 -74.91 52.75 0.56 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 120.303 1.41 . . . . 0.0 109.534 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 32' ' ' MET . 2.8 m 65.17 -11.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.115 ' CZ ' HG21 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -53.53 -60.04 3.82 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 118.207 0.458 . . . . 0.0 110.326 179.719 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 85.8 mt-30 -49.56 -41.04 40.5 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.979 -177.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.508 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.93 -28.08 21.85 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.833 HD12 ' CG1' ' B' ' 122' ' ' VAL . 0.5 OUTLIER -77.52 -55.4 5.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.44 0.638 . . . . 0.0 110.885 178.751 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.702 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -64.01 -25.87 68.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.26 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.87 -27.8 45.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.379 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.584 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 13.0 m-30 -88.5 -42.53 12.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.078 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 18.7 t70 124.95 63.67 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 O-C-N 124.548 1.155 . . . . 0.0 110.469 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.833 ' CG1' HD12 ' B' ' 117' ' ' LEU . 3.7 p -159.7 -32.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.507 -178.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.472 ' H ' ' HA ' ' B' ' 118' ' ' LYS . 6.7 p30 54.64 -102.91 0.16 Allowed 'General case' 0 C--N 1.343 0.29 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.166 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -158.4 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 179.3 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.515 ' HB3' " O3'" ' C' ' 176' ' ' ' DT' . 8.8 p -39.61 -64.63 0.46 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.436 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.747 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.04 -32.78 16.56 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.724 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.881 HD21 ' HG3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -56.57 -62.92 1.4 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.852 0.326 . . . . 0.0 111.12 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.166 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -55.22 -69.16 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.748 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 1.1 t -51.38 -41.21 60.53 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.747 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -76.05 -50.08 15.75 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 118.754 0.706 . . . . 0.0 109.282 179.12 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.613 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 1.3 m -51.47 -35.96 42.23 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.083 ' HE3' HG21 ' A' ' 24' ' ' ILE . 2.4 mtt -55.4 -48.76 73.87 Favored 'General case' 0 C--O 1.201 -1.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.439 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -53.98 -36.44 62.92 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.216 0.916 . . . . 0.0 110.561 179.42 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 134' ' ' ASN . . . . . 0.471 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 1.3 m-20 -75.19 -48.49 23.27 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.704 ' CG ' HD21 ' A' ' 17' ' ' LEU . 2.7 tp10 -68.92 -21.94 64.19 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.834 177.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.64 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -76.71 -47.37 22.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.672 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -56.41 13.43 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.659 0.742 . . . . 0.0 109.549 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.46 -34.24 75.6 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.445 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.982 HD11 ' CB ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 32.76 56.02 0.41 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.76 0.791 . . . . 0.0 111.737 -179.422 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.686 ' NH1' ' HA ' ' A' ' 47' ' ' GLU . 8.2 ttp180 -177.24 141.43 0.32 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.067 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -59.16 121.26 10.89 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.957 0.408 . . . . 0.0 111.317 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.415 ' HA ' ' NH2' ' B' ' 140' ' ' ARG . 0.9 OUTLIER -78.12 -77.97 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.277 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.436 ' HD2' ' O ' ' A' ' 49' ' ' GLN . 2.9 ttt180 68.76 131.98 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.623 0.725 . . . . 0.0 112.799 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.409 ' CZ2' ' HG3' ' A' ' 38' ' ' ARG . 31.6 p90 -111.36 155.98 22.27 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.902 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -115.41 163.64 15.43 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.198 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 14.6 p -121.53 143.04 35.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.943 0.402 . . . . 0.0 111.096 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -107.44 161.29 14.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.115 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -125.13 169.28 12.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.782 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.56 109.04 8.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.969 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.24 113.12 1.79 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.772 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -104.33 69.38 0.27 Allowed Glycine 0 C--N 1.334 0.423 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.267 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 19.5 mmm -87.37 105.87 17.56 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.971 0.415 . . . . 0.0 111.199 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.542 HG13 ' O ' ' B' ' 153' ' ' VAL . 10.5 p -84.81 54.67 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.314 0.578 . . . . 0.0 111.792 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.413 ' C ' ' H ' ' B' ' 156' ' ' ALA . 33.1 tt0 -168.35 164.5 12.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.291 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 70.25 -23.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 178.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.413 ' H ' ' C ' ' B' ' 154' ' ' GLU . . . -74.14 -86.04 0.04 OUTLIER 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.859 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 3.2 ttt180 63.88 128.1 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.225 0.535 . . . . 0.0 111.807 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.523 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -175.06 98.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.976 -179.386 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.436 ' O ' ' C ' ' B' ' 160' ' ' GLU . 16.8 mm -97.05 -121.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.677 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 160' ' ' GLU . . . . . 0.436 ' C ' ' O ' ' B' ' 159' ' ' ILE . 0.5 OUTLIER 17.8 76.21 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 179.392 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 17.1 mtp -118.48 133.67 55.69 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.418 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -78.39 159.66 28.21 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.986 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -70.96 54.26 1.0 Allowed Glycine 0 CA--C 1.522 0.495 0 C-N-CA 121.273 -0.489 . . . . 0.0 113.217 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.99 -69.49 0.08 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 122.658 0.383 . . . . 0.0 111.947 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 39.1 t80 69.51 152.94 0.1 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.012 0.434 . . . . 0.0 111.546 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -170.29 109.99 0.38 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.717 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -72.77 68.73 0.88 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.309 0.576 . . . . 0.0 110.619 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -66.53 66.45 0.05 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.065 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -88.08 147.25 25.04 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.885 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.452 ' O ' ' CB ' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -162.28 -33.94 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.188 179.336 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.452 ' CB ' ' O ' ' B' ' 170' ' ' LYS . 10.7 t0 96.09 161.39 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.516 1.127 . . . . 0.0 110.671 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 30.7 m0 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.679 -0.677 . . . . 0.0 111.618 179.969 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.884 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O4'-C1'-C2' 107.425 1.205 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.884 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.789 0 C3'-C2'-C1' 104.562 1.33 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.686 ' C8 ' " C2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 O4'-C1'-C2' 107.045 0.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.542 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 C1'-O4'-C4' 106.737 -2.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.562 ' N2 ' ' C4 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C4'-C3'-C2' 104.17 0.97 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.799 ' H72' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.88 0 C4'-C3'-C2' 104.701 1.501 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.704 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 C3'-C2'-C1' 105.007 1.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.794 ' H73' ' HD2' ' A' ' 4' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.671 0 C3'-C2'-C1' 100.801 -1.357 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.663 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.656 0 O4'-C1'-C2' 107.245 1.041 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.721 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.881 0 C3'-C2'-C1' 105.27 1.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.721 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-C2' 106.992 0.811 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.557 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 N19-C1'-C2' 115.25 0.657 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C4'-C3'-C2' 100.861 -2.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.519 ' H71' " C2'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C1'-C2' 106.918 0.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.519 " C2'" ' H71' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.774 0 N19-C1'-C2' 112.86 -0.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 C3'-C2'-C1' 101.651 -0.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.431 H2'' " O5'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 O4'-C1'-C2' 105.074 -0.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.566 ' OP2' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O5'--C5' 1.426 -0.861 0 C1'-O4'-C4' 107.19 -1.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.571 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 C2'--C1' 1.53 0.677 0 C3'-C2'-C1' 104.631 1.379 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.456 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C3'-C2'-C1' 106.694 2.853 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.602 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.584 0 N19-C1'-C2' 115.292 0.682 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.602 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C4'-C3'-C2' 104.546 1.346 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.49 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.909 0 C1'-O4'-C4' 107.295 -1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.562 ' C4 ' ' N2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.602 0 C3'-C2'-C1' 104.345 1.175 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.646 H2'' ' C8 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.862 0 C3'-C2'-C1' 105.115 1.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.646 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C1'-O4'-C4' 110.308 0.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 111.557 0.206 . . . . 0.0 111.557 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt 72.42 160.92 0.23 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.011 0.434 . . . . 0.0 111.67 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.563 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -98.76 106.78 19.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.454 0.645 . . . . 0.0 110.397 179.516 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 1.014 ' HG2' HG22 ' B' ' 106' ' ' THR . 0.0 OUTLIER -79.48 103.91 9.72 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.187 -179.221 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.909 HG21 ' CE1' ' B' ' 114' ' ' TYR . 9.0 pt -100.05 128.88 51.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.846 ' CG2' HG23 ' B' ' 106' ' ' THR . 0.3 OUTLIER -132.52 124.37 28.36 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 117.992 -1.483 . . . . 0.0 113.997 -177.965 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.677 HG22 HG22 ' A' ' 9' ' ' VAL . 1.2 p -100.33 101.72 12.47 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 176.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.677 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 37.7 p -69.98 80.71 0.48 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.447 0.641 . . . . 0.0 110.471 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.963 HG11 ' HB3' ' A' ' 14' ' ' TYR . 4.0 t -72.93 -124.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.912 -178.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.712 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 0.4 OUTLIER 99.95 6.02 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.179 0.992 . . . . 0.0 109.88 -176.294 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.722 ' H ' HG12 ' A' ' 9' ' ' VAL . 38.7 t -167.44 -42.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.876 -1.056 . . . . 0.0 112.161 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.65 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 0.5 OUTLIER -62.24 47.92 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -177.274 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.565 ' O ' ' HB3' ' B' ' 132' ' ' MET . 1.0 OUTLIER 53.66 7.51 0.11 Allowed 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 177.181 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.972 ' CE1' HD11 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -66.59 -52.57 43.95 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.278 0.49 . . . . 0.0 111.141 179.181 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.77 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.54 -36.88 24.92 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.957 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.72 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -55.5 -56.47 19.82 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.477 0.58 . . . . 0.0 111.224 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.806 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.5 -54.09 15.62 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.288 0.566 . . . . 0.0 111.355 -178.985 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 7.5 pttt -71.9 -25.74 62.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.153 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -58.5 -20.12 42.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.469 178.067 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.649 ' CD2' HD12 ' B' ' 139' ' ' LEU . 23.5 m-85 -87.69 -53.58 4.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.65 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 O-C-N 124.303 1.002 . . . . 0.0 111.821 178.57 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.805 ' CG1' HD12 ' A' ' 17' ' ' LEU . 9.7 p -147.03 80.61 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.522 0.677 . . . . 0.0 112.439 -178.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.054 ' O ' HD12 ' A' ' 24' ' ' ILE . 48.8 m-80 -65.42 63.44 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.883 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.095 HD11 HD12 ' B' ' 105' ' ' ILE . 0.5 OUTLIER 39.53 -7.94 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 118.336 2.717 . . . . 0.0 118.336 179.176 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -37.71 -60.07 0.75 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 120.432 1.469 . . . . 0.0 110.318 -178.28 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.53 -28.27 40.05 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.143 -0.551 . . . . 0.0 112.279 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.737 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -65.09 -61.35 2.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 122.677 0.391 . . . . 0.0 111.202 179.961 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.846 HG22 ' CG2' ' B' ' 128' ' ' VAL . 15.4 t -47.89 -61.25 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.478 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.812 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 7.7 p -49.2 -44.8 43.46 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 124.814 1.246 . . . . 0.0 113.417 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 97.4 m -67.07 -51.09 58.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.679 HG22 HD21 ' B' ' 127' ' ' LEU . 1.2 m -60.37 -34.07 73.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.288 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.925 ' HE2' HG23 ' B' ' 124' ' ' ILE . 3.3 mmt -57.73 -57.28 13.45 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.933 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.432 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -57.98 -45.42 86.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.606 0.241 . . . . 0.0 110.866 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.432 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 2.4 t-20 -64.06 -55.49 21.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.615 179.208 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.914 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.7 tp10 -67.57 -22.1 65.4 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.745 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -72.1 -42.94 65.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.71 -56.63 5.0 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.783 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.479 ' HA ' ' HD3' ' A' ' 38' ' ' ARG . 22.3 mmt180 -84.22 -32.1 24.69 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -176.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.562 ' CD1' ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 34.11 73.45 0.08 Allowed 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.691 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.546 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -174.49 -14.38 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 40' ' ' ARG . . . 78.87 104.94 0.07 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.48 0.582 . . . . 0.0 110.775 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -134.72 173.03 12.13 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.804 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 79.8 145.6 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.589 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -101.83 -78.83 0.53 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' NZ ' ' OE2' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -169.37 178.52 4.25 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -178.674 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.679 HG23 ' HB3' ' B' ' 141' ' ' ALA . 0.2 OUTLIER -124.22 174.39 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.954 179.407 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' OE2' ' NZ ' ' A' ' 45' ' ' LYS . 1.2 mp0 -94.63 -90.99 0.21 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.43 -68.08 0.3 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.595 ' HG3' HG13 ' B' ' 146' ' ' VAL . 14.0 mm100 -145.02 170.48 16.1 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.885 0.374 . . . . 0.0 111.563 -179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.68 134.36 40.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.754 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -152.66 144.33 11.35 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.972 -0.633 . . . . 0.0 113.004 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.439 ' O ' ' NZ ' ' B' ' 145' ' ' LYS . 59.5 mtp -104.38 -177.78 3.47 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.715 0.293 . . . . 0.0 111.49 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.1 p -159.04 124.62 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.027 0.441 . . . . 0.0 111.262 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.13 -165.53 1.11 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.085 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.3 t -119.08 -125.38 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.42 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 179.47 -72.08 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.527 0.203 . . . . 0.0 111.518 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.22 121.21 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.113 0.482 . . . . 0.0 112.035 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.5 t80 179.53 106.24 0.03 OUTLIER 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.63 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -125.93 -134.09 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.677 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.78 167.24 22.42 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.744 0.307 . . . . 0.0 111.106 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.1 ttt -157.41 52.39 0.47 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.981 0.419 . . . . 0.0 111.219 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -109.74 -177.42 3.27 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.427 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 133.12 72.26 0.09 OUTLIER Glycine 0 C--N 1.333 0.38 0 C-N-CA 121.076 -0.583 . . . . 0.0 112.617 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.3 t -123.35 124.69 43.51 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.696 0.284 . . . . 0.0 111.361 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -164.21 150.1 10.82 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.301 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -145.92 155.18 42.69 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.077 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.83 -86.95 0.45 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.429 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 52.64 74.12 0.3 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.096 0.474 . . . . 0.0 111.199 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -140.9 -162.06 1.3 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.416 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.49 -35.63 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.157 0.503 . . . . 0.0 109.718 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.428 ' HB3' ' HD1' ' A' ' 72' ' ' TRP . 6.2 t70 78.7 -58.44 0.43 Allowed 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.411 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.428 ' HD1' ' HB3' ' A' ' 71' ' ' ASP . 34.1 m95 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.606 -0.712 . . . . 0.0 110.905 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.458 ' O ' ' HD2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 120.712 0.291 . . . . 0.0 111.507 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.712 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -137.38 144.19 42.33 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.389 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.543 ' O ' ' HA ' ' A' ' 8' ' ' THR . 3.7 tt0 -122.79 125.65 45.88 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.808 ' NH2' HG21 ' B' ' 106' ' ' THR . 4.3 ttt-85 -78.32 112.51 15.4 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.958 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 1.095 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -95.45 122.47 46.95 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.542 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 175.069 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 106' ' ' THR . . . . . 1.014 HG22 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -131.89 109.83 10.36 Favored 'General case' 0 C--N 1.299 -1.589 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.889 -177.03 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.817 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -102.92 107.71 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.364 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.822 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 6.1 p -70.97 98.19 1.57 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.464 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.758 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.94 -148.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.888 -178.449 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.598 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 15.6 t70 106.55 6.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 122.197 0.998 . . . . 0.0 108.591 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.68 -41.68 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.6 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.812 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -78.57 42.32 0.43 Allowed 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -176.875 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.497 ' O ' ' HB3' ' A' ' 32' ' ' MET . 41.0 m 67.97 -2.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 177.087 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.909 ' CE1' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -54.23 -51.02 65.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.878 0.763 . . . . 0.0 110.604 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.586 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 6.2 mm-40 -50.0 -43.99 50.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.94 -176.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.745 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -53.55 -27.9 28.65 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.764 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.925 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -77.58 -55.46 5.34 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.622 0.725 . . . . 0.0 110.906 178.184 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.6 OUTLIER -65.87 -25.44 67.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.832 179.848 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.82 -28.35 48.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.007 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.563 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 16.0 m-30 -88.57 -42.56 11.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.897 178.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 25.3 t70 121.29 62.4 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 124.58 1.175 . . . . 0.0 109.775 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 51.3 t -144.21 -48.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.975 -178.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 64.54 -113.95 0.34 Allowed 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -178.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 0.981 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -146.93 4.28 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 114.66 1.355 . . . . 0.0 114.66 179.245 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.506 ' HB2' ' P ' ' C' ' 177' ' ' ' DG' . 27.6 t -40.58 -64.6 0.5 Allowed 'General case' 0 C--O 1.241 0.643 0 C-N-CA 120.139 -0.625 . . . . 0.0 109.905 -178.274 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.451 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.71 -25.41 35.36 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.787 177.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.766 HD11 ' HG2' ' A' ' 35' ' ' GLU . 4.3 tp -60.84 -61.41 2.61 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 179.367 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.981 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.1 t -52.48 -65.57 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.884 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.65 ' HB3' ' CB ' ' A' ' 12' ' ' ASP . 8.8 p -46.94 -44.23 19.75 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.451 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -75.24 -43.81 49.57 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 119.097 0.862 . . . . 0.0 109.392 178.605 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.602 ' OG1' HG21 ' A' ' 31' ' ' THR . 18.9 m -59.58 -39.9 85.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.479 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.806 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 6.4 mmt -61.05 -57.5 12.34 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.341 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -34.24 56.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 118.152 0.433 . . . . 0.0 111.745 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -79.23 -47.86 15.2 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.182 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.685 ' HB3' HD21 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -72.87 -22.2 60.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.988 0.423 . . . . 0.0 109.925 177.855 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.72 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -71.71 -45.2 62.56 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.6 mmt85 -67.5 -56.05 11.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.104 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.449 ' HD2' ' N ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER -69.59 -43.0 73.71 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.052 -1.431 . . . . 0.0 114.287 -177.099 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.649 HD12 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 15.91 -88.72 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -177.067 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.04 113.68 27.35 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.949 0.404 . . . . 0.0 111.902 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.679 ' HB3' HG23 ' A' ' 46' ' ' VAL . . . 177.3 161.89 0.48 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.682 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.38 -89.54 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -124.81 -168.16 1.78 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.443 ' O ' ' CB ' ' B' ' 145' ' ' LYS . 0.0 OUTLIER -84.36 145.36 28.27 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 179.409 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.443 ' CB ' ' O ' ' B' ' 144' ' ' TRP . 1.8 tttt 84.95 158.1 0.1 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.333 -0.394 . . . . 0.0 109.989 -179.055 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.595 HG13 ' HG3' ' A' ' 49' ' ' GLN . 6.5 t -125.08 -117.67 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.236 -179.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.402 ' OE2' ' HE3' ' B' ' 145' ' ' LYS . 1.1 mp0 53.69 -110.72 0.56 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 117.582 0.174 . . . . 0.0 110.975 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 58.16 -172.13 0.1 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.61 0.243 . . . . 0.0 111.132 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.39 158.67 2.34 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.942 0.401 . . . . 0.0 111.778 -179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.61 156.28 41.18 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.842 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -167.07 172.66 42.21 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.595 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 29.5 tpp -153.69 156.53 38.02 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.836 0.351 . . . . 0.0 111.283 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.519 HG13 ' O ' ' B' ' 153' ' ' VAL . 7.2 p -159.41 103.53 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-O 121.141 0.496 . . . . 0.0 110.996 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -118.54 152.24 36.35 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.841 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.467 ' O ' ' HB3' ' B' ' 156' ' ' ALA . 4.1 t -132.1 -123.84 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.492 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' B' ' 155' ' ' VAL . . . 75.17 105.81 0.07 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.116 0.484 . . . . 0.0 111.586 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -116.51 118.87 33.86 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.981 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 4.8 t80 177.64 106.48 0.02 OUTLIER 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.248 0.547 . . . . 0.0 110.826 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.91 19.87 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.392 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -97.61 107.15 19.59 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.831 0.348 . . . . 0.0 111.505 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 12.4 tpt -120.83 146.52 46.46 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -153.49 -176.22 5.71 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.349 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -104.58 -147.14 16.3 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 121.033 -0.603 . . . . 0.0 113.004 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 16.0 p -139.87 171.26 14.46 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.827 0.346 . . . . 0.0 111.298 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -162.93 92.94 0.79 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.141 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -156.53 138.01 13.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.369 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.54 70.56 3.93 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.084 0.469 . . . . 0.0 110.901 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -71.06 85.78 0.73 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.281 0.563 . . . . 0.0 111.496 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -65.7 143.96 57.22 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.965 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.556 ' HD3' ' N ' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -162.74 -38.46 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.512 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.556 ' N ' ' HD3' ' B' ' 170' ' ' LYS . 34.9 m-20 71.82 152.74 0.12 Allowed 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.287 179.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.555 ' HB2' ' O ' ' B' ' 171' ' ' ASP . 71.7 m95 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 123.183 0.593 . . . . 0.0 111.405 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.644 " C3'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.272 0 C4'-C3'-C2' 101.396 -1.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.644 H5'' " C3'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.513 -0.607 0 C3'-C2'-C1' 106.409 2.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.609 ' C8 ' " C2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.554 0 O4'-C1'-C2' 107.138 0.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.677 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.872 0 C4'-C3'-C2' 104.734 1.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.506 ' P ' ' HB2' ' B' ' 125' ' ' SER . . . . . . . . 0 O4'--C1' 1.409 -0.843 0 C4'-C3'-C2' 104.495 1.295 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.75 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.87 0 C1'-O4'-C4' 107.309 -1.708 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.625 " H2'" ' H72' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 C3'-C2'-C1' 104.916 1.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.765 ' H71' ' HD2' ' A' ' 4' ' ' ARG . . . . . . . . 0 O4'--C4' 1.453 0.601 0 C3'-C2'-C1' 101.104 -1.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.589 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 O4'-C1'-C2' 107.341 1.128 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.595 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.743 0 C3'-C2'-C1' 105.311 1.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.661 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.572 0 O4'-C1'-C2' 107.032 0.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.661 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.79 0 N19-C1'-C2' 115.19 0.619 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C4'-C3'-C2' 100.978 -2.222 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.215 1.014 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.767 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.54 0 O4'-C1'-C2' 106.95 0.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.767 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 C1'-O4'-C4' 110.268 0.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.463 ' C8 ' ' N7 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.49 0 O4'-C1'-C2' 107.078 0.889 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.732 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.935 0 C1'-O4'-C4' 106.885 -2.011 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.732 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.531 0.72 0 O4'-C4'-C3' 103.876 -1.724 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.627 ' H62' ' CZ ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 C3'-C2'-C1' 105.434 1.953 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.5 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 N19-C1'-C2' 115.61 0.881 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.5 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.805 0 C4'-C3'-C2' 104.766 1.566 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.412 ' C2 ' ' N7 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.071 0 C1'-O4'-C4' 107.416 -1.631 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.412 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C4'-C3'-C2' 104.425 1.225 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 O4'-C1'-C2' 105.296 -0.731 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 C3'-C2'-C1' 101.991 -0.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 120.514 0.197 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.6 ' HA ' ' CB ' ' B' ' 110' ' ' ASP . 0.0 OUTLIER 68.82 150.09 0.08 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.193 0.52 . . . . 0.0 111.746 -179.663 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.612 ' O ' ' HA ' ' B' ' 108' ' ' THR . 15.8 tt0 -129.6 113.12 14.42 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 121.491 0.662 . . . . 0.0 110.997 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.863 ' HG3' HG22 ' B' ' 108' ' ' THR . 4.3 ttm180 -78.77 109.8 13.35 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.598 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.909 HD12 HD11 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -102.54 109.82 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.059 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 176.153 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.858 ' CG2' ' HG2' ' B' ' 104' ' ' ARG . 1.5 m -117.25 118.55 32.59 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 120.264 -0.574 . . . . 0.0 111.463 -175.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.916 HG13 HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.75 106.22 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.24 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.552 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.6 OUTLIER -70.83 79.91 0.62 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.209 0.528 . . . . 0.0 110.375 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.162 HG21 ' CD1' ' A' ' 14' ' ' TYR . 6.2 m -72.84 -158.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.37 -178.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.596 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 10.9 t70 93.55 -22.66 0.06 Allowed 'General case' 0 C--N 1.351 0.643 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -176.43 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.47 ' OG ' ' HE3' ' B' ' 102' ' ' LYS . 0.4 OUTLIER -116.37 -1.58 12.27 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.896 177.185 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.758 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -110.7 -95.58 0.42 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.774 177.596 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.78 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.3 OUTLIER -173.85 30.34 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 118.481 0.582 . . . . 0.0 111.96 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.162 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -70.34 -39.11 74.89 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.533 0.733 . . . . 0.0 112.243 179.091 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.571 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.8 OUTLIER -49.79 -47.94 50.9 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -176.442 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.73 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -49.53 -28.96 6.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -179.468 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.845 HD12 HG23 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -78.26 -60.16 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.391 0.615 . . . . 0.0 111.057 178.101 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -62.67 -25.5 68.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.648 179.496 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.4 -27.11 34.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.647 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.753 ' CE2' HD13 ' B' ' 139' ' ' LEU . 14.8 m-30 -88.58 -52.32 5.22 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.862 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.679 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 16.6 p-10 147.02 40.86 0.0 OUTLIER 'General case' 0 C--N 1.357 0.924 0 O-C-N 124.638 1.211 . . . . 0.0 111.395 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.799 HG11 HD22 ' A' ' 17' ' ' LEU . 14.4 p -138.08 89.33 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.162 0.506 . . . . 0.0 112.317 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.975 ' O ' HD12 ' A' ' 24' ' ' ILE . 5.4 m-20 -76.78 50.89 0.73 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.161 0.505 . . . . 0.0 110.636 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.993 ' HB ' HG23 ' A' ' 28' ' ' VAL . 1.4 pp 33.76 5.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.888 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.4 p -37.49 -63.55 0.44 Allowed 'General case' 0 C--O 1.247 0.961 0 CA-C-N 119.092 0.86 . . . . 0.0 110.743 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.445 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -76.44 -25.64 65.21 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.003 177.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.827 HD12 ' CG2' ' A' ' 24' ' ' ILE . 3.2 tm? -65.84 -60.21 3.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.51 -0.281 . . . . 0.0 110.791 179.369 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.993 HG23 ' HB ' ' A' ' 24' ' ' ILE . 61.8 t -42.14 -71.6 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 CA-C-N 117.586 0.175 . . . . 0.0 110.642 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.673 ' O ' ' HB2' ' B' ' 113' ' ' SER . 88.2 p -49.57 -34.17 16.95 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.1 m -75.2 -52.14 11.65 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 121.043 -1.036 . . . . 0.0 110.308 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.624 ' CG2' HD11 ' B' ' 127' ' ' LEU . 0.8 OUTLIER -56.8 -28.45 61.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.403 -179.763 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.912 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -54.2 -54.44 39.88 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.698 178.824 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.461 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.55 -33.14 65.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 111.633 -179.416 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.461 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.8 t-20 -76.33 -47.68 22.7 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.733 ' HB3' HD21 ' B' ' 117' ' ' LEU . 5.1 tp10 -67.41 -31.47 71.7 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.327 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.745 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -72.41 -39.47 67.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.74 179.458 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -70.14 -56.2 7.45 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.57 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -79.01 -37.12 39.97 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.823 -177.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.031 HD11 ' CE2' ' B' ' 120' ' ' TYR . 19.3 mt 37.5 66.17 0.47 Allowed 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 121.266 0.555 . . . . 0.0 111.595 -178.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -164.37 125.32 2.15 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.086 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.77 52.82 0.08 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.032 0.444 . . . . 0.0 112.112 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -112.9 127.14 56.12 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.134 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.1 mtm180 179.23 172.02 0.88 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.145 0.498 . . . . 0.0 111.493 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 1.6 p90 -165.68 162.71 18.95 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.53 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.51 139.23 19.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.804 0.335 . . . . 0.0 111.653 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.762 HG23 ' HG2' ' B' ' 142' ' ' GLU . 0.7 OUTLIER -141.26 125.23 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.691 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.617 ' HG3' ' HA ' ' B' ' 147' ' ' GLU . 5.2 pm0 -122.16 136.95 54.98 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.256 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.568 ' HB2' ' HB3' ' B' ' 144' ' ' TRP . 57.0 t30 -151.28 144.86 24.95 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.64 ' HB3' ' HB3' ' B' ' 148' ' ' ASN . 3.9 pt20 -155.95 142.14 18.33 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.584 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.77 -43.46 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.042 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -166.43 141.27 6.84 Favored Glycine 0 C--N 1.338 0.691 0 C-N-CA 120.908 -0.663 . . . . 0.0 113.077 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.02 136.46 1.09 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.662 0.268 . . . . 0.0 111.305 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -155.42 -62.26 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.541 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -80.52 156.04 26.71 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 111.333 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.7 t -87.53 -4.84 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 65.75 -49.81 0.39 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 3.5 mtt85 -65.35 97.16 0.26 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.852 0.358 . . . . 0.0 111.885 -179.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 1.6 t80 177.84 105.11 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.066 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.3 mm -118.71 -116.55 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.871 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -109.85 172.6 6.76 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.923 0.392 . . . . 0.0 111.249 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.97 151.91 31.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.05 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -61.48 -48.83 79.32 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.588 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 129.03 -122.72 3.99 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.962 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.9 t -164.56 -160.74 0.54 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.716 0.293 . . . . 0.0 111.232 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -130.99 154.66 47.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.948 0.404 . . . . 0.0 111.495 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.48 154.72 38.73 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.175 179.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.17 -67.55 0.47 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.478 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.99 101.15 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 70.22 -178.31 0.22 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.079 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.43 -33.92 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.02 0.438 . . . . 0.0 109.915 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 87.02 103.56 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.793 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.5 t90 . . . . . 0 C--O 1.253 1.281 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.643 -179.008 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.535 ' O ' ' NZ ' ' B' ' 102' ' ' LYS . 1.4 mpt? . . . . . 0 N--CA 1.493 1.681 0 N-CA-C 111.237 0.088 . . . . 0.0 111.237 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.596 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 5.7 mmtm -138.67 148.1 43.6 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 179.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.581 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -100.72 111.76 24.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.823 0.821 . . . . 0.0 112.627 -178.567 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.858 ' HG2' ' CG2' ' A' ' 6' ' ' THR . 0.1 OUTLIER -79.59 101.31 8.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.7 -178.602 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.916 HG12 HG13 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -107.3 128.52 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 176.101 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.681 HG22 HG23 ' A' ' 6' ' ' THR . 0.5 OUTLIER -132.09 129.12 39.54 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.659 -178.494 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.888 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.23 88.08 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 175.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.863 HG22 ' HG3' ' A' ' 4' ' ' ARG . 57.9 p -70.82 67.27 0.38 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.467 0.651 . . . . 0.0 109.691 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.137 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -63.77 -101.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 114.716 -1.129 . . . . 0.0 112.341 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.632 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.2 t70 75.75 -1.89 2.89 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 -173.163 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.447 ' H ' ' C ' ' B' ' 109' ' ' VAL . 54.9 p -94.26 -73.8 0.56 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.034 -1.439 . . . . 0.0 109.758 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' B' ' 114' ' ' TYR . 1.1 p-10 -144.83 156.1 43.84 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -175.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.673 ' HB2' ' O ' ' A' ' 29' ' ' SER . 1.0 OUTLIER 48.19 -27.3 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 175.539 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.137 ' CB ' HG21 ' B' ' 109' ' ' VAL . 1.7 t80 -54.6 -60.04 3.89 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.321 0.964 . . . . 0.0 109.393 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.655 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 48.0 mt-30 -49.75 -42.22 45.79 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.669 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.745 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -50.71 -55.7 15.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.468 0.651 . . . . 0.0 109.375 178.169 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.733 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -46.72 -53.89 10.82 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.318 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.655 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -74.5 -25.47 59.38 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.085 179.666 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.501 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.82 -29.83 60.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.647 178.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.031 ' CE2' HD11 ' A' ' 39' ' ' LEU . 15.0 m-30 -87.94 -40.63 13.77 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.673 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 4.5 p-10 132.92 17.33 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 O-C-N 124.988 1.43 . . . . 0.0 111.751 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.558 ' HB ' ' CD1' ' B' ' 117' ' ' LEU . 26.1 t -105.34 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.177 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.87 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -67.43 45.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.092 0.472 . . . . 0.0 111.199 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.014 HG22 HD12 ' B' ' 127' ' ' LEU . 1.8 pp 32.74 6.56 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 119.457 3.132 . . . . 0.0 119.457 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.59 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 3.7 p -37.93 -62.93 0.51 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 117.973 0.351 . . . . 0.0 111.347 -178.6 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.452 ' N ' ' OG ' ' B' ' 125' ' ' SER . . . -82.85 -24.36 53.15 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.058 178.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 1.014 HD12 HG22 ' B' ' 124' ' ' ILE . 2.3 tm? -66.81 -61.51 1.92 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.807 HG23 ' HB ' ' B' ' 124' ' ' ILE . 2.6 t -52.43 -60.64 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-O 121.007 0.432 . . . . 0.0 109.889 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.758 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 63.3 p -54.82 -33.25 61.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.075 -0.966 . . . . 0.0 113.397 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 3.4 m -79.57 -54.22 6.11 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 121.728 -0.607 . . . . 0.0 111.073 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.04 -36.64 40.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.915 -178.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.83 ' HE3' HG21 ' A' ' 24' ' ' ILE . 3.9 mtt -56.77 -53.23 60.18 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.36 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.78 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -56.26 -40.48 74.27 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.742 -179.777 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 134' ' ' ASN . . . . . 0.55 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 73.9 m-80 -67.98 -55.08 14.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.299 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -34.58 77.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.925 0.393 . . . . 0.0 110.248 178.369 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.73 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -66.38 -45.69 79.21 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.057 178.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.44 ' HD3' ' OE2' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -61.8 -52.17 65.27 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.814 0.816 . . . . 0.0 109.378 177.655 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.452 ' O ' ' N ' ' B' ' 140' ' ' ARG . 1.0 OUTLIER -63.59 -58.06 8.13 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.003 -1.453 . . . . 0.0 112.145 -178.546 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.753 HD13 ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 8.66 59.96 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.323 1.049 . . . . 0.0 113.404 -178.842 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.476 ' HD2' ' O ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER 174.71 -72.72 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.869 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.608 ' HB3' ' CB ' ' B' ' 149' ' ' GLN . . . -175.61 -177.78 1.02 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.762 ' HG2' HG23 ' A' ' 46' ' ' VAL . 3.1 tt0 -120.07 142.68 48.65 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.558 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 0.0 OUTLIER -150.06 -79.55 0.13 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.568 ' HB3' ' HB2' ' A' ' 48' ' ' ASN . 17.6 t90 -151.15 -106.62 0.06 Allowed 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -179.05 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.564 ' O ' ' HB ' ' B' ' 146' ' ' VAL . 7.2 tmtt? -130.85 140.45 50.25 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.935 -0.478 . . . . 0.0 111.984 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.605 HG12 ' N ' ' B' ' 147' ' ' GLU . 37.1 t 118.05 -88.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.674 1.19 . . . . 0.0 111.513 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.617 ' HA ' ' HG3' ' A' ' 47' ' ' GLU . 2.7 tt0 -170.49 162.82 8.32 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -179.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 148' ' ' ASN . . . . . 0.64 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER 69.3 -161.27 0.18 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.255 179.237 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 149' ' ' GLN . . . . . 0.608 ' CB ' ' HB3' ' B' ' 141' ' ' ALA . 1.6 pm0 -146.01 59.54 1.24 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 150' ' ' GLU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 49' ' ' GLN . 5.8 mm-40 -83.6 -78.64 0.22 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.989 -0.445 . . . . 0.0 110.866 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 116.8 61.84 0.32 Allowed Glycine 0 C--N 1.335 0.474 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.099 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -170.24 175.22 5.0 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 122.38 0.272 . . . . 0.0 110.77 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 6.0 p -171.3 116.37 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.199 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -100.9 154.17 18.89 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.953 0.406 . . . . 0.0 111.406 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 5.5 t -127.59 -122.03 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.512 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 67.16 93.26 0.07 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.119 0.485 . . . . 0.0 111.738 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.48 140.82 22.33 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.38 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -174.32 102.92 0.1 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.268 0.556 . . . . 0.0 110.86 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 1.1 mp -132.96 29.55 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.325 179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -100.12 126.1 46.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.432 -179.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 12.6 mtm -144.22 135.54 25.59 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.125 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -143.62 137.32 28.23 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.24 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 177.95 143.13 4.94 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.879 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 19.1 t -170.5 161.0 7.67 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.685 0.279 . . . . 0.0 111.239 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -175.3 154.31 1.69 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.545 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -144.55 67.54 1.26 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.08 0.466 . . . . 0.0 111.334 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.32 81.18 4.94 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.176 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.85 59.32 0.48 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-O 121.308 0.575 . . . . 0.0 110.916 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -110.73 139.13 46.29 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.013 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.555 ' HE2' ' HB2' ' B' ' 172' ' ' TRP . 8.2 ttpt -168.73 30.67 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.355 0.598 . . . . 0.0 109.733 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.7 t70 27.65 71.48 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 114.645 -1.162 . . . . 0.0 112.826 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.555 ' HB2' ' HE2' ' B' ' 170' ' ' LYS . 1.2 m95 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.243 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.644 " C3'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.504 -1.229 0 C3'-C2'-C1' 100.316 -1.703 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.696 " C2'" ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.77 0 C3'-C2'-C1' 105.712 2.151 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.696 ' C8 ' " C2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.131 0.937 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.745 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.811 0 C1'-O4'-C4' 107.343 -1.684 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.745 " O5'" H2'' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 C3'-C2'-C1' 104.961 1.615 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.75 ' H73' ' HB ' ' A' ' 6' ' ' THR . . . . . . . . 0 C2'--C1' 1.51 -0.764 0 O4'-C1'-C2' 104.979 -1.019 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.531 ' C2 ' ' C2 ' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 C3'-C2'-C1' 104.87 1.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.531 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.841 0 C3'-C2'-C1' 100.779 -1.372 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.485 ' C2 ' ' C2 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C1'-O4'-C4' 110.552 0.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.435 ' C2 ' ' C2 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 C4'-C3'-C2' 104.428 1.228 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.757 0 C4'-C3'-C2' 104.575 1.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 O4'-C4'-C3' 106.176 0.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 C4'-C3'-C2' 100.873 -2.327 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.523 " H4'" ' OP3' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O4'-C1'-C2' 107.044 0.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.42 ' OP1' H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-C2' 107.389 1.172 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.418 ' OP1' ' HD3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 O4'-C1'-C2' 107.575 1.341 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.425 ' OP2' ' HE3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.428 -0.781 0 C3'-C2'-C1' 101.081 -1.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.561 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C1'-O4'-C4' 106.372 -2.377 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.561 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C4'-C3' 104.499 -1.101 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.485 ' C2 ' ' C2 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.793 0 C1'-O4'-C4' 110.728 0.734 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.542 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 C4'-C3'-C2' 104.444 1.244 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.488 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.768 0 C3'-C2'-C1' 105.02 1.657 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.488 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.025 0 O4'-C1'-N19 108.819 1.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.429 ' C8 ' ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C4'-C3'-C2' 104.359 1.159 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.429 ' H71' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.976 0 C4'-C3'-C2' 104.57 1.37 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C5'-C4'-O4' 108.672 -0.455 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.434 ' O ' ' C ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.797 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.54 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -23.6 116.93 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -179.053 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.61 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 33.6 tp60 -112.59 110.34 20.45 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.276 178.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 1.145 ' HG2' HG22 ' B' ' 106' ' ' THR . 5.4 ttm105 -80.0 117.03 20.47 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-O 121.641 0.734 . . . . 0.0 112.662 -178.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.82 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.96 131.95 55.59 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 177.036 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.918 ' CB ' HG23 ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.48 121.93 32.08 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.557 -177.422 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.689 ' CG1' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -102.72 96.94 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 174.835 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.617 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 69.7 p -70.92 87.35 0.72 Allowed 'General case' 0 C--N 1.317 -0.84 0 O-C-N 121.102 -0.999 . . . . 0.0 109.921 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.041 HG23 ' HB3' ' A' ' 14' ' ' TYR . 14.0 m -144.86 55.47 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 117.217 2.302 . . . . 0.0 117.217 -177.396 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.818 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 0.8 OUTLIER -73.98 54.33 0.51 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 123.761 1.743 . . . . 0.0 108.277 173.906 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.44 ' H ' ' C ' ' A' ' 9' ' ' VAL . 28.6 t -164.65 -47.78 0.03 OUTLIER 'General case' 0 C--N 1.27 -2.85 0 CA-C-N 111.463 -2.608 . . . . 0.0 110.905 -178.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.628 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 20.4 m-20 -73.4 47.25 0.22 Allowed 'General case' 0 C--N 1.348 0.502 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.717 -178.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.549 ' O ' ' HB3' ' B' ' 132' ' ' MET . 51.0 m 69.5 -3.07 1.71 Allowed 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.041 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -61.64 -45.23 94.96 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.556 0.693 . . . . 0.0 110.213 179.26 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.752 ' HG3' ' HA ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -48.17 -44.68 32.75 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.092 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.603 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.1 OUTLIER -60.36 -49.01 79.3 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -178.63 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.953 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.1 -44.78 52.22 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.393 0.616 . . . . 0.0 111.372 -179.66 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.751 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 21.2 pttt -79.63 -33.85 41.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.32 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.503 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -62.07 -28.99 70.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.362 178.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.99 ' CB ' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -88.15 -45.29 10.24 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 117.772 -1.109 . . . . 0.0 110.864 179.218 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.714 ' HA ' ' HG3' ' A' ' 52' ' ' MET . 0.4 OUTLIER 152.35 31.46 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.453 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.533 HG23 ' HE1' ' A' ' 20' ' ' TYR . 27.1 t -145.52 -33.67 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.502 -0.879 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.603 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 9.9 p30 53.89 -104.42 0.21 Allowed 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -176.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.053 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -153.66 -0.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 178.456 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.528 ' HB3' " O3'" ' D' ' 189' ' ' ' DG' . 51.8 p -39.01 -64.31 0.46 Allowed 'General case' 0 C--O 1.241 0.648 0 CA-C-N 119.265 0.938 . . . . 0.0 109.505 -178.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.45 -28.64 24.13 Favored Glycine 0 CA--C 1.522 0.475 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.208 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.746 HD13 HD11 ' A' ' 17' ' ' LEU . 2.9 tp -56.45 -58.29 8.67 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.815 0.308 . . . . 0.0 110.357 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.053 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.6 t -53.99 -62.6 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.7 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 59.9 p -49.43 -45.16 46.11 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.72 -46.07 26.89 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.861 0.362 . . . . 0.0 110.221 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.635 ' CG2' HD21 ' B' ' 127' ' ' LEU . 36.3 m -61.2 -38.52 86.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.399 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' MET . . . . . 1.021 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -51.3 -43.34 61.63 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.135 179.258 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.507 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -63.49 -46.2 87.21 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.558 0.218 . . . . 0.0 110.731 179.02 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.507 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.27 -48.17 79.29 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.746 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.581 ' HG3' ' HG ' ' B' ' 127' ' ' LEU . 2.5 mm-40 -66.26 -36.14 82.24 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.501 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -59.38 -42.78 92.45 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.719 -0.613 . . . . 0.0 109.466 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -78.36 -56.46 4.43 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.922 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.66 -29.74 29.79 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -176.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.578 ' N ' ' O ' ' A' ' 35' ' ' GLU . 0.3 OUTLIER 26.69 79.54 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.589 0.756 . . . . 0.0 112.374 -178.96 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.417 ' NH1' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -169.62 88.3 0.16 Allowed 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.552 ' CB ' HG21 ' B' ' 130' ' ' THR . . . -174.92 141.92 0.63 Allowed 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -169.28 94.67 0.3 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.336 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -154.49 162.7 41.01 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -146.42 -179.37 6.71 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.431 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.827 ' HG3' HG22 ' A' ' 46' ' ' VAL . 0.9 OUTLIER -152.18 -61.84 0.16 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.827 HG22 ' HG3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -172.82 172.74 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 O-C-N 123.233 0.333 . . . . 0.0 110.775 -179.1 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 7.9 pt-20 -89.79 -167.29 1.81 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -172.2 -159.71 0.14 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -110.25 -141.64 0.38 Allowed 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.294 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.46 -159.47 0.96 Allowed 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.979 -0.451 . . . . 0.0 111.554 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.63 75.33 1.15 Allowed Glycine 0 C--N 1.339 0.732 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.402 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.714 ' HG3' ' HA ' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -158.31 146.81 18.77 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.981 0.419 . . . . 0.0 111.878 -179.208 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 14.3 p -172.63 124.65 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.913 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.51 -160.46 1.06 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 56' ' ' ALA . 4.4 t -114.28 -124.68 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 122.25 0.22 . . . . 0.0 110.64 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.472 ' HB1' ' CZ ' ' A' ' 58' ' ' PHE . . . -144.74 85.99 1.78 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.257 0.551 . . . . 0.0 111.374 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.44 106.01 16.34 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.501 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.501 ' N ' ' CD1' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -163.57 89.57 0.6 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.187 0.518 . . . . 0.0 111.734 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -113.74 -133.4 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.803 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.49 171.03 15.67 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.639 0.257 . . . . 0.0 111.073 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.1 ttt -142.86 124.1 14.6 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.909 0.385 . . . . 0.0 111.639 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -144.67 171.22 14.7 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.157 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 171.78 152.85 8.67 Favored Glycine 0 CA--C 1.522 0.471 0 C-N-CA 120.888 -0.672 . . . . 0.0 113.089 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.7 t -157.66 166.22 33.4 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 111.363 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -170.91 148.09 2.79 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.419 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -133.83 105.58 6.86 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.45 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -120.32 116.93 26.52 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.981 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -149.04 91.59 1.87 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.732 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -158.65 143.63 16.17 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.625 -179.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.461 ' NZ ' ' O ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -173.73 -34.63 0.01 OUTLIER 'General case' 0 C--O 1.237 0.442 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.286 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.461 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 2.3 t0 78.21 175.39 0.17 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.023 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.007 0 CA-C-O 117.879 -1.058 . . . . 0.0 111.818 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.499 ' SD ' ' HE2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 N-CA-C 111.216 0.08 . . . . 0.0 111.216 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.552 ' O ' ' HG2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -125.51 104.5 8.45 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.173 0.511 . . . . 0.0 111.927 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.818 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 1.4 tp60 -97.0 121.59 39.05 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.864 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.597 ' HG3' ' OG1' ' A' ' 6' ' ' THR . 2.7 ttm105 -77.8 105.99 9.34 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.734 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.727 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -99.8 108.69 23.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.022 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 178.447 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 106' ' ' THR . . . . . 1.145 HG22 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -119.35 112.74 19.81 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.416 -173.965 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.512 HG22 ' CG1' ' B' ' 109' ' ' VAL . 1.2 p -100.59 112.13 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.45 177.11 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.784 HG23 ' HG3' ' A' ' 4' ' ' ARG . 3.3 p -70.93 87.51 0.73 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.994 HG21 ' CD2' ' B' ' 114' ' ' TYR . 13.2 m -89.37 -143.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.653 ' N ' HG23 ' B' ' 109' ' ' VAL . 6.4 t70 87.95 -7.49 0.56 Allowed 'General case' 0 C--N 1.351 0.633 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -176.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.34 -65.52 1.1 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.244 -1.344 . . . . 0.0 107.839 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.7 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -43.53 -86.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.172 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 2.2 m 175.97 41.31 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 118.428 0.558 . . . . 0.0 111.454 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.994 ' CD2' HG21 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -83.6 -45.46 13.47 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.631 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -48.58 -40.68 28.19 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.048 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.501 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -53.81 -56.28 18.97 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.115 0.87 . . . . 0.0 111.705 179.387 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.832 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -55.67 -45.74 77.68 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.925 -178.534 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.631 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -73.41 -26.85 61.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.948 179.037 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.404 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -70.21 -14.36 62.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.34 177.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.683 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.8 m-85 -87.72 -44.54 11.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.683 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.2 m-20 128.1 9.17 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 O-C-N 125.166 1.541 . . . . 0.0 111.278 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.777 ' HB ' HD13 ' B' ' 117' ' ' LEU . 98.3 t -101.91 -36.29 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.171 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.701 ' O ' HD12 ' B' ' 117' ' ' LEU . 1.3 m-20 54.31 -119.86 1.54 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.021 HG23 ' HE2' ' A' ' 32' ' ' MET . 0.3 OUTLIER -137.52 0.56 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 179.399 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.48 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 10.8 p -43.0 -64.63 0.59 Allowed 'General case' 0 C--O 1.243 0.734 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.414 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -83.31 -29.19 34.14 Favored Glycine 0 C--N 1.334 0.444 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.893 178.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.73 HD12 ' HG ' ' B' ' 117' ' ' LEU . 4.8 tt -59.57 -61.99 2.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 117.418 0.609 . . . . 0.0 110.944 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.944 HG22 HG21 ' A' ' 24' ' ' ILE . 3.2 t -50.97 -66.44 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 C-N-CA 120.526 -0.47 . . . . 0.0 109.902 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.628 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 22.0 p -48.34 -47.32 37.12 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.552 HG21 ' CB ' ' A' ' 41' ' ' ALA . 0.9 OUTLIER -71.3 -46.39 60.87 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 118.799 0.727 . . . . 0.0 110.457 -179.502 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.591 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.8 OUTLIER -66.37 -34.91 79.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.654 -179.82 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.953 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -60.77 -57.05 14.33 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.287 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.494 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -52.75 -42.0 64.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.651 0.262 . . . . 0.0 111.656 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 134' ' ' ASN . . . . . 0.513 ' O ' ' HD3' ' B' ' 138' ' ' ARG . 1.7 m-20 -62.29 -55.31 29.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.679 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.63 ' HB3' HD21 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -74.64 -8.96 58.01 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.634 178.473 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.603 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -82.32 -42.55 18.62 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -74.56 -51.99 13.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.398 177.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.528 ' N ' ' HD2' ' B' ' 138' ' ' ARG . 0.2 OUTLIER -63.97 -47.47 80.26 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.568 -178.809 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.99 HD11 ' CB ' ' A' ' 20' ' ' TYR . 0.7 OUTLIER 16.8 81.73 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.849 0.86 . . . . 0.0 112.664 179.159 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.673 ' NH1' ' HB3' ' B' ' 141' ' ' ALA . 0.0 OUTLIER -172.32 -34.4 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.92 -179.814 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.673 ' HB3' ' NH1' ' B' ' 140' ' ' ARG . . . -144.86 -171.13 3.57 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.706 0.289 . . . . 0.0 111.302 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -124.34 -167.82 1.71 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.735 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 65.7 179.83 0.2 Allowed 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.184 0.516 . . . . 0.0 112.34 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -73.62 164.26 26.9 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.191 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.8 148.73 44.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.025 0.441 . . . . 0.0 112.106 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.5 p -126.61 -40.2 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.76 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -62.1 -29.63 70.45 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.805 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 8.4 p30 42.53 35.8 0.71 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -44.31 134.95 4.78 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -142.64 131.02 22.24 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.019 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 167.83 103.55 0.17 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.945 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.9 164.52 24.38 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.941 0.4 . . . . 0.0 111.246 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.496 HG13 ' O ' ' B' ' 153' ' ' VAL . 10.0 p -70.86 64.92 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 121.523 0.678 . . . . 0.0 111.241 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.27 172.13 7.01 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.546 -179.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.4 t -120.05 -124.11 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.494 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -170.45 -67.44 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.721 0.296 . . . . 0.0 111.469 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 157' ' ' ARG . . . . . 0.45 ' NH1' ' O ' ' B' ' 160' ' ' GLU . 3.6 tmt_? -162.71 140.96 8.49 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.008 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -162.1 96.34 0.99 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.068 0.461 . . . . 0.0 111.185 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 10.8 mt -137.97 -67.5 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.969 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 160' ' ' GLU . . . . . 0.45 ' O ' ' NH1' ' B' ' 157' ' ' ARG . 0.6 OUTLIER -143.71 153.96 42.99 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 179.63 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.38 -64.73 1.25 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 173.87 -171.21 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.032 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -92.56 -92.83 1.45 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 120.938 -0.649 . . . . 0.0 113.062 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 33.6 t -170.36 -164.39 0.39 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.677 0.275 . . . . 0.0 111.327 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -147.4 139.58 24.43 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 111.605 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -171.62 152.08 3.08 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.293 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -114.45 -86.95 0.59 Allowed 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.679 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.05 137.97 54.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.818 0.342 . . . . 0.0 111.056 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -129.81 -55.59 1.13 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.454 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.96 -32.54 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.2 t0 79.1 -72.05 0.08 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.481 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.116 -0.945 . . . . 0.0 111.038 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.753 " C2'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 105.043 1.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.753 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.806 0 C3'-C2'-C1' 104.605 1.361 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.681 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 C1'-O4'-C4' 110.742 0.744 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.541 ' C4 ' ' C5 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 C4'-C3'-C2' 104.339 1.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.544 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.968 0 C4'-C3'-C2' 104.405 1.205 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.732 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.967 0 C1'-O4'-C4' 107.571 -1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.56 ' H8 ' H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.425 0.401 0 O4'-C4'-C3' 104.438 -1.162 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.496 ' H72' ' C8 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C3'-C2'-C1' 100.899 -1.286 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C3'-C2'-C1' 104.36 1.186 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.698 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.525 0.707 0 C3'-C2'-C1' 105.505 2.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.698 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 N19-C1'-C2' 112.502 -1.061 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.543 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C4'-C3'-C2' 104.159 0.959 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C4'-C3'-C2' 100.938 -2.262 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 N19-C1'-C2' 115.39 0.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.526 0.838 0 C3'-C2'-C1' 105.308 1.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.822 H2'' " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 105.131 1.737 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.822 " O4'" H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C4'-C3' 104.022 -1.578 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.468 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.903 0 C3'-C2'-C1' 105.681 2.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.525 ' C7 ' ' HB ' ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 104.464 1.26 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.525 H2'' " O5'" ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.525 0.676 0 C3'-C2'-C1' 106.034 2.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.525 " O5'" H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.569 0 C4'-C3'-C2' 102.403 -0.797 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 C4'-C3'-C2' 104.031 0.831 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.076 0 C1'-O4'-C4' 106.421 -2.342 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C4'-C3'-C2' 104.523 1.323 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.807 0 C4'-C3'-C2' 104.362 1.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.41 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 101.994 -0.504 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.5 ttm . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.676 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER 70.44 134.63 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 122.861 0.464 . . . . 0.0 110.473 -179.222 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.478 ' O ' HG22 ' B' ' 109' ' ' VAL . 33.1 tp60 -120.35 111.52 17.86 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.283 0.564 . . . . 0.0 111.294 -179.308 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.976 ' HG2' HG22 ' B' ' 106' ' ' THR . 0.0 OUTLIER -79.4 112.61 16.81 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.049 -179.557 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.787 HG12 HG13 ' B' ' 107' ' ' VAL . 0.6 OUTLIER -114.0 129.3 70.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.486 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.81 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.0 OUTLIER -133.01 135.59 45.54 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 117.886 -1.526 . . . . 0.0 113.768 -179.029 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.777 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.75 95.61 4.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.351 177.052 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 14.5 p -70.62 69.24 0.41 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.801 HG11 ' HB2' ' A' ' 14' ' ' TYR . 10.3 p -92.28 -133.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.835 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.782 ' H ' HG22 ' A' ' 9' ' ' VAL . 25.6 t70 97.81 13.34 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.309 1.052 . . . . 0.0 109.348 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.405 ' H ' HG22 ' A' ' 9' ' ' VAL . 28.0 t -145.25 -51.75 0.26 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 113.875 -1.511 . . . . 0.0 111.473 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.798 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.2 m-20 -72.82 41.41 0.1 Allowed 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 115.003 1.482 . . . . 0.0 115.003 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.497 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.2 OUTLIER 80.89 4.95 1.54 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 176.464 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.877 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 3.5 t80 -58.16 -59.58 5.07 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.545 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 11.7 mt-30 -49.73 -40.05 39.37 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.042 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.874 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -48.65 -33.33 9.76 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.426 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.082 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.7 OUTLIER -78.25 -57.24 3.88 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.187 -0.605 . . . . 0.0 111.921 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.546 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -63.29 -25.18 68.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.718 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.415 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.94 -30.63 61.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.987 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.024 ' CE2' HD11 ' B' ' 139' ' ' LEU . 11.3 m-30 -88.34 -38.64 14.98 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.614 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 37.6 t70 133.19 43.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 O-C-N 124.336 1.022 . . . . 0.0 109.578 178.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.795 ' CG1' HD22 ' A' ' 17' ' ' LEU . 6.1 p -160.89 78.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.932 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.703 -177.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.636 ' O ' ' HE3' ' B' ' 132' ' ' MET . 0.0 OUTLIER -64.1 -86.9 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.487 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.153 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -166.9 9.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 115.791 1.775 . . . . 0.0 115.791 178.966 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.575 ' HB2' ' OP1' ' D' ' 190' ' ' ' DG' . 29.0 t -38.36 -65.2 0.36 Allowed 'General case' 0 C--O 1.242 0.704 0 C-N-CA 120.211 -0.596 . . . . 0.0 110.551 -177.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.562 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -90.25 -24.91 27.8 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.584 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.824 HD11 ' HG2' ' B' ' 135' ' ' GLU . 0.7 OUTLIER -60.6 -56.94 15.26 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.105 -0.056 . . . . 0.0 111.008 179.317 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.153 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.0 t -57.21 -61.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.737 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 57.5 p -50.63 -41.92 55.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.562 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -75.21 -50.19 16.99 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.685 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.462 ' N ' ' CG2' ' A' ' 30' ' ' THR . 17.2 m -53.15 -43.76 67.25 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.947 ' HE3' HG12 ' B' ' 124' ' ' ILE . 11.7 mtt -52.59 -52.7 54.0 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.499 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -55.53 -37.38 67.86 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.828 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -48.46 40.23 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -68.41 -27.35 66.13 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.259 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.565 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -83.1 -46.27 12.98 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.746 0.818 . . . . 0.0 110.73 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -51.98 -51.64 55.84 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 121.819 0.819 . . . . 0.0 109.482 178.423 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -37.91 49.12 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.14 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.945 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 42.99 44.81 4.19 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.323 -179.853 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 4.0 tpt180 174.4 76.09 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.057 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -165.94 163.89 18.45 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.565 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 3.3 mt-10 -161.48 -92.62 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.051 179.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.565 ' HD3' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 63.25 131.64 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.88 0.848 . . . . 0.0 112.667 178.724 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -97.47 -165.33 1.24 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.242 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' A' ' 46' ' ' VAL . 7.6 tmtt? -129.79 130.37 45.26 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.801 0.334 . . . . 0.0 111.826 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.408 ' O ' ' HE2' ' A' ' 45' ' ' LYS . 8.4 p -92.57 132.02 38.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.451 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE1' ' HA ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -77.21 76.99 3.75 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.365 0.602 . . . . 0.0 111.931 -178.942 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -116.84 145.84 43.29 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.114 179.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 pm0 -60.1 133.91 56.55 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 120.804 0.335 . . . . 0.0 111.394 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -134.82 -59.87 0.79 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.036 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 130.4 -122.43 3.62 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.418 -0.42 . . . . 0.0 112.333 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -149.96 139.23 21.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.621 0.248 . . . . 0.0 110.744 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 11.1 t -138.0 76.77 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-O 121.049 0.452 . . . . 0.0 111.866 -179.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -81.91 101.83 10.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.729 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.9 t -118.08 -126.27 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.392 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.44 -58.48 0.23 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.552 0.215 . . . . 0.0 111.44 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -53.5 162.5 0.79 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.885 0.374 . . . . 0.0 110.987 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -147.33 92.53 2.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.402 0.62 . . . . 0.0 110.556 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 14.2 mm -138.51 105.75 3.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.154 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.554 ' HB2' ' CB ' ' B' ' 141' ' ' ALA . 5.1 tp10 -116.16 153.59 31.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.983 178.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.618 ' HB2' ' HG3' ' B' ' 145' ' ' LYS . 2.7 mtm -143.92 -70.57 0.3 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.602 0.239 . . . . 0.0 111.628 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -146.68 -87.05 0.1 Allowed 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 103.25 75.59 1.08 Allowed Glycine 0 C--N 1.335 0.473 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.617 ' HB3' ' HB2' ' B' ' 148' ' ' ASN . 0.5 OUTLIER -168.92 -162.92 0.4 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.332 0.123 . . . . 0.0 111.332 -178.995 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.408 ' O ' ' HB3' ' A' ' 66' ' ' ALA . 4.7 m-85 -106.98 -58.36 1.95 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.422 0.526 . . . . 0.0 112.422 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.65 ' HB2' ' O ' ' B' ' 147' ' ' GLU . . . 70.33 -59.95 0.5 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.442 0.297 . . . . 0.0 111.463 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 55.06 29.11 11.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.262 0.553 . . . . 0.0 111.444 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.55 86.01 1.17 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.822 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.415 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 14.5 p30 -54.02 153.7 4.75 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.77 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.416 ' O ' ' CB ' ' A' ' 71' ' ' ASP . 0.9 OUTLIER -170.95 -37.42 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.99 0.424 . . . . 0.0 110.036 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.416 ' CB ' ' O ' ' A' ' 70' ' ' LYS . 0.4 OUTLIER 88.4 124.89 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.818 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 27.8 m95 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.151 -0.928 . . . . 0.0 111.09 -179.591 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.442 ' O ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.763 0 N-CA-C 110.696 -0.112 . . . . 0.0 110.696 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -120.37 105.45 10.91 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 111.051 179.455 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.673 ' HB2' ' HB2' ' A' ' 10' ' ' ASP . 3.8 tm0? -95.62 123.2 39.06 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.541 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.58 ' HD2' ' N7 ' ' D' ' 192' ' ' ' DA' . 14.3 ttm-85 -77.14 101.81 6.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.713 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 1.031 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -93.34 107.64 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.392 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 177.354 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.976 HG22 ' HG2' ' A' ' 4' ' ' ARG . 1.2 m -118.18 110.91 18.16 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.317 0.579 . . . . 0.0 112.328 -175.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.787 HG13 HG12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -102.13 106.3 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.987 177.138 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.848 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 4.7 p -70.92 88.36 0.75 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.844 0.354 . . . . 0.0 110.1 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 1.121 HG21 ' CD2' ' B' ' 114' ' ' TYR . 10.9 m -80.34 -142.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.488 -178.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.681 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 0.4 OUTLIER 86.28 -15.75 0.46 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -176.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.4 m -112.23 -68.93 0.9 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.944 -1.026 . . . . 0.0 108.691 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.737 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 2.2 m-20 -43.71 -93.24 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -178.158 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 29' ' ' SER . 1.8 t -177.98 47.71 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 121.567 0.699 . . . . 0.0 111.257 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 1.121 ' CD2' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.79 -45.51 14.24 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.082 -179.493 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.543 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.1 OUTLIER -48.59 -42.48 34.02 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.568 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.565 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -51.81 -47.37 64.33 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 119.305 0.957 . . . . 0.0 112.073 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.821 HD11 HD12 ' B' ' 127' ' ' LEU . 0.2 OUTLIER -59.72 -51.8 68.22 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.313 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.595 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -74.13 -28.6 61.41 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.618 179.773 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -60.31 -28.2 67.93 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.33 178.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.945 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.44 -44.64 10.58 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.235 -0.888 . . . . 0.0 109.602 178.18 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.58 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 176.631 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.635 ' O ' HD12 ' B' ' 117' ' ' LEU . 38.8 t -146.64 94.71 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 1.067 ' O ' HD12 ' B' ' 124' ' ' ILE . 28.9 m-20 -71.43 57.12 0.25 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.86 178.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.067 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER 43.06 0.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 -179.483 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.777 ' HA ' HG22 ' A' ' 7' ' ' VAL . 14.9 p -38.66 -64.52 0.43 Allowed 'General case' 0 C--O 1.246 0.902 0 CA-C-N 119.144 0.884 . . . . 0.0 110.516 -178.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.676 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.9 -15.12 68.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.229 177.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.935 ' HB3' HG22 ' B' ' 124' ' ' ILE . 4.8 tt -72.63 -62.04 1.59 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 117.318 0.559 . . . . 0.0 110.348 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.116 HG22 ' CG2' ' A' ' 28' ' ' VAL . 75.1 t -44.78 -63.86 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.379 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.798 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 53.6 p -53.09 -51.45 61.82 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.676 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -67.55 -47.06 70.93 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 118.746 0.703 . . . . 0.0 110.103 -178.88 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.547 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.9 OUTLIER -53.22 -37.61 62.2 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.812 179.597 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.082 ' SD ' HD12 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -49.83 -49.17 50.0 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.774 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -43.66 98.35 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -67.06 -51.51 53.73 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.824 ' HG2' HD11 ' A' ' 27' ' ' LEU . 4.7 tp10 -58.73 -36.18 73.9 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.888 178.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.874 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -71.25 -42.42 68.86 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 121.026 0.441 . . . . 0.0 110.077 178.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -61.42 -52.6 63.89 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.617 0.723 . . . . 0.0 110.139 178.244 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.41 -47.66 11.18 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.228 -1.351 . . . . 0.0 113.865 -176.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.024 HD11 ' CE2' ' A' ' 20' ' ' TYR . 29.8 mt 40.05 34.1 0.18 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 121.03 0.443 . . . . 0.0 111.054 -177.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.408 ' HD2' ' HA ' ' B' ' 140' ' ' ARG . 0.0 OUTLIER 166.37 123.62 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.36 -179.032 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 141' ' ' ALA . . . . . 0.554 ' CB ' ' HB2' ' A' ' 60' ' ' GLU . . . -138.44 150.27 46.31 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.67 174.2 6.41 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.588 179.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' B' ' 144' ' ' TRP . 0.2 OUTLIER -79.8 177.94 8.54 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.521 ' HB2' ' O ' ' B' ' 143' ' ' ARG . 6.2 m-90 82.19 103.49 0.06 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.477 0.711 . . . . 0.0 112.387 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.618 ' HG3' ' HB2' ' A' ' 61' ' ' MET . 7.6 ptpt 167.67 162.65 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.969 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.424 HG12 ' N ' ' B' ' 147' ' ' GLU . 48.9 t -131.02 -101.7 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.65 ' O ' ' HB2' ' A' ' 66' ' ' ALA . 3.8 mt-10 -146.06 -177.37 5.57 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.375 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 148' ' ' ASN . . . . . 0.617 ' HB2' ' HB3' ' A' ' 64' ' ' SER . 1.9 t30 179.12 149.76 0.27 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.485 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.03 173.21 6.94 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.359 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -175.44 3.05 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.932 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -174.13 132.63 2.31 Favored Glycine 0 C--N 1.336 0.582 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.311 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 20.8 ttm -164.13 139.16 5.9 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 122.322 0.249 . . . . 0.0 110.718 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 9.6 p -166.5 147.5 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 120.93 0.395 . . . . 0.0 111.993 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.35 166.62 32.91 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.651 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.47 ' O ' ' HB2' ' B' ' 156' ' ' ALA . 4.0 t -128.5 -124.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.975 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.47 ' HB2' ' O ' ' B' ' 155' ' ' VAL . . . 172.53 106.05 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.844 0.458 . . . . 0.0 110.812 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -103.73 130.29 51.22 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.57 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -164.9 87.55 0.45 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.105 0.478 . . . . 0.0 112.155 -179.917 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 44.8 mm -114.94 91.61 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.275 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -115.08 145.01 42.76 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 28.1 ttm -161.55 141.43 10.41 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.359 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -143.92 152.64 41.37 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.017 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -87.38 -145.26 9.62 Favored Glycine 0 C--N 1.333 0.411 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.537 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 4.4 m -173.63 169.01 4.36 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 122.709 -0.289 . . . . 0.0 111.192 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -118.15 158.77 24.45 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.782 0.325 . . . . 0.0 111.691 -179.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -146.51 148.51 32.27 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.305 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.99 -13.62 11.9 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.978 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -56.97 88.95 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.131 0.491 . . . . 0.0 111.644 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -96.8 -1.55 46.0 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.066 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.434 ' NZ ' ' O ' ' B' ' 171' ' ' ASP . 1.2 tmtt? -171.6 -38.12 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.434 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 0.3 OUTLIER 86.36 127.37 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.315 179.044 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 172' ' ' TRP . . . . . 0.41 ' CE3' ' HA ' ' B' ' 172' ' ' TRP . 3.4 m95 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.403 -0.808 . . . . 0.0 111.163 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.753 " C3'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.446 1.149 0 C2'-C3'-O3' 114.611 1.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.753 H5'' " C3'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.854 0 C3'-C2'-C1' 104.693 1.423 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.637 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 104.29 1.136 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.46 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.77 0 C1'-O4'-C4' 107.264 -1.74 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.706 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.824 0 C4'-C3'-C2' 104.721 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.706 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.536 0.804 0 C4'-C3'-C2' 104.529 1.329 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.649 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.583 0 C3'-C2'-C1' 105.096 1.712 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.548 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.827 0 C3'-C2'-C1' 101.049 -1.179 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.514 ' C2 ' ' C2 ' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 104.29 1.136 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.517 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C3'-C2'-C1' 105.657 2.112 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.517 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 104.195 1.068 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.675 H2'' " H5'" ' C' ' 185' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 105.518 2.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . 0.675 " H5'" H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.513 -0.451 0 C4'-C3'-C2' 101.055 -2.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.896 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.44 0.686 0 O4'-C1'-C2' 107.53 1.3 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.896 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C4'-C3'-C2' 103.993 0.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 C3'-C2'-C1' 101.685 -0.725 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.818 H2'' " O5'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -1.006 0 C1'-O4'-C4' 106.672 -2.163 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.818 " O5'" H2'' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.405 -1.124 0 C3'-C2'-C1' 105.077 1.698 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.609 ' H72' HG21 ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C3'-C2'-C1' 105.157 1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.58 ' N7 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 C3'-C2'-C1' 106.317 2.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.577 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 N19-C1'-C2' 116.01 1.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.577 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 C4'-C3'-C2' 104.361 1.161 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.527 0.937 0 C1'-O4'-C4' 107.287 -1.724 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.412 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 104.338 1.17 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.595 H2'' ' C8 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C4'-C3'-C2' 104.34 1.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.595 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C3'-C2'-C1' 101.756 -0.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -30.16 126.89 0.14 Allowed 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.604 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.457 ' O ' ' N ' ' B' ' 109' ' ' VAL . 10.1 tp60 -105.63 111.57 24.32 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.465 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.829 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 1.3 ttm105 -79.3 105.93 10.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.954 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -112.59 122.32 66.56 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.767 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -125.41 129.67 50.34 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.921 -177.098 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -100.36 107.07 20.32 Favored 'Isoleucine or valine' 0 C--N 1.343 0.295 0 N-CA-C 106.973 -1.492 . . . . 0.0 106.973 176.957 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 16.6 p -70.57 95.64 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.189 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.01 HG21 ' CB ' ' A' ' 14' ' ' TYR . 1.5 t -89.51 -143.55 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.21 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 33.7 t70 95.94 -10.14 0.09 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.5 t -126.0 -58.78 1.37 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 114.77 -1.105 . . . . 0.0 109.378 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.67 ' HB2' HG13 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -47.6 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.51 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 m -177.54 38.48 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.248 -0.908 . . . . 0.0 110.933 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.01 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -80.56 -39.17 28.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.346 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.575 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.78 -43.25 48.21 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.364 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.713 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -48.33 -32.24 7.17 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.891 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -78.16 -60.09 2.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.092 179.028 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -61.79 -25.79 67.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.982 178.707 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.81 -30.85 71.79 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.75 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.915 ' CE2' HD21 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.6 -35.47 16.84 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.772 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.659 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 27.7 t70 142.99 31.2 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 123.724 0.64 . . . . 0.0 112.211 176.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.598 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.0 t -160.95 100.85 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.039 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.412 ' OD1' ' HB3' ' A' ' 18' ' ' LYS . 70.1 m-20 -55.78 -89.75 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 178.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.014 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -157.01 6.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.888 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.7 t -38.92 -64.44 0.45 Allowed 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.201 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.35 -23.36 51.5 Favored Glycine 0 C--N 1.335 0.496 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.02 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 1.014 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -65.65 -57.9 7.01 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 122.621 0.369 . . . . 0.0 111.2 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.955 HG23 ' HB ' ' A' ' 24' ' ' ILE . 3.8 t -51.55 -63.29 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.547 0.689 . . . . 0.0 109.21 178.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.754 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -50.16 -46.91 54.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.836 -1.075 . . . . 0.0 113.382 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.6 m -69.61 -50.27 46.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 121.311 0.577 . . . . 0.0 109.502 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.609 ' OG1' HG21 ' B' ' 131' ' ' THR . 1.8 m -55.16 -39.27 69.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.408 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.95 ' HE1' HG12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -60.58 -57.28 13.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.429 179.006 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -40.43 66.0 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.25 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.69 -48.91 52.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.34 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.85 ' CB ' HD21 ' B' ' 117' ' ' LEU . 3.5 mm-40 -68.67 -24.92 64.57 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.27 178.074 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.594 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.26 -47.23 58.33 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -65.56 -54.79 22.97 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.49 0.662 . . . . 0.0 109.929 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.432 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -58.22 -50.89 71.96 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.438 -1.256 . . . . 0.0 110.928 -178.924 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.784 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 9.61 69.93 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 178.862 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 167.04 74.61 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 120.713 0.292 . . . . 0.0 111.482 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -165.8 156.4 13.22 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -102.94 143.75 32.12 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.828 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -96.57 169.21 10.05 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.985 0.422 . . . . 0.0 111.927 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 p-90 -125.61 -152.53 0.52 Allowed 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.235 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.75 127.88 56.26 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.084 -0.385 . . . . 0.0 111.675 -179.077 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.22 133.97 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.391 179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -147.73 126.3 12.49 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.366 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -178.84 147.61 0.37 Allowed 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.039 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -100.47 127.63 46.76 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.399 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -144.69 144.68 31.34 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.916 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -175.8 87.22 0.08 OUTLIER Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.571 -0.824 . . . . 0.0 113.582 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.2 ptt? -116.45 -174.31 2.54 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.604 0.202 . . . . 0.0 111.004 179.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 12.2 p -155.46 135.81 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.791 0.329 . . . . 0.0 111.374 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -130.89 -179.36 5.27 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.703 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 3.4 t -108.98 -125.35 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.885 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 55' ' ' VAL . . . 178.31 -85.02 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.537 0.208 . . . . 0.0 111.375 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.1 131.05 19.21 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.802 0.334 . . . . 0.0 111.143 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -154.02 50.53 0.66 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.286 0.565 . . . . 0.0 111.025 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.414 ' O ' ' C ' ' A' ' 60' ' ' GLU . 3.1 mp -133.09 -45.86 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.001 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.414 ' C ' ' O ' ' A' ' 59' ' ' ILE . 1.5 mp0 15.71 65.75 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.597 1.159 . . . . 0.0 113.621 178.478 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.76 133.9 18.27 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.992 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -160.35 158.53 29.81 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.334 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 111.79 138.97 7.64 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.829 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.6 t -160.76 145.89 14.36 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.637 0.256 . . . . 0.0 111.183 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -163.88 129.96 3.09 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.049 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -162.29 73.35 0.38 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.026 0.441 . . . . 0.0 111.54 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.92 63.2 0.63 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.154 0.502 . . . . 0.0 111.078 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.07 167.0 22.76 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.715 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.58 -61.46 0.19 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.058 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.22 -30.66 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 t0 82.13 -70.17 0.06 Allowed 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.779 -1.1 . . . . 0.0 111.685 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.707 -0.664 . . . . 0.0 111.198 179.692 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.423 ' N ' ' OD2' ' A' ' 10' ' ' ASP . 10.0 ttt . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.415 ' C ' ' O ' ' B' ' 101' ' ' MET . 0.1 OUTLIER -29.05 116.72 0.11 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.801 0.441 . . . . 0.0 111.866 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.602 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 1.3 tt0 -96.43 111.92 23.85 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.099 0.475 . . . . 0.0 111.747 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.46 ' HB2' HH11 ' B' ' 104' ' ' ARG . 0.1 OUTLIER -77.93 102.39 7.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.76 . . . . 0.0 112.198 -178.625 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.75 HD11 HG11 ' B' ' 128' ' ' VAL . 0.4 OUTLIER -104.92 117.44 50.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 177.114 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.767 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -120.81 123.25 42.14 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -175.364 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.985 HG12 HG22 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -100.26 103.32 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.111 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.829 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.6 p -71.65 91.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.994 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -93.33 -139.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 118.028 -0.987 . . . . 0.0 111.332 -178.143 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.629 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 28.4 t70 119.86 5.1 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.003 0.921 . . . . 0.0 109.49 -177.306 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -175.15 -26.87 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.754 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.2 OUTLIER -70.77 41.57 0.06 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -176.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.622 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.8 m 62.57 -0.32 0.55 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.994 ' CG ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -57.55 -52.04 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 179.856 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.559 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.98 -36.83 18.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.505 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.594 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.05 -56.49 21.32 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -179.661 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.85 HD21 ' CB ' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -48.26 -51.64 24.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.334 0.588 . . . . 0.0 111.603 -178.583 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.555 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.9 pttt -76.73 -26.68 54.88 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.891 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -63.55 -25.63 68.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.856 178.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.796 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -87.96 -42.38 12.51 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 118.524 -0.751 . . . . 0.0 109.8 178.698 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.541 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 158.41 37.04 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 177.264 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.706 HG13 ' O ' ' B' ' 122' ' ' VAL . 0.8 OUTLIER -163.21 92.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.109 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 1.015 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -70.71 61.89 0.25 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.176 0.512 . . . . 0.0 110.531 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.141 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.6 OUTLIER 39.37 -8.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 119.162 3.023 . . . . 0.0 119.162 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.522 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.61 -62.59 0.59 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.675 1.125 . . . . 0.0 110.944 -178.233 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.37 -30.15 25.62 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.44 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.57 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -60.87 -61.44 2.58 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 122.631 0.372 . . . . 0.0 111.447 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.141 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.2 t -55.18 -58.02 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-O 120.636 0.255 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.64 ' CB ' ' CB ' ' A' ' 12' ' ' ASP . 12.0 p -50.29 -41.56 50.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.187 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.8 m -74.38 -52.87 10.87 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.609 HG21 ' OG1' ' A' ' 31' ' ' THR . 0.6 OUTLIER -51.93 -44.18 63.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.174 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.0 ' HE2' HG23 ' A' ' 24' ' ' ILE . 25.9 mtt -49.29 -40.77 35.99 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.872 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -43.92 94.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.757 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -49.76 67.56 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.719 ' CG ' HD21 ' A' ' 17' ' ' LEU . 2.6 tp10 -60.71 -37.49 81.86 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.713 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -67.41 -49.94 61.62 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.904 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.65 -48.22 63.46 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 121.965 0.888 . . . . 0.0 109.187 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -51.92 -26.65 10.78 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.753 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.915 HD21 ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -96.34 71.91 2.78 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.075 0.464 . . . . 0.0 109.944 177.758 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 3.4 ttp180 -92.7 -12.72 30.71 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -179.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 63.67 -164.89 0.25 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.621 0.248 . . . . 0.0 111.465 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -159.51 111.27 2.07 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.735 0.302 . . . . 0.0 111.308 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 21.7 mtt85 65.82 -175.39 0.18 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.752 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 80.0 m95 70.59 -178.12 0.21 Allowed 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.739 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 3.2 ptpp? -173.47 -55.57 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.582 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 m 37.06 43.91 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 122.864 0.466 . . . . 0.0 112.201 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -61.28 98.42 0.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.253 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -158.8 163.06 37.05 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.067 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -160.78 165.14 30.83 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.472 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.38 178.01 5.64 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.126 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -130.78 -178.64 15.55 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.919 -0.658 . . . . 0.0 113.465 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 6.7 mtt -145.32 156.66 43.93 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.542 0.21 . . . . 0.0 110.882 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 153' ' ' VAL . . . . . 0.442 HG13 ' N ' ' B' ' 154' ' ' GLU . 8.2 p -104.06 -46.64 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 154' ' ' GLU . . . . . 0.442 ' N ' HG13 ' B' ' 153' ' ' VAL . 4.1 mt-10 -140.03 -71.74 0.38 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.523 0.201 . . . . 0.0 111.51 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.2 t -123.18 -125.12 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.864 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.476 ' O ' ' HD2' ' B' ' 157' ' ' ARG . . . -136.99 -45.43 0.57 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 157' ' ' ARG . . . . . 0.505 ' O ' ' CB ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER 69.27 124.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 122.82 0.448 . . . . 0.0 111.758 179.789 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.505 ' CB ' ' O ' ' B' ' 157' ' ' ARG . 0.3 OUTLIER 98.53 107.23 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.792 0.837 . . . . 0.0 110.079 -179.251 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 50.8 mt -122.09 -80.35 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.27 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 160' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' B' ' 161' ' ' MET . 0.1 OUTLIER -137.61 161.99 34.98 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.283 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 161' ' ' MET . . . . . 0.424 ' N ' ' HG3' ' B' ' 160' ' ' GLU . 2.2 ttm -82.92 -50.82 8.19 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.281 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -147.56 -59.26 0.26 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.406 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 135.17 -168.2 23.82 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 121.205 -0.522 . . . . 0.0 112.699 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 48.8 p -129.62 163.54 25.83 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -152.58 130.27 11.58 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.529 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -167.82 170.07 11.07 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.065 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 167' ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' B' ' 168' ' ' GLU . 4.6 p-10 -84.96 -114.16 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.084 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.436 ' HB3' ' O ' ' B' ' 167' ' ' ASP . 0.7 OUTLIER 177.29 154.65 0.27 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.925 0.393 . . . . 0.0 111.108 179.583 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 169' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' B' ' 170' ' ' LYS . 2.7 p30 -122.88 -88.15 0.62 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.728 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.486 ' HA ' ' HE3' ' B' ' 170' ' ' LYS . 1.3 tpmp? 170.87 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 35.05 58.78 0.75 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.674 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.115 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.702 " C2'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 105.54 2.029 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.734 " H2'" ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.715 0 C3'-C2'-C1' 105.583 2.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.734 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 C3'-C2'-C1' 104.546 1.318 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.485 ' H72' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.896 0 C4'-C3'-C2' 104.463 1.263 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.5 ' OP1' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C4'-C3'-C2' 104.68 1.48 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.639 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.991 0 C1'-O4'-C4' 107.256 -1.746 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.618 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.5 0 C3'-C2'-C1' 104.676 1.412 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.84 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.581 0 C3'-C2'-C1' 100.7 -1.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.84 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 O4'-C1'-C2' 107.124 0.931 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.663 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.406 -1.064 0 C3'-C2'-C1' 104.941 1.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.663 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O4'-C1'-N19 108.147 0.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.474 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 N19-C1'-C2' 115.274 0.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 C4'-C3'-C2' 100.916 -2.284 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.133 0.939 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.578 H2'' " O5'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 C3'-C2'-C1' 106.618 2.798 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.578 " O5'" H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C4'-C3'-C2' 104.025 0.825 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.724 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C4'-C3' 106.173 0.573 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.537 ' OP1' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.409 -0.847 0 C3'-C2'-C1' 105.616 2.083 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.558 ' H72' HG21 ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C3'-C2'-C1' 105.015 1.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.538 ' N7 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 C3'-C2'-C1' 104.852 1.537 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.508 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 N19-C1'-C2' 115.528 0.83 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.436 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.411 -0.719 0 C3'-C2'-C1' 105.559 2.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.41 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.951 0 C1'-O4'-C4' 107.691 -1.435 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.413 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C1'-C2' 107.241 1.037 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.413 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.712 0 C4'-C3'-C2' 104.337 1.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.401 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 C3'-C2'-C1' 101.91 -0.564 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 120.906 0.384 . . . . 0.0 111.445 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 168.82 97.76 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.207 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.641 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 2.0 tt0 -101.39 109.02 20.79 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 1.063 ' HG3' HG23 ' B' ' 108' ' ' THR . 4.2 ttm105 -78.5 103.84 8.71 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.748 HD11 HG11 ' A' ' 28' ' ' VAL . 1.7 pt -97.41 126.98 50.13 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.775 HG21 ' NH1' ' B' ' 104' ' ' ARG . 0.6 OUTLIER -131.73 123.95 28.76 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.08 -1.048 . . . . 0.0 113.561 -177.139 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.827 HG13 HG12 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -101.28 106.22 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 175.772 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.74 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 37.5 p -70.86 98.18 1.53 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.014 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.4 t -87.9 -137.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.78 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 24.6 t70 99.27 -9.82 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.901 0.881 . . . . 0.0 108.836 -176.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.2 m -136.98 -55.71 0.72 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.515 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.733 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.68 -92.33 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.462 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' B' ' 129' ' ' SER . 2.7 m 176.44 36.76 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 118.866 0.757 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.014 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.77 -43.99 14.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.174 -0.921 . . . . 0.0 113.162 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.573 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -49.1 -44.06 41.9 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.824 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.5 OUTLIER -54.04 -56.26 19.64 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.501 0.591 . . . . 0.0 112.265 179.821 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.692 HD13 ' CE2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -46.17 -51.22 14.55 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.567 0.699 . . . . 0.0 111.302 -178.207 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.573 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 17.6 pttt -79.05 -29.27 43.42 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.483 ' HB3' ' HA ' ' A' ' 16' ' ' LEU . . . -61.45 -23.52 65.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.491 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.001 ' CB ' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.97 -44.4 11.04 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 118.255 -0.879 . . . . 0.0 109.746 178.302 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.658 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 163.13 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 177.944 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.557 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -169.59 106.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -178.816 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.955 ' O ' HD12 ' A' ' 24' ' ' ILE . 9.2 m-20 -66.68 55.85 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.672 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.97 HG21 ' HE3' ' B' ' 132' ' ' MET . 1.6 pp 36.24 1.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.605 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 7.0 p -37.74 -63.59 0.45 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.913 0.779 . . . . 0.0 112.372 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.446 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -75.34 -20.3 78.93 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.259 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.762 HD12 ' CG2' ' A' ' 24' ' ' ILE . 2.2 tm? -72.93 -58.55 3.24 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 122.597 0.359 . . . . 0.0 110.934 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.969 HG12 ' SD ' ' A' ' 32' ' ' MET . 59.7 t -45.43 -69.99 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.728 0.299 . . . . 0.0 110.973 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.554 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 45.6 p -49.43 -34.11 15.73 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.026 0.53 . . . . 0.0 112.099 178.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.5 m -69.74 -53.93 16.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 m -52.0 -43.39 63.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.182 178.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.969 ' SD ' HG12 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -55.75 -48.59 74.99 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.906 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.525 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -60.06 -42.78 95.28 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.355 0.525 . . . . 0.0 110.608 179.638 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 83.0 m-20 -67.33 -49.58 63.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.749 ' HB3' HD21 ' B' ' 117' ' ' LEU . 17.3 tp10 -65.04 -29.15 70.03 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.341 177.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.708 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -68.16 -45.48 73.41 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -54.27 36.27 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.248 177.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.449 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.8 OUTLIER -75.01 -17.97 60.43 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.503 -1.226 . . . . 0.0 113.284 -177.41 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.636 HD11 ' CB ' ' B' ' 120' ' ' TYR . 1.0 OUTLIER -9.49 105.67 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -178.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER 85.77 -8.06 0.8 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 178.405 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.34 66.15 0.69 Allowed 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.6 141.35 35.11 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 120.751 0.31 . . . . 0.0 111.595 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 178.87 97.59 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.84 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -80.05 155.47 27.56 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.055 0.455 . . . . 0.0 111.8 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -153.34 162.44 41.29 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.972 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 3.6 t -125.05 60.54 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 120.954 0.407 . . . . 0.0 111.723 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.09 147.18 50.84 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.024 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -153.98 -178.12 6.87 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.24 124.66 11.63 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.231 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -82.5 179.97 7.62 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.708 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.9 116.57 1.88 Allowed Glycine 0 C--N 1.338 0.676 0 C-N-CA 121.144 -0.55 . . . . 0.0 113.034 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.0 mtm -148.76 -92.65 0.07 Allowed 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.619 0.209 . . . . 0.0 111.343 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.7 t 58.82 67.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-O 121.221 0.534 . . . . 0.0 111.34 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -113.07 101.63 9.63 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.177 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 96.3 t -142.64 -83.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 121.424 0.631 . . . . 0.0 111.819 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 70.26 85.39 0.13 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.64 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -158.04 126.67 5.54 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.682 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.527 ' O ' HD13 ' A' ' 59' ' ' ILE . 5.8 t80 165.19 105.44 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.053 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.527 HD13 ' O ' ' A' ' 58' ' ' PHE . 29.4 mm -144.44 63.68 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.614 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -140.96 175.34 9.69 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.401 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.5 mmm -153.31 177.17 11.15 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.43 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -114.72 161.72 17.77 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.415 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 161.72 136.88 2.08 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.245 -0.502 . . . . 0.0 112.638 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.9 t -148.95 153.48 38.02 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.076 0.465 . . . . 0.0 111.639 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -84.45 91.49 7.84 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.131 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -131.14 62.8 1.61 Allowed 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.135 0.493 . . . . 0.0 111.027 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -75.34 99.24 4.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.41 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -122.08 112.27 18.02 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.82 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -135.13 -74.84 0.46 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.11 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.45 ' HE2' ' O ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER 175.36 -32.15 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.45 ' O ' ' HE2' ' A' ' 70' ' ' LYS . 1.8 t0 91.45 139.08 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.227 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.256 1.395 0 CA-C-O 118.668 -0.682 . . . . 0.0 111.521 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.78 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -40.5 135.73 1.47 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.69 0.281 . . . . 0.0 111.09 179.868 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.672 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 1.1 tt0 -109.84 116.73 32.19 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.072 0.463 . . . . 0.0 111.671 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.775 ' NH1' HG21 ' A' ' 6' ' ' THR . 2.6 ttp85 -78.08 106.5 10.0 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.827 HG12 HG13 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -103.88 130.08 55.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.81 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.736 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -131.06 126.12 35.0 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.795 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.882 HG22 HG22 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -101.86 102.94 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.319 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 108' ' ' THR . . . . . 1.063 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -70.76 67.24 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 122.131 -0.356 . . . . 0.0 111.398 -179.472 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.882 HG22 HG22 ' B' ' 107' ' ' VAL . 3.7 m -99.31 -124.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.661 ' HB2' ' O ' ' B' ' 109' ' ' VAL . 10.4 t0 157.02 -83.13 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.543 ' HA ' ' CD ' ' B' ' 115' ' ' GLN . 3.8 t -102.63 12.56 36.18 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.638 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 29' ' ' SER . 1.8 t0 -75.56 59.28 1.11 Allowed 'General case' 0 C--N 1.36 1.059 0 CA-C-N 120.191 1.359 . . . . 0.0 108.304 178.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 29' ' ' SER . 13.3 m 64.11 -20.55 0.07 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.177 -177.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.787 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -46.61 -60.33 2.45 Favored 'General case' 0 C--N 1.351 0.674 0 CA-C-O 121.383 0.611 . . . . 0.0 110.326 179.305 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.654 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.8 pt20 -49.53 -40.39 37.77 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.766 -1.107 . . . . 0.0 112.643 -177.507 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.708 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -55.55 -42.09 74.16 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.751 HD11 ' HG ' ' B' ' 127' ' ' LEU . 0.5 OUTLIER -59.03 -52.4 65.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.633 179.753 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.704 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.5 pttt -73.38 -30.45 63.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.209 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.478 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.48 -29.21 67.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.198 178.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.703 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -87.7 -41.64 13.21 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.475 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.519 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 155.1 24.01 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 176.786 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 121' ' ' ASP . 71.0 t -162.38 101.58 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.629 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 33.4 m-80 -53.14 -84.62 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.11 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -161.89 3.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 178.308 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.483 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.2 OUTLIER -38.54 -63.5 0.5 Allowed 'General case' 0 C--O 1.241 0.658 0 CA-C-N 118.249 0.477 . . . . 0.0 110.691 -177.943 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -88.14 -29.91 18.61 Favored Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.234 178.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.751 ' HG ' HD11 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -58.6 -60.4 3.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.854 0.462 . . . . 0.0 111.127 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.11 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.3 t -55.16 -61.54 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.963 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.733 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.6 p -50.71 -42.17 56.8 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 178.127 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 16.5 m -67.82 -55.17 14.0 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.698 HG22 ' O ' ' B' ' 128' ' ' VAL . 1.8 t -53.55 -42.63 67.68 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.242 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.97 ' HE3' HG21 ' A' ' 24' ' ' ILE . 4.3 mtt -58.18 -54.93 41.38 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.587 178.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.17 -37.46 22.48 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.944 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -52.62 13.15 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.407 ' CB ' HD21 ' A' ' 17' ' ' LEU . 3.0 mp0 -69.45 -15.3 63.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.928 0.394 . . . . 0.0 110.343 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.625 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.96 -50.18 9.43 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.263 0.625 . . . . 0.0 109.512 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -54.33 29.59 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.718 0.77 . . . . 0.0 109.595 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -67.18 -42.42 84.26 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.916 -178.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.001 HD11 ' CB ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 29.1 62.73 0.13 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.489 0.661 . . . . 0.0 111.775 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.06 176.68 10.92 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.012 -179.602 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -149.05 159.6 44.08 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.22 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -137.67 -122.38 0.14 Allowed 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.373 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.43 ' O ' ' HB3' ' B' ' 144' ' ' TRP . 1.0 OUTLIER 77.42 157.92 0.19 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 122.537 0.335 . . . . 0.0 111.48 -179.749 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 144' ' ' TRP . . . . . 0.435 ' O ' ' HB3' ' B' ' 145' ' ' LYS . 63.9 t-105 87.82 129.03 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.087 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.435 ' HB3' ' O ' ' B' ' 144' ' ' TRP . 0.2 OUTLIER 169.52 121.84 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.386 179.423 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.1 p -147.4 150.22 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.678 0.275 . . . . 0.0 111.453 -179.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' B' ' 147' ' ' GLU . 3.6 pm0 -73.5 120.36 19.0 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.014 0.435 . . . . 0.0 111.183 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -138.01 152.01 48.45 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.49 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -134.26 142.16 47.24 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.292 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 72.84 147.77 0.09 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.772 0.32 . . . . 0.0 110.969 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -175.55 79.46 0.07 OUTLIER Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.672 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 64.9 mtm -111.21 164.62 12.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 3.2 t -141.75 46.72 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-O 121.045 0.45 . . . . 0.0 110.775 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -96.65 115.57 27.65 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.869 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 6.0 t -141.71 -123.56 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.826 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.668 ' HB1' ' CE1' ' B' ' 158' ' ' PHE . . . 56.93 76.75 0.29 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.195 0.521 . . . . 0.0 111.848 179.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.22 98.55 11.35 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.071 0.462 . . . . 0.0 111.155 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.668 ' CE1' ' HB1' ' B' ' 156' ' ' ALA . 0.0 OUTLIER -175.88 74.64 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.484 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 2.4 mp -116.69 -78.15 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.994 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -159.87 -62.97 0.07 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -152.6 178.38 9.66 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.908 0.385 . . . . 0.0 111.607 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -153.97 116.94 4.48 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.934 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 143.17 101.42 0.38 Allowed Glycine 0 C--N 1.335 0.477 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.099 -179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 164' ' ' SER . . . . . 0.512 ' O ' ' HB2' ' B' ' 165' ' ' PHE . 1.4 m -145.69 -153.43 0.48 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 122.731 -0.276 . . . . 0.0 111.34 -179.236 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 165' ' ' PHE . . . . . 0.512 ' HB2' ' O ' ' B' ' 164' ' ' SER . 1.0 OUTLIER 78.67 150.51 0.11 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.948 0.499 . . . . 0.0 111.519 -179.717 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -162.27 -69.65 0.05 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.127 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 60.41 27.34 16.94 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.46 72.97 1.39 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.129 0.49 . . . . 0.0 110.731 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -113.18 -165.07 0.96 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.577 -179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 1.1 ptmm? -161.67 -33.18 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.656 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 4.0 m-20 77.02 157.91 0.19 Allowed 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.85 178.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 63.1 p-90 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.524 -0.751 . . . . 0.0 111.425 -179.771 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.493 H2'' " H5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.803 0 C3'-C2'-C1' 105.591 2.065 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.895 H2'' ' N7 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 P--O3' 1.615 0.672 0 C3'-C2'-C1' 101.321 -0.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.895 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.562 0 O4'-C1'-C2' 107.246 1.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.74 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.862 0 C1'-O4'-C4' 107.822 -1.342 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.485 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C4'-C3'-C2' 104.232 1.032 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.629 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.827 0 C4'-C3'-C2' 104.744 1.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.621 " H2'" ' H72' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.53 0 C3'-C2'-C1' 105.327 1.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.814 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C3'-C2'-C1' 100.62 -1.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.814 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 O4'-C1'-C2' 107.145 0.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.564 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.526 0.794 0 C3'-C2'-C1' 105.494 1.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.564 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O4'-C1'-C2' 106.995 0.814 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.435 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 N19-C1'-C2' 115.23 0.644 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C4'-C3'-C2' 100.902 -2.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.504 ' H72' " H2'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 N19-C1'-C2' 115.45 0.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.504 " H2'" ' H72' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.777 0 C4'-C3'-C2' 104.884 1.684 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.498 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O4'-C1'-C2' 106.798 0.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.777 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 O4'-C4'-C3' 103.96 -1.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.777 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.405 -1.14 0 C4'-C3'-C2' 104.722 1.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.605 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C3'-C2'-C1' 105.022 1.658 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.461 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C3'-C2'-C1' 104.515 1.296 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.41 ' N3 ' ' N1 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 N19-C1'-C2' 115.315 0.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.515 H2'' " O5'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 C3'-C2'-C1' 105.232 1.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.515 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 C1'-O4'-C4' 107.956 -1.246 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 C1'-O4'-C4' 111.171 1.05 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.795 0 C4'-C3'-C2' 104.113 0.913 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 C1'-O4'-C4' 110.386 0.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.425 ' O ' ' HG2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.425 ' HG2' ' O ' ' A' ' 1' ' ' MET . 0.4 OUTLIER -146.48 127.0 14.12 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 179.251 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.685 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 46.1 tt0 -116.22 118.76 33.68 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.301 0.572 . . . . 0.0 110.601 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.945 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.18 105.9 10.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.206 -178.503 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.821 HD12 HD11 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -104.06 109.86 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.093 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.126 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -115.14 121.91 44.46 Favored 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.146 -176.587 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.872 HG13 HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.23 106.45 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 176.723 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.558 ' HB ' ' HB3' ' B' ' 102' ' ' LYS . 18.1 p -70.06 81.01 0.49 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.022 0.439 . . . . 0.0 110.601 -178.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 1.162 HG21 ' CD1' ' A' ' 14' ' ' TYR . 14.8 m -73.69 -141.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.627 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.644 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 27.4 t70 88.88 -12.45 0.41 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -124.53 -58.93 1.49 Allowed 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.664 ' HB2' ' OG ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.96 -98.59 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.546 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.5 OUTLIER -176.12 41.32 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.212 -0.93 . . . . 0.0 111.82 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 1.162 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -81.97 -41.49 20.71 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.94 0.896 . . . . 0.0 113.169 -179.474 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.536 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 1.8 mp0 -49.47 -46.59 48.25 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.522 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -50.02 -30.77 11.36 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.419 0.554 . . . . 0.0 111.917 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.045 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -78.14 -55.14 5.51 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.54 178.614 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.673 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -69.06 -25.54 64.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.335 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.54 -33.17 59.59 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.064 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.629 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 20.0 m-85 -88.87 -45.99 9.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.905 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.629 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 143.1 46.37 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 O-C-N 124.413 1.071 . . . . 0.0 110.824 178.85 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.618 HG21 HD21 ' B' ' 139' ' ' LEU . 7.5 t -128.24 73.45 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.333 -178.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.963 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -76.14 45.35 0.36 Allowed 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.983 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 39.91 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 118.316 2.71 . . . . 0.0 118.316 177.998 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . 1.039 ' HA ' HG22 ' B' ' 107' ' ' VAL . 3.1 p -39.35 -64.9 0.43 Allowed 'General case' 0 C--O 1.253 1.256 0 CA-C-N 119.272 0.942 . . . . 0.0 110.667 -177.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.416 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -80.53 -26.63 53.88 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.929 -0.653 . . . . 0.0 111.984 177.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.898 HD22 HD11 ' A' ' 17' ' ' LEU . 6.6 tp -66.2 -61.34 2.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.01 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.983 HG23 ' HB ' ' A' ' 24' ' ' ILE . 6.5 t -44.23 -66.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.486 ' HB3' ' O ' ' B' ' 112' ' ' ASP . 0.7 OUTLIER -50.03 -37.44 33.06 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 178.424 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.5 m -71.92 -58.5 3.4 Favored 'General case' 0 CA--C 1.507 -0.691 0 O-C-N 121.81 -0.556 . . . . 0.0 109.916 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.572 ' CG2' HD11 ' B' ' 127' ' ' LEU . 1.0 OUTLIER -54.47 -31.61 56.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.586 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.991 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.7 mmt -56.32 -57.26 13.02 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.083 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.581 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 2.6 tt0 -50.12 -34.16 21.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -72.33 -48.99 37.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.79 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.541 ' HB3' HD21 ' B' ' 117' ' ' LEU . 3.5 mm-40 -79.63 -15.25 57.97 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.754 0.312 . . . . 0.0 110.311 177.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.605 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -88.06 -29.96 20.27 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.159 0.584 . . . . 0.0 110.418 178.254 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -75.73 -55.41 5.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.582 0.706 . . . . 0.0 110.299 179.625 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -83.39 -35.66 24.9 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.04 -178.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.107 HD23 ' CD2' ' B' ' 120' ' ' TYR . 1.0 OUTLIER 46.11 28.34 0.64 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.986 0.514 . . . . 0.0 112.12 -178.913 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER 170.55 111.35 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.556 0.342 . . . . 0.0 110.782 179.611 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.72 -56.31 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.428 ' C ' ' HG3' ' A' ' 43' ' ' ARG . 0.6 OUTLIER 62.18 174.38 0.13 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.345 -179.726 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.428 ' HG3' ' C ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -144.2 -60.89 0.39 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.229 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER 43.53 63.45 1.55 Allowed 'General case' 0 C--O 1.238 0.467 0 CA-C-O 121.277 0.56 . . . . 0.0 111.036 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -154.66 149.84 27.02 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.219 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 12.8 p -79.57 143.98 11.64 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.24 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.18 150.18 39.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.351 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -116.92 -178.98 3.56 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.394 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -159.74 -153.61 0.36 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.397 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.421 ' O ' ' NH1' ' B' ' 143' ' ' ARG . 0.0 OUTLIER 71.2 175.66 0.29 Allowed 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 179.357 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 120.23 -116.42 3.24 Favored Glycine 0 C--N 1.338 0.692 0 CA-C-N 115.938 -0.573 . . . . 0.0 112.822 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.1 ttp 56.53 78.56 0.21 Allowed 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 11.3 m -83.78 176.97 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.961 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.672 ' CD ' HG23 ' A' ' 55' ' ' VAL . 4.8 tm-20 -75.04 -81.69 0.07 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.78 -0.191 . . . . 0.0 110.812 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.672 HG23 ' CD ' ' A' ' 54' ' ' GLU . 15.5 t -132.81 -122.36 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 110.459 -0.2 . . . . 0.0 110.459 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 55' ' ' VAL . . . 77.47 106.96 0.08 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.047 0.451 . . . . 0.0 111.108 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -103.92 138.66 40.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.52 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -173.7 102.88 0.11 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.238 0.542 . . . . 0.0 110.802 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 16.9 mm -90.49 77.47 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.346 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.92 167.48 26.51 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.178 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 69.93 -179.2 0.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.808 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -162.16 179.9 7.57 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.381 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 125.13 168.86 12.84 Favored Glycine 0 C--N 1.335 0.501 0 C-N-CA 121.13 -0.557 . . . . 0.0 112.959 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.1 m -129.96 76.99 1.76 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.901 0.381 . . . . 0.0 111.386 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.411 ' O ' ' HA ' ' B' ' 145' ' ' LYS . 0.6 OUTLIER -157.92 120.45 3.8 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.26 179.83 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.81 173.28 8.63 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.618 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.48 ' CG ' ' HB3' ' B' ' 147' ' ' GLU . 14.0 t70 -166.86 -55.25 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.008 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.604 ' H ' HG11 ' B' ' 146' ' ' VAL . 0.4 OUTLIER 79.19 -139.06 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.77 -179.34 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' A' ' 68' ' ' GLU . 0.6 OUTLIER 81.27 97.75 0.05 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.127 0.571 . . . . 0.0 110.947 -179.402 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.453 ' O ' ' CB ' ' A' ' 71' ' ' ASP . 14.4 mmtm -151.89 -41.21 0.11 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.453 ' CB ' ' O ' ' A' ' 70' ' ' LYS . 1.5 t70 93.88 -49.25 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.858 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 118.524 -0.751 . . . . 0.0 110.523 178.925 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.52 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 111.25 0.093 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.558 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 0.0 OUTLIER 81.34 114.12 0.06 Allowed 'General case' 0 N--CA 1.469 0.523 0 O-C-N 123.785 0.678 . . . . 0.0 111.088 -179.475 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.566 ' HB3' HG23 ' A' ' 9' ' ' VAL . 28.8 tp60 -98.72 116.52 31.14 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.242 0.544 . . . . 0.0 111.048 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.447 ' HB2' HH11 ' B' ' 104' ' ' ARG . 0.0 OUTLIER -78.55 99.9 6.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.483 -178.399 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.872 HG12 HG13 ' A' ' 7' ' ' VAL . 0.4 OUTLIER -103.05 118.51 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.067 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.682 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -122.33 129.4 52.11 Favored 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.871 -176.916 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 1.039 HG22 ' HA ' ' A' ' 25' ' ' SER . 0.9 OUTLIER -99.04 96.06 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.868 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.945 HG22 ' HG3' ' A' ' 4' ' ' ARG . 46.6 p -70.01 67.65 0.29 Allowed 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.957 HG11 ' CB ' ' B' ' 114' ' ' TYR . 6.7 p -80.56 -117.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.264 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.685 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 35.6 t70 85.47 1.29 0.7 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -174.184 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.54 ' H ' HG22 ' B' ' 109' ' ' VAL . 0.4 OUTLIER -101.45 -67.02 0.88 Allowed 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.269 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -133.78 142.3 47.85 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -176.512 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.64 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 46.48 -23.79 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 118.824 2.898 . . . . 0.0 118.824 174.89 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.957 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.6 OUTLIER -52.13 -61.99 1.92 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 120.079 1.309 . . . . 0.0 111.6 -178.314 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.635 ' HA ' ' HE3' ' B' ' 118' ' ' LYS . 77.6 mt-30 -49.56 -37.62 28.02 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.113 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.49 -57.16 14.17 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.872 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.991 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -49.5 -45.67 47.37 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.187 0.518 . . . . 0.0 111.674 -178.176 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.685 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.4 pttp -80.26 -36.83 34.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.249 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.558 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -68.29 -23.88 64.8 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.914 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 1.107 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -87.76 -42.71 12.41 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.04 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.45 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 163.34 17.91 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.535 ' C ' ' H ' ' B' ' 124' ' ' ILE . 72.4 t -146.98 85.28 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.349 0 O-C-N 121.581 -0.699 . . . . 0.0 112.709 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.883 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.4 OUTLIER -69.11 50.21 0.08 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.557 0.694 . . . . 0.0 109.977 178.515 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.034 HG22 HD12 ' B' ' 127' ' ' LEU . 1.6 pp 33.28 0.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 120.103 3.372 . . . . 0.0 120.103 179.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.547 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 0.4 OUTLIER -38.27 -62.47 0.58 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 118.525 0.602 . . . . 0.0 110.791 -178.944 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.403 ' N ' ' OG ' ' B' ' 125' ' ' SER . . . -80.66 -27.08 52.34 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.695 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 1.034 HD12 HG22 ' B' ' 124' ' ' ILE . 1.9 tm? -67.04 -61.49 1.91 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.929 0.365 . . . . 0.0 110.978 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.022 HG23 ' HB ' ' B' ' 124' ' ' ILE . 12.3 t -48.63 -68.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.249 0 C-N-CA 121.139 -0.224 . . . . 0.0 111.386 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.664 ' OG ' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -49.86 -31.27 11.65 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.0 m -71.65 -54.67 9.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.46 ' HA ' HD22 ' B' ' 134' ' ' ASN . 7.2 m -53.9 -36.47 62.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.183 178.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 132' ' ' MET . . . . . 1.045 ' SD ' HD12 ' A' ' 17' ' ' LEU . 5.3 mmm -53.15 -57.05 11.77 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.12 178.378 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.546 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -58.53 -36.01 73.2 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.109 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 134' ' ' ASN . . . . . 0.499 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.67 -48.42 22.12 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.087 -179.249 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.48 -19.25 60.45 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.692 177.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.522 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -72.37 -47.72 47.29 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 177.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.524 ' HA ' ' NE ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -65.84 -56.4 12.07 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-O 121.444 0.64 . . . . 0.0 109.912 178.22 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 -62.64 -51.63 66.51 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.32 -179.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.618 HD21 HG21 ' A' ' 22' ' ' VAL . 0.3 OUTLIER 33.17 43.37 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.542 0.737 . . . . 0.0 112.545 -179.309 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.57 97.77 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.614 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -81.86 125.79 31.11 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.684 -0.235 . . . . 0.0 111.429 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -165.53 101.2 0.7 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.814 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.421 ' NH1' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -166.27 179.52 5.61 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.756 0.312 . . . . 0.0 111.748 179.82 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -160.0 160.07 32.88 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.094 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 145' ' ' LYS . . . . . 0.442 ' HD2' ' N ' ' B' ' 146' ' ' VAL . 0.0 OUTLIER -86.7 118.28 26.0 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.9 0.381 . . . . 0.0 111.618 -179.69 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.604 HG11 ' H ' ' A' ' 68' ' ' GLU . 5.4 t -117.89 -82.54 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.089 178.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 147' ' ' GLU . . . . . 0.48 ' HB3' ' CG ' ' A' ' 67' ' ' ASP . 0.5 OUTLIER -143.61 -100.09 0.12 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 119.654 -0.213 . . . . 0.0 110.956 178.754 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -175.59 113.1 0.13 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.15 0.432 . . . . 0.0 111.812 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 149' ' ' GLN . . . . . 0.451 ' HG2' ' HA ' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -167.33 172.34 9.83 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.941 0.401 . . . . 0.0 111.799 179.736 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.48 135.41 51.2 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.832 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -94.2 176.83 36.08 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 121.079 -0.581 . . . . 0.0 112.662 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 6.7 tpt -123.07 112.59 17.94 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.929 0.395 . . . . 0.0 111.75 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 27.0 m -118.32 161.39 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.714 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.53 -148.81 0.43 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.453 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' B' ' 156' ' ' ALA . 3.6 t -116.19 -124.26 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 O-C-N 122.406 -0.184 . . . . 0.0 110.638 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' B' ' 155' ' ' VAL . . . 176.29 103.3 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.877 0.37 . . . . 0.0 111.234 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.73 149.0 25.59 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.155 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -176.67 104.99 0.06 Allowed 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.313 0.578 . . . . 0.0 110.746 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 159' ' ' ILE . . . . . 0.446 HD12 ' N ' ' B' ' 159' ' ' ILE . 0.7 OUTLIER -137.92 38.66 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.458 -179.723 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -48.99 -53.16 21.07 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.768 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 65.48 -164.69 0.24 Allowed 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.782 0.325 . . . . 0.0 111.434 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -122.45 168.9 11.54 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.813 0.34 . . . . 0.0 111.307 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -128.41 174.13 18.95 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 121.087 -0.577 . . . . 0.0 112.888 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.6 m -177.8 163.18 1.81 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.766 0.317 . . . . 0.0 111.364 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -130.48 168.1 17.57 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.23 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -139.25 -138.67 0.13 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.822 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.05 -25.95 66.51 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 111.438 0.162 . . . . 0.0 111.438 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 60.2 66.63 0.94 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.066 0.46 . . . . 0.0 111.159 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -92.33 -63.7 1.2 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.826 -179.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.497 ' O ' ' HB3' ' B' ' 171' ' ' ASP . 7.4 pttp -174.79 -37.22 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.497 ' HB3' ' O ' ' B' ' 170' ' ' LYS . 35.1 t70 95.88 116.1 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 124.758 1.286 . . . . 0.0 110.433 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.1 t90 . . . . . 0 C--O 1.253 1.244 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.893 -179.093 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.737 " C2'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.447 1.246 0 C2'-C3'-O3' 114.918 1.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.737 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.829 0 C3'-C2'-C1' 105.484 1.988 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.666 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C1'-O4'-C4' 110.533 0.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.654 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.963 0 C1'-O4'-C4' 107.502 -1.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.976 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C4'-C3'-C2' 104.332 1.132 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.976 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.408 -0.925 0 C1'-O4'-C4' 107.498 -1.573 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.837 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C3'-C2'-C1' 105.389 1.921 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.837 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.617 0 C3'-C2'-C1' 100.247 -1.752 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.59 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 C3'-C2'-C1' 104.574 1.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.656 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.898 0 C3'-C2'-C1' 105.063 1.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.656 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C1'-O4'-C4' 110.721 0.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.51 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 N19-C1'-C2' 115.006 0.503 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.568 0 C4'-C3'-C2' 100.94 -2.26 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.86 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.44 0.691 0 O4'-C1'-C2' 107.177 0.979 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.86 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 N19-C1'-C2' 115.777 0.986 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 O4'-C1'-C2' 107.062 0.875 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 101.978 -0.516 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.61 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.803 0 C4'-C3'-C2' 104.849 1.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.61 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.817 0 C4'-C3'-C2' 103.877 0.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.594 ' N7 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C3'-C2'-C1' 104.668 1.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.447 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 N19-C1'-C2' 115.581 0.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.434 ' C5 ' ' C4 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.739 0 C4'-C3'-C2' 104.818 1.618 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.434 ' C4 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.405 -1.126 0 C1'-O4'-C4' 106.985 -1.939 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 C1'-O4'-C4' 110.987 0.919 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.898 0 C4'-C3'-C2' 104.492 1.292 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.424 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 101.96 -0.528 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.618 ' HE3' ' HA ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -139.79 115.45 10.08 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.584 0.706 . . . . 0.0 111.517 178.753 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.657 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 43.4 tp60 -117.69 109.15 16.28 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.373 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 1.062 ' HG3' HG23 ' B' ' 108' ' ' THR . 17.8 ttp-105 -79.31 111.58 15.69 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.819 179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.787 HD11 HG11 ' A' ' 28' ' ' VAL . 3.3 pt -102.34 127.8 55.61 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.771 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -131.71 124.73 30.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -177.791 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.622 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -99.43 105.56 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.206 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.653 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 14.5 p -70.19 89.72 0.65 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 178.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.852 HG11 ' CB ' ' A' ' 14' ' ' TYR . 3.8 p -108.36 -119.89 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.814 -177.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.681 ' N ' HG22 ' A' ' 9' ' ' VAL . 0.8 OUTLIER 77.41 10.25 2.41 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-O 122.491 1.138 . . . . 0.0 109.089 -174.747 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.443 ' OG ' ' NZ ' ' B' ' 102' ' ' LYS . 0.5 OUTLIER -128.46 -66.83 0.82 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.507 178.59 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.824 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 1.1 m-20 -51.74 -79.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -177.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.728 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 1.0 OUTLIER 177.28 40.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.39 0.995 . . . . 0.0 111.683 -178.513 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.852 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.67 -49.84 9.38 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.333 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.56 ' CD ' ' HA ' ' A' ' 10' ' ' ASP . 1.1 mp0 -49.33 -37.69 25.31 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.984 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.7 OUTLIER -56.61 -56.73 17.63 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.598 0.636 . . . . 0.0 111.687 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.786 ' HB2' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.48 -48.11 56.91 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.108 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.559 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 1.9 pttt -80.28 -35.59 35.65 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.475 -178.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.518 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -70.39 -22.64 62.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.256 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.146 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -87.83 -41.54 13.18 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.855 179.269 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.518 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 168.52 -7.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 177.382 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.685 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 72.2 t -122.08 85.95 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -177.291 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.028 ' O ' HD12 ' A' ' 24' ' ' ILE . 11.2 p30 -65.08 48.41 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.701 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.028 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 48.08 -15.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 117.203 2.298 . . . . 0.0 117.203 -179.546 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 23' ' ' ASN . 30.4 t -38.28 -62.84 0.54 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 119.137 0.88 . . . . 0.0 109.509 -178.315 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.483 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.28 -27.21 40.78 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.245 177.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.59 ' CD1' ' HG3' ' B' ' 132' ' ' MET . 0.1 OUTLIER -60.02 -62.24 2.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.972 0.386 . . . . 0.0 110.703 179.958 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.918 HG23 ' CG2' ' A' ' 24' ' ' ILE . 12.4 t -51.43 -66.38 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.775 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.535 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 15.5 p -47.2 -40.84 16.97 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.483 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -78.1 -47.82 17.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.558 1.072 . . . . 0.0 109.304 178.321 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.788 HG21 HG21 ' B' ' 131' ' ' THR . 9.0 m -53.24 -47.37 69.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.796 ' HA ' HD23 ' B' ' 117' ' ' LEU . 6.2 mmt -55.05 -46.83 75.4 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.656 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.528 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -57.3 -49.1 77.17 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.936 0.398 . . . . 0.0 110.336 178.445 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.477 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.64 -50.49 69.11 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.906 ' HB3' HD21 ' B' ' 117' ' ' LEU . 2.9 mm-40 -72.13 -8.59 55.53 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.808 178.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.624 ' O ' HD11 ' A' ' 39' ' ' LEU . . . -88.39 -44.1 11.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 122.667 0.387 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -57.36 4.39 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.546 0.689 . . . . 0.0 110.004 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.483 ' C ' HD12 ' A' ' 39' ' ' LEU . 2.3 mtt180 -85.0 -36.53 21.24 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.55 -1.204 . . . . 0.0 113.352 -178.204 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.891 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER 42.47 66.36 0.76 Allowed 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.779 0.432 . . . . 0.0 110.578 -176.778 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -174.24 112.8 0.17 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.883 0.373 . . . . 0.0 111.67 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -114.75 122.94 47.96 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.672 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.33 177.7 8.25 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.082 0.468 . . . . 0.0 111.822 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.59 146.96 53.93 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.836 -179.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -117.77 161.04 20.35 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.471 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -100.12 -95.28 0.26 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 111.569 0.211 . . . . 0.0 111.569 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.7 p -177.84 157.12 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 120.987 0.422 . . . . 0.0 111.811 -179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.29 175.32 8.36 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.037 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -94.91 -168.63 1.85 Allowed 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.205 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -122.54 134.13 54.55 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.63 0.252 . . . . 0.0 111.162 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.02 157.93 43.77 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.754 0.312 . . . . 0.0 111.464 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 176.71 165.03 31.6 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.407 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.99 -66.64 0.3 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.8 p -142.81 162.75 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 120.769 0.319 . . . . 0.0 111.852 -179.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -49.03 152.78 1.01 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.457 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.6 t -113.33 -122.62 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.886 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -161.87 94.57 0.94 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.96 0.41 . . . . 0.0 111.443 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.02 161.19 5.26 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.698 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -168.63 102.14 0.41 Allowed 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.058 0.456 . . . . 0.0 110.434 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.451 HG12 ' HB ' ' A' ' 30' ' ' THR . 2.9 mt -109.02 -90.11 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.628 -0.715 . . . . 0.0 112.255 -178.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 45.73 81.2 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.12 0.486 . . . . 0.0 111.913 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.526 ' HG2' ' HG3' ' A' ' 33' ' ' GLN . 14.2 tpp -132.71 86.01 2.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.702 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -104.22 171.12 7.51 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.387 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 128.81 136.31 4.13 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.212 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.8 t -153.91 145.06 22.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.567 0.223 . . . . 0.0 111.083 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -174.23 98.48 0.1 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.186 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -162.02 54.41 0.24 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.091 0.472 . . . . 0.0 111.271 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -112.85 98.84 7.45 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.447 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.78 173.17 6.34 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.13 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -113.64 -164.89 0.95 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.749 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.49 ' NZ ' ' O ' ' A' ' 72' ' ' TRP . 0.6 OUTLIER -154.77 -44.17 0.09 Allowed 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.74 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' A' ' 72' ' ' TRP . 10.0 t70 80.48 111.75 0.07 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.115 -1.402 . . . . 0.0 111.912 178.557 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.49 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.3 t90 . . . . . 0 C--O 1.253 1.286 0 CA-C-O 118.709 -0.662 . . . . 0.0 111.416 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 2.9 ptt? . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 111.061 0.023 . . . . 0.0 111.061 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.443 ' NZ ' ' OG ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -77.52 144.68 37.47 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.668 0.271 . . . . 0.0 110.651 179.427 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.671 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 1.6 tp60 -114.2 121.77 44.75 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.146 0.498 . . . . 0.0 110.22 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.64 ' HD2' ' O4 ' ' C' ' 178' ' ' ' DT' . 0.3 OUTLIER -78.83 112.39 15.93 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.071 -179.454 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 0.755 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -113.7 114.04 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.771 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -117.57 129.01 55.51 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.928 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.999 HG23 HG13 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -102.37 102.59 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 174.667 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 108' ' ' THR . . . . . 1.062 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -71.22 67.29 0.45 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.371 -0.531 . . . . 0.0 111.223 -179.18 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.999 HG13 HG23 ' B' ' 107' ' ' VAL . 4.7 m -96.14 -127.64 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.736 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.657 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 1.4 t70 154.12 -89.18 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 111' ' ' SER . . . . . 0.647 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 39.0 t -94.19 9.47 37.8 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 118.685 -0.674 . . . . 0.0 111.521 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.535 ' O ' ' HA ' ' A' ' 29' ' ' SER . 2.3 m-20 -74.64 56.2 0.69 Allowed 'General case' 0 C--N 1.365 1.277 0 CA-C-N 119.943 1.247 . . . . 0.0 109.271 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.55 ' HA ' HD12 ' B' ' 116' ' ' LEU . 0.9 OUTLIER 62.07 -14.78 0.05 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.983 -178.774 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.825 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.2 OUTLIER -53.87 -54.67 35.32 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.117 0.484 . . . . 0.0 110.135 178.974 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.657 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.38 -41.11 27.9 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.168 -178.17 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 3.9 mt -52.46 -53.89 39.56 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.044 -0.41 . . . . 0.0 111.433 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.906 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -53.12 -41.1 64.71 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.764 0.792 . . . . 0.0 111.727 179.785 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.825 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.6 pttt -79.81 -25.74 40.75 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.51 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -59.24 -23.36 62.27 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.891 ' CD2' HD23 ' A' ' 39' ' ' LEU . 2.1 m-85 -88.35 -37.88 15.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.987 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.643 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.2 t70 117.98 75.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.629 1.205 . . . . 0.0 111.948 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.848 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -166.8 -40.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.859 -179.306 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 65.59 -108.04 0.15 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 0.965 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -153.06 2.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 178.576 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.553 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 81.8 p -39.04 -63.26 0.55 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.472 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.27 -31.52 19.37 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.303 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.723 ' HB3' HG22 ' B' ' 124' ' ' ILE . 8.4 tp -56.97 -62.2 1.91 Allowed 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 117.3 0.55 . . . . 0.0 111.52 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 0.965 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.5 t -53.48 -59.55 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.797 0.808 . . . . 0.0 109.079 178.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.824 ' HB3' ' CB ' ' A' ' 12' ' ' ASP . 3.5 m -48.29 -50.09 31.28 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.194 -1.366 . . . . 0.0 112.965 179.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.472 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -83.57 -50.3 8.37 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 122.163 -0.336 . . . . 0.0 111.587 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.788 HG21 HG21 ' A' ' 31' ' ' THR . 0.5 OUTLIER -55.62 -41.94 74.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -179.153 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.953 ' SD ' HG13 ' B' ' 128' ' ' VAL . 0.0 OUTLIER -60.73 -46.72 89.32 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.333 178.912 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.728 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.6 OUTLIER -49.26 -35.87 18.9 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.179 0.445 . . . . 0.0 110.526 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 134' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -70.71 -49.22 49.29 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.513 179.279 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.591 ' CB ' HD21 ' A' ' 17' ' ' LEU . 30.3 mm-40 -77.92 -13.67 59.8 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.964 0.411 . . . . 0.0 110.612 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.984 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -83.55 -34.64 25.18 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.371 0.669 . . . . 0.0 110.074 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.81 -50.89 8.18 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.985 0.898 . . . . 0.0 109.933 178.104 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 138' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -62.39 -20.21 64.21 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 113.849 -1.523 . . . . 0.0 114.143 -177.178 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 1.146 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -43.67 118.38 1.39 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.67 0.668 . . . . 0.0 111.081 -179.418 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.42 156.21 8.13 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -179.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -132.94 124.78 28.45 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.877 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' B' ' 143' ' ' ARG . 9.8 tm-20 -62.3 -73.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.194 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 143' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER 177.07 -58.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.413 -179.818 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 29.4 t-105 -118.6 -29.85 5.31 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.38 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.62 102.08 0.07 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.015 0.436 . . . . 0.0 110.912 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.562 ' O ' HG13 ' B' ' 146' ' ' VAL . 8.9 p -69.21 79.08 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.332 0.587 . . . . 0.0 111.251 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.09 176.32 5.19 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.362 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -143.78 156.13 44.39 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.017 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -91.33 66.95 5.65 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.151 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.74 -59.25 5.68 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.252 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 101.46 163.1 27.27 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.984 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -103.05 123.36 46.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.722 0.296 . . . . 0.0 110.87 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 10.5 p -94.91 139.76 18.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.39 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.02 176.85 9.4 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.213 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.401 HG12 ' N ' ' B' ' 156' ' ' ALA . 5.6 t -104.57 -123.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.228 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.401 ' N ' HG12 ' B' ' 155' ' ' VAL . . . -175.58 58.89 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.705 0.288 . . . . 0.0 111.239 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 55.13 -166.47 0.1 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.463 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.77 99.89 0.23 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.009 0.433 . . . . 0.0 111.137 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 24.1 mm -139.39 104.16 2.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.04 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -75.85 114.88 14.97 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.324 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 9.0 mmt -122.71 144.26 49.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.019 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.45 132.11 35.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.14 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -91.58 179.73 41.84 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.617 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 11.3 p -158.09 159.99 36.85 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.595 0.236 . . . . 0.0 111.057 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -150.73 166.08 31.53 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.449 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -134.01 127.66 32.76 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.466 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.78 126.15 54.51 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.896 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.31 152.77 26.42 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.246 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -175.8 -161.82 0.09 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.493 ' O ' ' HB3' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -175.08 -31.41 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.405 -179.807 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.493 ' HB3' ' O ' ' B' ' 170' ' ' LYS . 36.6 t70 90.81 -105.33 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.392 1.077 . . . . 0.0 111.285 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 40.0 t-105 . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.071 -0.966 . . . . 0.0 111.159 -179.936 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.495 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 C3'-C2'-C1' 101.285 -1.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.594 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 101.333 -0.976 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.594 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 O4'-C1'-C2' 107.415 1.195 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.653 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.981 0 C1'-O4'-C4' 107.173 -1.805 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.628 " O5'" H2'' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-C2' 107.111 0.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.64 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.408 -0.951 0 C1'-O4'-C4' 107.399 -1.643 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.522 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 C3'-C2'-C1' 104.996 1.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.714 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 C3'-C2'-C1' 100.754 -1.39 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.714 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 O4'-C1'-C2' 107.248 1.043 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.582 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.944 0 C3'-C2'-C1' 105.003 1.645 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.582 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O4'-C1'-C2' 107.116 0.924 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.472 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 C4'-C3'-C2' 103.967 0.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.579 0 C4'-C3'-C2' 100.947 -2.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 O4'-C1'-C2' 106.951 0.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.485 H2'' " O5'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C3'-C2'-C1' 106.564 2.76 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.485 " O5'" H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 105.207 1.791 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.555 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O5'--C5' 1.432 -0.519 0 C4'-C3'-C2' 103.979 0.779 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.516 ' C8 ' ' C7 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.528 1.018 0 C1'-O4'-C4' 105.987 -2.652 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.718 " H2'" ' N7 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 105.308 1.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.718 ' N7 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 106.212 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.539 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 C3'-C2'-C1' 104.845 1.532 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.602 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 C3'-C2'-C1' 104.399 1.214 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.602 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.079 0 C1'-O4'-C4' 106.778 -2.087 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.429 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.572 0 C1'-O4'-C4' 110.881 0.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.429 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C4'-C3'-C2' 104.072 0.872 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.455 ' C2 ' ' N1 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 O4'-C4'-C3' 106.106 0.506 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.485 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 1.7 ttp . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 120.562 0.22 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 1' ' ' MET . 7.4 mmtm 72.44 133.73 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.234 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.583 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 2.0 tt0 -108.8 112.38 24.62 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.531 0.681 . . . . 0.0 111.535 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.911 ' HG2' HG22 ' B' ' 106' ' ' THR . 8.3 ttm-85 -79.57 99.98 7.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.171 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.914 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -101.87 130.3 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.969 0 N-CA-C 106.787 -1.561 . . . . 0.0 106.787 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.974 ' HB ' HG23 ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.09 134.23 50.28 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.344 -0.942 . . . . 0.0 112.765 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 1.009 ' O ' HG23 ' B' ' 105' ' ' ILE . 0.9 OUTLIER -99.53 81.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.493 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.536 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 69.7 p -68.89 71.3 0.22 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.162 -0.961 . . . . 0.0 110.85 -178.191 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.852 HG21 ' HB3' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -77.89 -102.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.729 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.722 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 27.3 t0 113.88 14.09 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.363 0.665 . . . . 0.0 110.719 -178.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 177.73 -23.09 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.68 ' HB2' HG11 ' A' ' 9' ' ' VAL . 2.4 m-20 -72.27 56.01 0.34 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 -176.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.542 ' O ' ' HB3' ' B' ' 132' ' ' MET . 61.6 m 57.91 0.91 0.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.383 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.852 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.02 -49.31 62.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.507 ' HG3' ' CD2' ' A' ' 14' ' ' TYR . 4.5 mt-30 -49.41 -36.94 23.66 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -176.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -63.16 -56.37 17.35 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.736 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -46.47 -47.17 19.27 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 112.169 -178.159 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.518 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 1.4 pttt -79.57 -29.67 41.36 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.818 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.443 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -74.82 -25.35 58.96 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.019 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.947 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.9 -38.13 15.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.234 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.507 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 158.28 12.97 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 177.255 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.484 ' O ' HG12 ' A' ' 22' ' ' VAL . 75.8 t -134.34 79.91 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.584 -0.697 . . . . 0.0 111.716 -178.676 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.983 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.7 OUTLIER -66.66 52.92 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.945 0.403 . . . . 0.0 111.349 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.983 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER 41.6 -8.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 118.375 2.731 . . . . 0.0 118.375 178.887 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.996 ' HA ' HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.73 -62.48 0.61 Allowed 'General case' 0 C--O 1.245 0.837 0 CA-C-N 120.13 1.332 . . . . 0.0 109.852 -178.464 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.85 -24.89 57.31 Favored Glycine 0 CA--C 1.522 0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.621 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.7 ' HB3' HG22 ' A' ' 24' ' ' ILE . 7.8 tp -67.49 -61.5 1.87 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 117.207 0.503 . . . . 0.0 111.471 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.986 HG22 ' CG2' ' B' ' 128' ' ' VAL . 33.5 t -45.0 -63.0 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.61 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.778 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 7.4 p -48.78 -47.32 41.97 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.988 1.315 . . . . 0.0 113.091 177.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.6 m -61.5 -51.26 69.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.45 ' OG1' HG21 ' B' ' 131' ' ' THR . 7.1 m -59.11 -41.84 89.12 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.27 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.881 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -52.64 -52.23 56.54 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.174 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.471 ' HB2' ' CB ' ' B' ' 113' ' ' SER . 2.3 tt0 -62.79 -51.71 66.01 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.269 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -56.28 -51.35 68.47 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HG2' HD21 ' B' ' 127' ' ' LEU . 3.0 tp10 -65.8 -29.07 69.5 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.204 178.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.67 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -70.48 -44.31 67.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.116 0.484 . . . . 0.0 110.257 178.327 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -56.28 7.19 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.38 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.33 -33.98 25.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.704 -1.134 . . . . 0.0 113.646 -176.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.484 HD23 ' HA ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER 30.8 53.69 0.17 Allowed 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.321 0.581 . . . . 0.0 111.811 -178.066 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 1.1 tpt180 177.75 84.03 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.898 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -142.85 147.83 36.05 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.605 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.31 171.63 11.74 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.063 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -82.68 -62.64 1.55 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 68.11 173.13 0.28 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.075 0.464 . . . . 0.0 111.932 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -175.69 140.95 0.47 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.188 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.427 HG22 ' H ' ' A' ' 47' ' ' GLU . 3.3 p -140.94 165.86 19.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.551 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.427 ' H ' HG22 ' A' ' 46' ' ' VAL . 1.5 mm-40 -83.94 178.44 7.88 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.988 0.423 . . . . 0.0 111.834 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -157.86 -176.69 6.07 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.021 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.47 146.44 35.94 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.033 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -77.08 158.96 30.18 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.988 0.423 . . . . 0.0 111.271 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -100.44 161.53 18.93 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 121.036 -0.602 . . . . 0.0 113.077 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.8 ptm -119.76 173.12 7.22 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.804 0.335 . . . . 0.0 111.479 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.4 m -122.62 153.03 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.483 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -118.05 168.61 10.38 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.467 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.588 HG12 ' HD3' ' A' ' 57' ' ' ARG . 2.4 t -109.53 -10.3 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.823 179.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.413 ' O ' ' HD2' ' A' ' 57' ' ' ARG . . . 47.81 66.62 0.99 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.031 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.588 ' HD3' HG12 ' A' ' 55' ' ' VAL . 4.3 mpt_? -129.54 110.53 11.92 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.089 0.471 . . . . 0.0 111.851 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -148.47 89.94 1.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.295 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 65.6 mt -129.03 -59.87 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.827 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -55.24 128.96 36.45 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.984 0.421 . . . . 0.0 111.284 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.9 mtp -174.2 125.94 0.34 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.645 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -118.06 138.46 52.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.855 0.359 . . . . 0.0 111.573 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -128.53 84.84 0.32 Allowed Glycine 0 C--N 1.334 0.445 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.444 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.3 t -82.33 -170.87 3.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.971 0.415 . . . . 0.0 111.575 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.52 ' O ' ' HB3' ' A' ' 66' ' ' ALA . 2.4 m-85 -125.2 -172.29 2.55 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.254 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' A' ' 65' ' ' PHE . . . 79.12 157.28 0.16 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.713 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -133.17 -63.15 0.77 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.151 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -178.86 4.9 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.813 0.339 . . . . 0.0 111.497 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.16 -58.48 2.13 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 71' ' ' ASP . 16.6 ttpp 177.74 -31.15 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.263 0.554 . . . . 0.0 109.538 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.491 ' HB3' ' O ' ' A' ' 70' ' ' LYS . 20.6 t70 75.77 -70.58 0.14 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.764 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.418 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.3 t90 . . . . . 0 C--O 1.255 1.363 0 CA-C-O 118.587 -0.72 . . . . 0.0 111.141 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 101' ' ' MET . . . . . 0.524 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 9.2 tpt . . . . . 0 N--CA 1.495 1.791 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 102' ' ' LYS . . . . . 0.722 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER 79.47 138.16 0.07 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.069 0.461 . . . . 0.0 110.351 -178.87 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 103' ' ' GLN . . . . . 0.478 ' CG ' ' HE2' ' A' ' 14' ' ' TYR . 9.4 tp-100 -121.95 117.5 26.57 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.938 0.875 . . . . 0.0 110.553 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 104' ' ' ARG . . . . . 0.749 ' NH1' ' H62' ' C' ' 179' ' ' ' DA' . 39.6 ttt85 -79.26 109.43 13.59 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.095 -1.412 . . . . 0.0 112.899 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 105' ' ' ILE . . . . . 1.009 HG23 ' O ' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -96.58 116.87 39.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.892 0 N-CA-C 103.739 -2.689 . . . . 0.0 103.739 174.4 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.974 HG23 ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -118.52 112.18 19.57 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.593 -174.917 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 107' ' ' VAL . . . . . 0.996 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.0 OUTLIER -102.44 106.17 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.525 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 108' ' ' THR . . . . . 0.79 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 25.6 p -72.07 90.38 1.18 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.822 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.68 -146.75 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 118.882 -0.58 . . . . 0.0 111.832 -178.38 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 110' ' ' ASP . . . . . 0.591 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 8.7 t70 105.13 5.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 24.6 t -150.23 -41.18 0.13 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 113.66 -1.609 . . . . 0.0 110.414 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 112' ' ' ASP . . . . . 0.778 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.3 OUTLIER -74.71 33.78 0.1 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.501 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.471 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.2 OUTLIER 72.21 3.86 4.82 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 177.383 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 114' ' ' TYR . . . . . 0.914 ' CE1' HG21 ' A' ' 5' ' ' ILE . 1.9 t80 -57.75 -55.63 32.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.203 0.456 . . . . 0.0 111.507 179.693 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 115' ' ' GLN . . . . . 0.562 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 15.2 mt-30 -49.68 -42.7 46.27 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -177.414 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 116' ' ' LEU . . . . . 0.67 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -49.19 -30.66 7.21 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.692 0.282 . . . . 0.0 111.726 179.774 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 117' ' ' LEU . . . . . 0.697 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.56 -57.55 3.71 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.372 0.606 . . . . 0.0 111.574 178.314 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 118' ' ' LYS . . . . . 0.61 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -65.09 -25.48 67.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.995 -179.909 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 119' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.95 -27.98 47.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.079 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 120' ' ' TYR . . . . . 0.554 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.1 m-30 -88.21 -47.41 8.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.667 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.554 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 5.0 m-20 143.45 41.51 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.193 0.933 . . . . 0.0 110.52 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 122' ' ' VAL . . . . . 0.737 HG13 ' O ' ' B' ' 122' ' ' VAL . 6.1 p -160.25 87.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-O 121.661 0.743 . . . . 0.0 111.592 -177.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 123' ' ' ASN . . . . . 0.702 ' O ' ' HE1' ' A' ' 32' ' ' MET . 1.2 m120 -63.22 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 124' ' ' ILE . . . . . 1.025 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -146.86 4.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 125' ' ' SER . . . . . 0.872 ' HA ' HG22 ' A' ' 7' ' ' VAL . 1.2 t -39.51 -64.63 0.46 Allowed 'General case' 0 C--O 1.244 0.814 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.011 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.94 -21.53 45.98 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 127' ' ' LEU . . . . . 0.696 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -64.43 -56.72 12.38 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 122.73 0.412 . . . . 0.0 110.911 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 128' ' ' VAL . . . . . 1.025 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.2 t -56.67 -60.99 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 129' ' ' SER . . . . . 0.656 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.2 p -47.15 -38.8 12.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.147 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 93.1 m -70.96 -48.58 52.59 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 131' ' ' THR . . . . . 0.463 HG23 HD21 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -66.62 -31.86 72.81 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.124 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 132' ' ' MET . . . . . 0.736 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 4.7 mmt -65.39 -57.04 9.33 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 133' ' ' GLN . . . . . 0.51 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -48.79 -37.13 18.28 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 -75.05 -41.41 59.14 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.997 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.669 ' CB ' HD21 ' A' ' 17' ' ' LEU . 1.6 mm-40 -84.25 -12.75 54.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.81 0.338 . . . . 0.0 110.832 177.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 136' ' ' ALA . . . . . 0.652 ' O ' HD11 ' B' ' 139' ' ' LEU . . . -87.34 -29.61 21.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.42 0.688 . . . . 0.0 109.313 178.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 137' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 2.1 mmt180 -81.45 -48.25 12.13 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.763 0.792 . . . . 0.0 110.102 178.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -78.7 -40.27 34.19 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 113.958 -1.474 . . . . 0.0 112.969 -177.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 139' ' ' LEU . . . . . 0.947 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 26.79 67.67 0.06 Allowed 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.496 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.441 ' HD3' ' O ' ' B' ' 140' ' ' ARG . 0.0 OUTLIER -95.37 13.3 26.24 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -95.19 43.07 1.09 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -97.71 174.08 6.8 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.967 0.413 . . . . 0.0 111.828 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -46.6 141.67 3.62 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.351 -179.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -131.4 167.04 19.97 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.185 0.516 . . . . 0.0 111.772 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 41.0 mttt -87.52 -57.38 2.97 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.7 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 40.3 t 48.84 79.44 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -179.28 156.04 0.74 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.553 179.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.33 54.59 0.31 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.896 0.379 . . . . 0.0 110.959 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -172.87 142.65 1.14 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.02 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -95.37 -58.11 2.22 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.05 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 161.23 -143.84 9.28 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.489 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 14.1 mmt -98.39 102.38 14.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.876 0.369 . . . . 0.0 110.807 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 22.2 t -85.21 75.75 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.353 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -178.94 -85.1 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.065 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 155' ' ' VAL . . . . . 0.532 ' O ' ' HB3' ' B' ' 156' ' ' ALA . 0.8 OUTLIER 51.38 126.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 CA-C-O 123.461 1.601 . . . . 0.0 115.314 179.453 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 156' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' B' ' 155' ' ' VAL . . . 88.4 107.81 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 111.423 -2.626 . . . . 0.0 112.164 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -141.26 103.46 4.43 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.529 179.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 158' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -168.93 83.13 0.14 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.135 0.493 . . . . 0.0 111.63 -179.495 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 21.4 mm -119.67 93.32 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.009 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -85.45 5.78 29.66 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 1.1 mmt -72.76 69.15 0.9 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.247 0.546 . . . . 0.0 110.408 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -69.9 68.16 0.28 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.495 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -68.46 -42.07 82.84 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 121.231 -0.509 . . . . 0.0 113.139 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 71.17 77.18 0.18 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.008 0.432 . . . . 0.0 111.57 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -158.47 134.3 9.0 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.959 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -155.34 62.91 0.62 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.991 0.424 . . . . 0.0 111.675 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.88 67.39 1.22 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.286 0.565 . . . . 0.0 111.596 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -70.77 82.37 0.63 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.974 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -97.11 176.67 5.85 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.641 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 170' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 0.0 OUTLIER 176.76 -26.92 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.267 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 171' ' ' ASP . . . . . 0.515 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 6.3 m-20 80.0 141.07 0.07 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.65 179.242 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 54.1 m95 . . . . . 0 C--O 1.25 1.112 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.034 -179.646 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 173' ' ' ' DA' . . . . . 0.441 " H1'" " H5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.442 0.882 0 C4'-C3'-C2' 104.876 1.676 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 174' ' ' ' DT' . . . . . 0.649 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.721 0 C4'-C3'-C2' 101.758 -1.442 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 175' ' ' ' DA' . . . . . 0.649 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.521 0 C3'-C2'-C1' 104.997 1.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 176' ' ' ' DT' . . . . . 0.602 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.799 0 C1'-O4'-C4' 107.621 -1.485 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 177' ' ' ' DG' . . . . . 0.678 ' OP2' ' HA ' ' A' ' 7' ' ' VAL . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 C4'-C3'-C2' 104.286 1.086 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 178' ' ' ' DT' . . . . . 0.598 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.85 0 C3'-C2'-C1' 104.876 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 179' ' ' ' DA' . . . . . 0.749 ' H62' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.432 -0.49 0 C3'-C2'-C1' 105.551 2.036 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 180' ' ' ' DT' . . . . . 0.624 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 C3'-C2'-C1' 100.91 -1.278 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 181' ' ' ' DA' . . . . . 0.624 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 C3'-C2'-C1' 104.142 1.03 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 182' ' ' ' DC' . . . . . 0.507 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.832 0 C4'-C3'-C2' 104.789 1.589 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 183' ' ' ' DC' . . . . . 0.552 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 N19-C1'-C2' 112.98 -0.763 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 184' ' ' ' DC' . . . . . 0.552 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 C3'-C2'-C1' 101.477 -0.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.64 0 C4'-C3'-C2' 100.959 -2.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D ' 186' ' ' ' DT' . . . . . 0.578 H2'' " O4'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 C1'-O4'-C4' 110.319 0.442 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 187' ' ' ' DC' . . . . . 0.621 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C3'-C2'-C1' 101.961 -0.528 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 188' ' ' ' DG' . . . . . 0.621 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 C3'-C2'-C1' 101.981 -0.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 189' ' ' ' DG' . . . . . 0.407 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.649 0 O4'-C1'-N19 108.269 0.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 190' ' ' ' DG' . . . . . 0.552 ' N7 ' ' NH1' ' A' ' 4' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.939 0 C4'-C3'-C2' 104.879 1.679 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 191' ' ' ' DT' . . . . . 0.588 ' H72' HG21 ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 C1'-O4'-C4' 106.883 -2.012 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 192' ' ' ' DA' . . . . . 0.634 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 105.805 2.218 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 193' ' ' ' DT' . . . . . 0.54 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 N19-C1'-C2' 115.758 0.974 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 194' ' ' ' DA' . . . . . 0.54 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.838 0 C4'-C3'-C2' 104.804 1.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 195' ' ' ' DC' . . . . . 0.417 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.999 0 C1'-O4'-C4' 106.929 -1.979 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 196' ' ' ' DA' . . . . . 0.497 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 C3'-C2'-C1' 104.229 1.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 197' ' ' ' DT' . . . . . 0.497 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 N19-C1'-C2' 115.325 0.703 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 198' ' ' ' DA' . . . . . 0.459 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 C1'-O4'-C4' 110.407 0.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HD3' ' HB3' ' B' ' 110' ' ' ASP . 8.8 mmtm . . . . . 0 CA--C 1.534 0.349 0 CA-C-O 120.243 0.068 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.485 ' O ' ' HA ' ' B' ' 108' ' ' THR . 7.5 tt0 -130.26 120.74 24.9 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.916 0.389 . . . . 0.0 111.795 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 1.041 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -81.95 116.99 21.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.885 ' CG1' HG13 ' B' ' 107' ' ' VAL . 0.5 OUTLIER -113.78 122.22 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.105 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.691 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.59 129.85 41.44 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.025 -1.07 . . . . 0.0 112.954 -177.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.674 HG22 HG12 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -100.22 103.54 14.93 Favored 'Isoleucine or valine' 0 C--N 1.346 0.421 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 175.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -69.77 67.17 0.25 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 122.009 0.909 . . . . 0.0 109.774 -178.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.716 HG21 ' HB3' ' A' ' 12' ' ' ASP . 9.4 p -106.09 -132.32 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.389 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.635 ' H ' HG22 ' A' ' 9' ' ' VAL . 3.2 t70 148.34 -87.16 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 70.7 m -74.65 -5.67 44.34 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.716 ' HB3' HG21 ' A' ' 9' ' ' VAL . 4.2 t0 -79.68 56.76 2.32 Favored 'General case' 0 C--N 1.353 0.727 0 CA-C-N 120.437 1.471 . . . . 0.0 109.936 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' B' ' 132' ' ' MET . 13.2 m 65.25 -18.5 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.722 ' CE1' ' HB ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -50.63 -56.03 13.71 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 118.347 0.521 . . . . 0.0 110.777 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.745 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -50.75 -43.84 58.36 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.641 -0.708 . . . . 0.0 112.763 -177.906 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.641 HD13 ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -54.43 -40.59 68.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.905 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.93 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.665 0.745 . . . . 0.0 110.634 179.782 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 13.9 pttt -69.06 -25.78 64.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.655 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.17 -22.04 60.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 178.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.664 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 15.1 m-30 -87.84 -54.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.664 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 12.4 p-10 163.92 35.15 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.764 0.665 . . . . 0.0 112.117 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.655 HG13 ' O ' ' A' ' 22' ' ' VAL . 9.6 p -154.39 99.12 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.524 0.678 . . . . 0.0 112.622 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.7 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 16.0 m-20 -60.71 13.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.962 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.987 HG21 ' CE ' ' B' ' 132' ' ' MET . 1.7 pp 65.12 -5.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 N-CA-C 117.484 2.401 . . . . 0.0 117.484 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.757 ' HA ' ' HB ' ' B' ' 107' ' ' VAL . 9.8 p -38.49 -62.35 0.6 Allowed 'General case' 0 C--N 1.308 -1.233 0 O-C-N 123.243 0.339 . . . . 0.0 111.734 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.539 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -67.05 -38.72 92.74 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.663 -0.779 . . . . 0.0 113.059 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.492 ' CD2' HG22 ' A' ' 24' ' ' ILE . 3.5 tp -63.5 -61.44 2.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 117.208 0.504 . . . . 0.0 112.299 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.925 HG13 HG21 ' B' ' 124' ' ' ILE . 53.6 t -40.1 -73.4 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -178.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.735 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -57.71 -32.55 67.5 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.539 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.9 OUTLIER -66.54 -54.09 27.53 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 177.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.498 HG21 ' OG1' ' B' ' 131' ' ' THR . 9.4 m -51.78 -47.83 64.03 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.317 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.848 ' HE1' ' CG1' ' B' ' 124' ' ' ILE . 5.3 mtt -49.07 -48.99 43.68 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.242 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.15 -36.33 18.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.446 0.566 . . . . 0.0 110.394 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -67.8 -51.42 48.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.467 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.91 ' HB3' HD21 ' B' ' 117' ' ' LEU . 2.4 tp10 -75.34 -17.23 60.29 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.625 0.25 . . . . 0.0 110.84 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.766 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -86.28 -25.74 25.33 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 123.193 0.597 . . . . 0.0 109.691 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.22 -47.83 12.0 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 121.858 0.837 . . . . 0.0 109.756 177.916 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 . . . . . 0 N--CA 1.443 -0.799 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.414 -177.419 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.55 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 52.9 tp60 -105.58 113.32 26.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.772 0.796 . . . . 0.0 110.31 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.7 ' NH1' ' HB3' ' B' ' 104' ' ' ARG . 7.9 ttp-105 -79.31 103.55 9.31 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.712 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.722 ' HB ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.66 129.03 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.342 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.645 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -128.61 115.6 18.32 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.859 -177.868 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.885 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.14 98.72 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.701 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 1.041 HG22 ' HG3' ' A' ' 4' ' ' ARG . 41.6 p -68.13 84.3 0.24 Allowed 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.006 HG21 ' HB2' ' B' ' 114' ' ' TYR . 6.4 t -72.56 -116.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.413 -177.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.628 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 4.9 t70 75.63 -7.48 1.78 Allowed 'General case' 0 C--N 1.351 0.649 0 CA-C-O 121.443 0.64 . . . . 0.0 109.597 -176.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 2.4 m -127.18 -69.43 0.75 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.46 179.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.735 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 0.6 OUTLIER -42.36 -78.28 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.476 ' H ' ' HB2' ' A' ' 29' ' ' SER . 1.7 m 169.0 46.78 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.55 0.691 . . . . 0.0 110.662 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.006 ' HB2' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.89 -52.55 6.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.9 OUTLIER -48.69 -35.31 13.66 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -175.494 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.766 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -62.47 -57.03 12.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.632 0.651 . . . . 0.0 111.658 179.582 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.91 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -46.37 -48.76 18.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.506 0.67 . . . . 0.0 111.411 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.715 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 5.2 pttt -79.35 -27.88 42.03 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.004 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -58.45 -28.06 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.574 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.2 OUTLIER -88.42 -45.81 9.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.254 177.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 157.04 22.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 175.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.567 HG12 ' O ' ' B' ' 122' ' ' VAL . 49.5 t -138.93 82.57 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -178.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 1.042 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -64.54 56.74 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.006 0.431 . . . . 0.0 111.489 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.042 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER 44.66 -11.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.474 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.1 OUTLIER -38.19 -60.64 0.75 Allowed 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.362 1.437 . . . . 0.0 110.542 -178.523 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -81.11 -27.84 47.73 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.608 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.668 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -66.95 -62.35 1.48 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.701 0.4 . . . . 0.0 111.101 -179.901 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.924 HG22 HG22 ' A' ' 28' ' ' VAL . 3.0 t -47.08 -66.6 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-O 121.144 0.497 . . . . 0.0 109.877 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.558 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 13.7 p -47.99 -34.97 10.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.267 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.7 m -73.77 -56.24 5.23 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.498 ' OG1' HG21 ' A' ' 31' ' ' THR . 0.7 OUTLIER -51.74 -39.16 58.0 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.365 -0.834 . . . . 0.0 108.914 178.668 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.987 ' CE ' HG21 ' A' ' 24' ' ' ILE . 19.0 mmt -52.91 -54.08 39.86 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.042 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.2 -46.85 79.29 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.34 -54.57 30.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.882 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.732 ' CB ' HD21 ' A' ' 17' ' ' LEU . 21.7 mm-40 -62.76 -27.14 69.08 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.282 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.641 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -72.31 -46.45 55.58 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.571 0.348 . . . . 0.0 110.72 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -56.59 5.77 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.213 0.53 . . . . 0.0 111.545 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.725 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -176.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.583 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 7.4 mmmm . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' B' ' 109' ' ' VAL . 25.1 tt0 -95.31 115.97 28.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.24 0.543 . . . . 0.0 111.556 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.986 ' HG3' HG22 ' B' ' 108' ' ' THR . 7.9 ttm-85 -79.55 100.01 7.56 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.75 HG12 HG13 ' B' ' 107' ' ' VAL . 0.7 OUTLIER -103.28 130.54 53.37 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.842 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.367 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.833 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -130.05 127.66 40.36 Favored 'General case' 0 C--N 1.311 -1.083 0 C-N-CA 118.73 -1.188 . . . . 0.0 113.893 -177.1 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.868 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.1 t -101.02 112.54 34.26 Favored 'Isoleucine or valine' 0 C--N 1.347 0.49 0 C-N-CA 124.39 1.076 . . . . 0.0 108.789 176.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.0 p -70.92 85.17 0.69 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.826 0.739 . . . . 0.0 110.386 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.945 HG21 ' CD1' ' A' ' 14' ' ' TYR . 10.3 m -72.26 -162.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.981 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.567 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.6 t70 84.7 -23.59 0.17 Allowed 'General case' 0 C--N 1.351 0.636 0 C-N-CA 123.396 0.679 . . . . 0.0 109.365 -177.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.36 -75.52 0.53 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.294 177.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.914 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 1.0 OUTLIER -51.46 -87.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.516 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 5.2 t -176.85 41.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.256 0.935 . . . . 0.0 112.259 -178.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.945 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.2 -43.8 15.74 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.688 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 16.8 mt-30 -47.84 -37.8 14.66 Favored 'General case' 0 C--O 1.221 -0.418 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -174.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.892 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -58.42 -56.22 24.93 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.473 1.033 . . . . 0.0 111.693 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.796 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -48.05 -47.89 33.47 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.454 0.645 . . . . 0.0 111.63 -178.214 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -76.74 -27.16 55.27 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.41 178.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -66.03 -27.61 68.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.855 178.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.545 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -87.8 -40.48 14.01 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.57 178.482 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.545 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.8 OUTLIER 151.21 21.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.267 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.469 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 68.4 t -155.9 89.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.515 0 C-N-CA 120.886 -0.326 . . . . 0.0 111.833 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.467 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 1.1 m120 -61.2 -100.28 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.064 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -146.26 4.79 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.409 ' C ' ' O ' ' A' ' 24' ' ' ILE . 89.5 p -44.38 -64.82 0.61 Allowed 'General case' 0 C--O 1.244 0.794 0 C-N-CA 119.395 -0.922 . . . . 0.0 108.826 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.4 -28.65 29.58 Favored Glycine 0 CA--C 1.519 0.319 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.593 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.913 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -58.74 -59.6 5.16 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 122.198 0.199 . . . . 0.0 110.858 179.489 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.064 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.1 t -52.31 -61.65 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.835 ' HB3' ' CB ' ' B' ' 112' ' ' ASP . 12.1 p -50.55 -42.73 55.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 89.3 m -71.34 -53.29 14.68 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.47 -41.46 89.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.129 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.968 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -56.0 -52.99 62.24 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.446 178.433 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.444 ' HG3' ' HB3' ' B' ' 113' ' ' SER . 53.2 mt-30 -53.68 -56.68 15.17 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.35 -53.27 56.11 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.955 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -66.83 -23.33 66.02 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.145 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.775 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -72.19 -47.57 49.66 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.79 -51.58 66.52 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? . . . . . 0 N--CA 1.444 -0.731 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.151 -179.706 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.442 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 12.3 mptt . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.821 ' HB3' HG23 ' A' ' 9' ' ' VAL . 3.5 tp60 -99.36 125.06 44.96 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.976 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.455 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.3 OUTLIER -77.91 114.61 16.94 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.279 -177.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 1.04 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -102.89 108.98 25.48 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.949 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 177.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.833 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -115.25 114.02 24.65 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.986 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.75 HG13 HG12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.21 101.35 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 176.849 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.986 HG22 ' HG3' ' A' ' 4' ' ' ARG . 77.0 p -68.61 95.2 0.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.01 HG21 ' CG ' ' B' ' 114' ' ' TYR . 16.5 m -91.29 -148.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.613 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.529 ' N ' HG23 ' B' ' 109' ' ' VAL . 15.9 t70 88.84 -13.33 0.39 Allowed 'General case' 0 C--N 1.346 0.445 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 -176.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.4 t -114.46 -62.48 1.59 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.835 ' CB ' ' HB3' ' A' ' 29' ' ' SER . 0.6 OUTLIER -48.66 -89.34 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 O-C-N 123.591 0.557 . . . . 0.0 111.865 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.444 ' HB3' ' HG3' ' A' ' 33' ' ' GLN . 1.3 m 176.04 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.865 0.757 . . . . 0.0 111.438 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.01 ' CG ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.37 -44.36 16.23 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.312 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.578 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 4.4 mt-30 -48.78 -42.63 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.775 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.8 OUTLIER -52.32 -30.19 27.11 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.955 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -77.5 -53.62 7.41 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 121.599 0.714 . . . . 0.0 111.204 179.534 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.625 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -70.43 -28.83 65.35 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.556 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -60.57 -28.13 68.23 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.864 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.719 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -89.16 -36.81 15.48 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.022 179.097 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.719 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 33.2 t70 146.83 25.36 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 176.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.582 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 61.8 t -159.67 101.13 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 O-C-N 121.841 -0.537 . . . . 0.0 112.396 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.557 ' O ' ' HE1' ' A' ' 32' ' ' MET . 67.8 m-80 -58.9 -92.51 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 177.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.011 HG22 ' HB3' ' B' ' 127' ' ' LEU . 0.1 OUTLIER -154.84 6.76 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.727 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.868 ' HA ' HG22 ' A' ' 7' ' ' VAL . 54.0 p -38.6 -64.27 0.45 Allowed 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.076 -177.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.588 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.25 -20.25 46.41 Favored Glycine 0 CA--C 1.522 0.471 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.834 177.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 1.011 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.82 -61.21 2.56 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.061 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.913 HG22 HG21 ' A' ' 24' ' ' ILE . 26.0 t -55.15 -65.16 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 CA-C-O 121.687 0.755 . . . . 0.0 109.136 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.914 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 3.0 p -49.44 -47.96 47.8 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.588 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -81.14 -48.53 12.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.441 1.019 . . . . 0.0 111.198 -178.404 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.736 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.98 -37.91 69.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.102 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.913 ' SD ' HD12 ' A' ' 27' ' ' LEU . 1.6 mmt -64.21 -48.19 76.83 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.389 178.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 14.6 tt0 -48.79 -42.13 34.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.096 0.407 . . . . 0.0 110.659 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.51 -55.68 22.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.177 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.52 ' HG3' HD21 ' A' ' 17' ' ' LEU . 23.9 tp10 -71.31 -9.76 58.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.102 178.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.892 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.19 -46.93 8.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.985 0.421 . . . . 0.0 109.925 178.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -63.3 -56.17 18.65 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.623 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 2.8 tpt85 . . . . . 0 N--CA 1.438 -1.04 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.236 -178.884 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 3.5 mptt . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 121.211 0.529 . . . . 0.0 110.986 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.446 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 29.7 tp60 -104.64 109.62 21.61 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.13 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.856 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 2.3 ttm105 -78.91 104.6 9.65 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.331 -179.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.656 HG12 HG13 ' B' ' 107' ' ' VAL . 0.2 OUTLIER -104.08 130.21 55.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 177.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.7 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.36 128.41 39.6 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 119.117 -1.033 . . . . 0.0 112.901 -177.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.69 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -100.1 107.64 21.33 Favored 'Isoleucine or valine' 0 C--N 1.35 0.598 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 6.2 p -71.23 98.34 1.71 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.94 -0.475 . . . . 0.0 110.442 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.005 HG21 ' HB3' ' A' ' 14' ' ' TYR . 3.8 t -92.35 -130.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 119.094 -0.479 . . . . 0.0 112.077 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.541 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 31.4 t70 85.18 -9.23 0.84 Allowed 'General case' 0 C--N 1.351 0.641 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.4 m -132.23 -56.54 0.97 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.856 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.8 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 2.8 m-20 -49.86 -98.36 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -177.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 41.3 t -178.41 36.78 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.376 -0.828 . . . . 0.0 110.606 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.005 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.79 -45.71 14.0 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.794 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.685 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.1 -39.24 27.4 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -176.014 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.795 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -59.14 -56.84 17.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.439 0.563 . . . . 0.0 112.284 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.95 HD12 ' HA ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -59.61 -39.46 84.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 120.027 -0.669 . . . . 0.0 112.744 -177.471 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.685 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -80.14 -35.47 36.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.041 0.448 . . . . 0.0 112.123 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.569 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -73.66 -21.57 60.23 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.896 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.894 ' CE2' HD23 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -87.79 -40.08 14.36 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 118.913 -0.565 . . . . 0.0 109.642 178.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.602 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 7.0 t70 171.52 -5.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.81 ' HB ' HD22 ' A' ' 17' ' ' LEU . 74.4 t -121.57 82.0 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -177.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 1.025 ' O ' HD12 ' A' ' 24' ' ' ILE . 45.5 p30 -67.19 51.44 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 111.068 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.025 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 46.11 -15.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -37.99 -63.01 0.51 Allowed 'General case' 0 C--O 1.238 0.486 0 CA-C-N 120.166 1.348 . . . . 0.0 110.838 -177.688 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.52 -29.16 30.69 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.473 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.796 ' CD1' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -58.0 -62.33 1.9 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.463 179.511 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.015 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.8 t -48.48 -63.48 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.382 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.828 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 94.2 p -49.55 -38.73 32.05 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 81.3 m -67.31 -54.41 20.96 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.586 HG22 HD11 ' B' ' 127' ' ' LEU . 93.0 m -58.15 -40.85 82.45 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.257 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.948 ' SD ' HD12 ' B' ' 117' ' ' LEU . 8.1 mmt -53.52 -54.27 39.63 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.974 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? -62.73 -45.11 94.22 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.935 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.47 -50.72 71.62 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.554 ' HG2' ' CD1' ' B' ' 127' ' ' LEU . 5.6 tp10 -64.57 -37.93 89.24 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.922 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -56.11 -43.5 78.18 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 177.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -53.24 19.86 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.539 0.521 0 CA-C-N 114.187 -1.369 . . . . 0.0 113.224 -177.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.516 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 12.0 mmmt . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.529 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 33.8 tp60 -121.15 112.53 18.78 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.535 0.683 . . . . 0.0 112.121 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.488 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 5.5 ttm105 -79.55 111.91 16.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.895 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.7 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.8 OUTLIER -101.47 130.06 51.61 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.758 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.255 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.66 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.96 116.56 17.3 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.281 -177.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.793 HG22 HG22 ' B' ' 109' ' ' VAL . 0.8 OUTLIER -101.66 104.54 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 174.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.856 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 8.9 p -70.02 95.29 0.94 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.855 HG11 ' HB3' ' B' ' 114' ' ' TYR . 0.9 OUTLIER -93.2 -145.3 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.992 -178.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 28.2 t0 92.69 -10.62 0.18 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -175.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.46 -64.35 1.26 Allowed 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.354 177.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.828 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -44.0 -94.44 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.436 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -177.59 42.33 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.699 -0.625 . . . . 0.0 110.94 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.855 ' HB3' HG11 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.13 -45.52 15.05 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.055 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.548 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 3.9 mt-30 -49.86 -43.67 49.26 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.922 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -50.43 -33.82 22.29 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 1.057 HD12 HD22 ' B' ' 127' ' ' LEU . 0.4 OUTLIER -78.1 -53.94 6.83 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.894 -0.722 . . . . 0.0 111.771 178.594 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.548 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.1 OUTLIER -63.44 -25.49 68.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.995 178.621 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.62 -26.18 31.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.775 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.63 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 97.4 m-85 -87.64 -49.11 7.37 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.295 178.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.63 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 25.0 p-10 136.46 34.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 124.844 1.34 . . . . 0.0 112.078 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.599 ' CG1' HD13 ' B' ' 117' ' ' LEU . 5.5 p -120.76 -39.7 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.419 ' O ' ' HE1' ' A' ' 32' ' ' MET . 36.8 m-80 59.95 -119.64 0.92 Allowed 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 0.87 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -139.21 4.02 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 179.477 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.69 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.4 OUTLIER -40.53 -64.96 0.46 Allowed 'General case' 0 C--O 1.243 0.744 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.466 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.445 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.5 -23.13 51.95 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.128 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 1.057 HD22 HD12 ' B' ' 117' ' ' LEU . 7.0 tp -63.99 -61.27 2.38 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-N 116.843 0.322 . . . . 0.0 111.187 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.87 HG23 ' CG2' ' B' ' 124' ' ' ILE . 24.8 t -51.83 -61.19 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.8 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.8 p -48.41 -49.08 36.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.445 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.5 OUTLIER -77.04 -43.73 33.45 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.61 0.641 . . . . 0.0 110.496 179.776 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -63.14 -39.89 96.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.647 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.95 ' HA ' HD12 ' A' ' 17' ' ' LEU . 4.8 mmt -63.48 -57.05 11.45 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.62 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.442 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 5.3 tp60 -48.82 -37.52 19.55 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.962 0.164 . . . . 0.0 111.225 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -65.18 -57.47 8.45 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.769 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.928 ' HB2' HD11 ' A' ' 17' ' ' LEU . 1.3 mm-40 -75.81 -8.56 57.17 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.569 0.223 . . . . 0.0 111.053 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.795 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.23 -32.48 19.75 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.39 -46.77 13.11 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.898 0.856 . . . . 0.0 110.326 178.245 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 11.4 mtt180 . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 113.617 -1.629 . . . . 0.0 114.614 -176.479 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.579 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 1.7 mmmt . . . . . 0 N--CA 1.47 0.529 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.715 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -119.28 107.64 13.64 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.312 0.577 . . . . 0.0 111.796 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.893 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.94 109.79 14.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.534 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.909 HD13 HG13 ' B' ' 107' ' ' VAL . 0.0 OUTLIER -121.28 112.93 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 177.396 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.787 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.0 OUTLIER -123.46 132.92 54.08 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.84 -177.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.834 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.41 112.27 32.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 176.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.402 HG23 ' NH1' ' B' ' 104' ' ' ARG . 6.5 p -67.06 92.76 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.623 -0.673 . . . . 0.0 110.07 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.813 HG11 ' CB ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -97.64 -155.13 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.404 -178.235 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 24.7 t0 113.22 5.27 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.597 1.159 . . . . 0.0 108.837 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.7 t -152.18 -38.8 0.11 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.756 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.726 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -73.3 32.64 0.07 Allowed 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -177.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER 70.71 1.71 3.83 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 120.692 -1.255 . . . . 0.0 113.856 178.202 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.034 ' CZ ' HG21 ' B' ' 105' ' ' ILE . 0.7 OUTLIER -55.92 -53.6 54.88 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.919 0.39 . . . . 0.0 110.919 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.622 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 3.0 mp0 -49.91 -41.55 46.21 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -177.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.726 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -51.08 -29.71 13.88 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.94 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.65 -59.8 2.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.466 0.651 . . . . 0.0 110.919 178.2 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 4.4 pttt -63.63 -25.91 68.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.799 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.464 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.25 -25.64 34.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.098 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.61 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 21.0 m-85 -88.32 -50.24 6.46 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.565 178.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.61 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 19.7 t0 143.34 50.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.216 0.947 . . . . 0.0 110.166 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 22' ' ' VAL . 1.4 p -176.05 96.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.738 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -60.83 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.109 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.974 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -146.38 5.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.438 ' C ' ' O ' ' A' ' 24' ' ' ILE . 36.2 p -39.11 -62.99 0.58 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.455 -177.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.18 -30.04 32.12 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.098 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.816 HD23 HG23 ' A' ' 24' ' ' ILE . 22.0 tp -60.56 -56.3 22.95 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.193 0.197 . . . . 0.0 111.28 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.992 HG22 HG21 ' B' ' 124' ' ' ILE . 3.1 t -53.96 -64.43 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.439 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.687 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.75 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 10.8 p -49.73 -42.19 45.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.411 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.11 -46.15 52.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.784 ' HB ' HD21 ' B' ' 127' ' ' LEU . 22.9 m -63.21 -36.13 82.63 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.981 179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 1.071 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -54.57 -47.86 72.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.184 179.071 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.5 -36.85 76.84 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 120.475 0.179 . . . . 0.0 111.182 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.43 -44.8 50.21 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.767 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.2 tp10 -69.86 -26.63 64.3 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.045 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.764 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.34 -44.72 64.54 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -55.55 11.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.509 0.671 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 CA--C 1.543 0.708 0 CA-C-N 114.668 -1.151 . . . . 0.0 114.046 -176.627 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.49 ' HD3' ' HA ' ' B' ' 102' ' ' LYS . 1.8 mmtp . . . . . 0 N--CA 1.465 0.29 0 CA-C-O 121.007 0.432 . . . . 0.0 111.982 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.487 ' HG2' HG22 ' B' ' 105' ' ' ILE . 2.0 tt0 -113.54 110.6 20.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.965 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.711 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 11.8 ttm-85 -79.23 99.14 6.91 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.183 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 1.034 HG21 ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -104.82 112.29 37.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.587 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.787 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -107.33 125.1 50.75 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.447 -175.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.909 HG13 HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -99.33 93.3 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.576 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.893 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.3 p -66.31 67.64 0.05 Allowed 'General case' 0 CA--C 1.523 -0.079 0 CA-C-O 122.276 1.036 . . . . 0.0 109.526 -177.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.061 HG11 ' CB ' ' B' ' 114' ' ' TYR . 7.1 p -69.92 -127.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.848 -178.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.715 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 3.6 t70 83.44 -3.35 1.19 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.914 0.864 . . . . 0.0 109.082 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 38.0 m -127.06 -64.66 0.99 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.358 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.75 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.64 -85.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.712 0 O-C-N 123.696 0.623 . . . . 0.0 112.258 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.497 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.6 t 174.64 43.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.364 0.602 . . . . 0.0 110.881 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.061 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.4 OUTLIER -84.06 -42.27 16.31 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.57 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.42 -42.24 21.86 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -175.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.764 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -52.54 -49.79 64.18 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.996 0.816 . . . . 0.0 111.362 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.899 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.41 -48.98 78.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.819 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.571 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -71.27 -26.13 62.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.238 0.542 . . . . 0.0 110.529 179.534 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.16 -24.04 62.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.82 178.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.601 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 10.4 m-30 -87.98 -43.64 11.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.601 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 1.9 p-10 121.72 19.36 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.137 0 O-C-N 125.007 1.442 . . . . 0.0 111.81 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 79.2 t -101.7 -40.64 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.25 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.605 ' O ' HD12 ' B' ' 117' ' ' LEU . 5.3 m-80 61.54 -124.96 0.84 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.071 HG23 ' HE2' ' A' ' 32' ' ' MET . 0.3 OUTLIER -131.51 3.59 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.425 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.5 OUTLIER -39.43 -64.33 0.48 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.253 -178.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.426 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -87.23 -25.39 33.92 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.387 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.784 HD21 ' HB ' ' A' ' 31' ' ' THR . 6.1 tt -59.38 -61.44 2.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.188 0.518 . . . . 0.0 110.222 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.011 HG13 ' HE3' ' B' ' 132' ' ' MET . 3.4 t -50.67 -63.54 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.443 178.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.726 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 92.4 p -48.58 -46.9 39.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.438 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.6 OUTLIER -70.17 -48.01 59.14 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.689 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -65.02 -33.72 76.72 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.817 179.949 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.011 ' HE3' HG13 ' B' ' 128' ' ' VAL . 2.1 mmt -56.13 -52.92 62.62 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.187 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -58.16 -36.86 73.64 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.622 0.231 . . . . 0.0 111.622 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . 0.462 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.44 -51.05 13.95 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.774 ' HB3' HD21 ' A' ' 17' ' ' LEU . 12.0 tp10 -67.47 -24.46 65.6 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.965 -0.384 . . . . 0.0 109.965 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.726 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -69.41 -46.28 67.2 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -53.45 12.96 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.853 178.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.636 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -175.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.275 0 CA-C-O 120.861 0.362 . . . . 0.0 110.45 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.64 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 43.2 tp60 -124.96 116.28 21.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.148 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.858 ' HG3' HG22 ' B' ' 108' ' ' THR . 2.0 ttm105 -79.11 114.3 17.94 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.668 0.747 . . . . 0.0 111.667 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.949 HD13 ' CD1' ' B' ' 114' ' ' TYR . 4.4 pt -114.62 128.91 71.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.717 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.56 131.73 41.82 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.285 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.715 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.22 103.45 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 106.914 -1.514 . . . . 0.0 106.914 174.208 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.501 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 9.7 p -70.36 69.08 0.37 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.715 0.769 . . . . 0.0 109.837 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.9 HG11 ' HB2' ' A' ' 14' ' ' TYR . 14.3 p -85.89 -135.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.384 -1.28 . . . . 0.0 111.468 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.782 ' H ' HG22 ' A' ' 9' ' ' VAL . 20.4 t70 108.39 20.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.171 0.986 . . . . 0.0 109.607 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.552 ' H ' HG22 ' A' ' 9' ' ' VAL . 4.3 t -160.7 -45.69 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.5 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.751 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -79.05 61.39 3.2 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 119.61 -0.836 . . . . 0.0 113.165 -177.317 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.534 ' HB2' ' O ' ' B' ' 129' ' ' SER . 3.7 m 68.19 -7.78 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 177.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.9 ' HB2' HG11 ' A' ' 9' ' ' VAL . 1.1 t80 -50.29 -57.61 7.48 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.674 1.125 . . . . 0.0 110.348 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.582 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 39.5 mt-30 -49.77 -38.81 35.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.878 -178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.79 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -51.32 -33.09 27.62 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.942 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.67 -52.55 8.79 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.245 0.545 . . . . 0.0 111.317 178.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.691 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -66.28 -25.5 66.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.388 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 -28.21 62.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.411 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.717 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 6.8 m-30 -88.29 -40.78 13.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.888 178.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.717 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 120.39 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 125.203 1.565 . . . . 0.0 109.496 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.8 t -141.71 -48.15 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.04 0 CA-C-N 114.421 -1.263 . . . . 0.0 111.068 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.406 ' OD1' ' HB3' ' A' ' 18' ' ' LYS . 18.3 m-80 67.39 -113.71 0.17 Allowed 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -178.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.053 HG23 ' HE2' ' B' ' 132' ' ' MET . 0.1 OUTLIER -143.04 -1.27 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 178.628 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 24' ' ' ILE . 63.0 p -39.52 -64.9 0.43 Allowed 'General case' 0 C--O 1.245 0.853 0 CA-C-N 118.901 0.773 . . . . 0.0 110.468 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.537 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -79.0 -29.11 52.65 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.432 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.919 HD22 ' HG ' ' A' ' 17' ' ' LEU . 16.7 tp -62.41 -58.41 7.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.87 HG23 ' CG2' ' A' ' 24' ' ' ILE . 4.0 t -52.17 -71.39 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.396 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.81 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 93.7 p -47.37 -39.36 15.0 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.3 m -69.67 -48.0 61.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.251 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.428 ' HA ' HD22 ' A' ' 34' ' ' ASN . 25.3 m -65.34 -32.13 73.62 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.694 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.801 ' HE2' HG23 ' B' ' 124' ' ' ILE . 11.5 mmt -59.43 -57.42 13.04 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.959 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -55.56 -34.99 65.25 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.547 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.428 HD22 ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -74.73 -49.38 21.26 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 1.107 ' HB3' HD21 ' B' ' 117' ' ' LEU . 3.4 tp10 -72.15 -21.75 61.41 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.083 0.468 . . . . 0.0 109.776 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.612 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -70.38 -45.35 66.18 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.244 0.545 . . . . 0.0 109.628 178.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -55.02 5.12 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.883 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.662 0 CA-C-N 114.895 -1.048 . . . . 0.0 113.747 -176.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.42 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 7.4 mptt . . . . . 0 CA--C 1.532 0.287 0 CA-C-O 120.733 0.302 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.727 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 7.7 tt0 -97.22 108.87 21.69 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.237 0.542 . . . . 0.0 110.942 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.757 ' NH2' HG21 ' B' ' 106' ' ' THR . 0.3 OUTLIER -78.34 99.09 6.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.428 0.632 . . . . 0.0 110.163 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.863 HD11 HG11 ' B' ' 128' ' ' VAL . 3.9 pt -100.34 126.93 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.757 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -131.75 122.85 26.53 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -175.669 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.732 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.01 106.73 19.94 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.499 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.858 HG22 ' HG3' ' A' ' 4' ' ' ARG . 76.8 p -70.07 98.7 1.35 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.908 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.73 -124.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.85 -178.22 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.64 ' HB2' ' N ' ' A' ' 3' ' ' GLN . 26.0 t0 95.84 9.99 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 122.098 0.952 . . . . 0.0 108.845 -175.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.4 t -164.51 -43.13 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.985 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.829 ' HB2' HG12 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -68.47 52.58 0.08 Allowed 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.153 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.632 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.1 m 56.03 7.97 0.34 Allowed 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.949 ' CD1' HD13 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -63.99 -54.6 31.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.973 0.416 . . . . 0.0 111.491 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.578 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.95 -34.17 12.39 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.609 -176.421 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.609 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -52.15 -56.19 16.12 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.145 0.498 . . . . 0.0 110.781 178.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 1.107 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.5 OUTLIER -55.11 -50.85 68.18 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.031 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.606 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -71.85 -25.6 62.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.36 -179.386 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -58.1 -26.03 62.09 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.063 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.686 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 4.6 m-30 -88.27 -44.43 10.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.65 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.686 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.8 m-20 129.68 38.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.884 1.365 . . . . 0.0 111.284 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 91.0 t -122.74 -44.11 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.011 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.436 ' OD1' ' HE1' ' B' ' 114' ' ' TYR . 0.6 OUTLIER 61.55 -132.61 0.65 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 -178.253 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.016 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -134.07 8.48 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.744 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.504 ' HA ' ' HB ' ' A' ' 7' ' ' VAL . 0.9 OUTLIER -39.72 -63.99 0.53 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 120.235 -0.586 . . . . 0.0 109.944 -178.023 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.474 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.0 -30.78 13.4 Favored Glycine 0 C--O 1.225 -0.439 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.712 177.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.822 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -52.57 -61.11 2.49 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.638 0.375 . . . . 0.0 110.61 179.038 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.016 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.4 t -54.27 -64.35 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.544 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.751 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 4.9 p -49.22 -44.8 43.71 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.75 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.474 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -69.91 -53.72 16.67 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 121.767 -0.583 . . . . 0.0 109.843 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.5 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -57.9 -37.81 74.7 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.52 -179.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.053 ' HE2' HG23 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -49.19 -46.46 45.58 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.328 179.138 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -48.37 80.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.584 0.23 . . . . 0.0 111.35 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -58.14 -56.54 20.73 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.485 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.4 ' HG3' ' CD1' ' A' ' 27' ' ' LEU . 1.7 mm-40 -59.98 -40.13 88.06 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.79 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -60.04 -44.33 94.73 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.605 178.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -56.51 7.7 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.315 0.579 . . . . 0.0 111.339 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.568 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.125 -177.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.473 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 11.1 mmtm . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.694 0.283 . . . . 0.0 111.509 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.4 tp60 -101.75 118.46 36.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.631 0.729 . . . . 0.0 112.087 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.931 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.39 101.03 7.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.94 -179.532 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.917 HD13 ' CD2' ' B' ' 114' ' ' TYR . 8.3 pt -104.52 128.79 57.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.788 HG21 ' CZ ' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -131.56 124.59 30.35 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.882 -177.273 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.925 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -101.25 105.0 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 174.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 9.9 p -69.14 87.77 0.41 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -178.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.925 HG22 HG22 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -86.78 -139.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.16 -178.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.67 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 2.4 t70 87.22 -5.15 0.64 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -175.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.53 -67.7 0.94 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.117 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.848 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 1.1 m-20 -49.55 -87.45 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m -177.43 42.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.174 0.897 . . . . 0.0 111.751 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.982 ' CD1' HD13 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -82.53 -44.56 15.76 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.664 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.1 mp0 -49.67 -40.39 39.71 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -176.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.735 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -57.09 -54.0 51.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.736 0.698 . . . . 0.0 111.995 -179.503 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.881 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -49.54 -48.06 48.6 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.282 0.563 . . . . 0.0 111.387 -178.871 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.664 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.13 -30.41 43.68 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.045 179.274 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -63.78 -27.43 69.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.175 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.604 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -87.69 -44.77 10.93 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-O 118.765 -0.636 . . . . 0.0 109.399 178.816 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.604 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 157.28 16.46 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 177.028 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.515 ' O ' HD12 ' A' ' 17' ' ' LEU . 70.9 t -156.85 90.37 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 118.265 0.484 . . . . 0.0 111.973 -177.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.578 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 0.1 OUTLIER -56.78 -100.1 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.338 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.013 HG23 ' HE2' ' B' ' 132' ' ' MET . 0.3 OUTLIER -139.97 1.26 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.422 ' C ' ' O ' ' A' ' 24' ' ' ILE . 88.0 p -41.89 -65.26 0.47 Allowed 'General case' 0 C--O 1.239 0.519 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.866 -178.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.93 -25.88 43.54 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.813 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.746 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -62.17 -59.41 5.08 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.945 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -52.77 -66.25 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.713 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.779 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 18.1 p -48.74 -35.59 14.51 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.5 m -72.88 -56.26 5.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 28' ' ' VAL . 3.1 t -58.74 -36.64 74.67 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.126 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 1.092 ' SD ' HD12 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -55.53 -55.37 32.65 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.641 178.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -56.19 -53.49 56.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.589 0.233 . . . . 0.0 110.782 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -57.69 -46.91 83.69 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB3' HD11 ' B' ' 117' ' ' LEU . 3.2 tp10 -70.23 -19.89 63.12 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.353 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.738 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -77.38 -44.48 29.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -54.74 7.61 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.564 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.741 -176.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.67 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 17.1 tt0 -98.41 115.18 27.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.799 178.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.788 ' CZ ' HG21 ' A' ' 6' ' ' THR . 28.7 ttt-85 -77.52 101.93 6.7 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.226 -0.589 . . . . 0.0 110.461 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.982 HD13 ' CD1' ' A' ' 14' ' ' TYR . 1.8 pt -102.62 130.21 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.657 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.77 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.4 OUTLIER -131.26 121.59 25.04 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.056 -0.657 . . . . 0.0 111.823 -176.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.67 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.8 OUTLIER -101.28 91.59 2.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.085 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 176.127 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.931 HG22 ' HG3' ' A' ' 4' ' ' ARG . 31.9 p -60.85 90.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.505 0.669 . . . . 0.0 110.385 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.018 HG21 ' CD1' ' B' ' 114' ' ' TYR . 31.6 m -87.5 -148.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.885 -177.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 23.7 t70 96.04 -10.33 0.09 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.371 1.069 . . . . 0.0 108.342 -176.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.417 ' HG ' ' HZ2' ' A' ' 2' ' ' LYS . 58.4 m -118.15 -62.9 1.49 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.779 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.4 OUTLIER -42.03 -92.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.662 0.601 . . . . 0.0 112.34 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.48 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.2 m -180.0 41.18 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.724 -0.61 . . . . 0.0 110.765 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.018 ' CD1' HG21 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -83.04 -45.2 14.32 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.617 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.7 mp0 -49.18 -45.27 43.83 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.738 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -51.8 -28.02 14.22 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.759 0.709 . . . . 0.0 112.356 -179.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 1.092 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.6 OUTLIER -78.33 -57.25 3.88 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 120.113 -0.635 . . . . 0.0 111.329 178.111 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -62.36 -25.43 67.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.337 178.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.39 -27.06 34.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.004 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.62 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.5 m-30 -88.18 -49.56 6.93 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.644 178.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.9 m-20 139.4 46.14 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 O-C-N 124.407 1.067 . . . . 0.0 110.675 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.743 ' O ' HG13 ' B' ' 122' ' ' VAL . 4.0 p -163.14 89.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.725 0.774 . . . . 0.0 110.783 -178.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.725 ' O ' ' HE1' ' A' ' 32' ' ' MET . 74.6 m-80 -58.41 -98.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.722 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.091 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -152.55 9.73 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.405 ' C ' ' O ' ' B' ' 124' ' ' ILE . 2.1 p -39.59 -64.7 0.45 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.144 -177.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.609 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.13 -28.5 20.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.705 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -55.48 -61.43 2.35 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.485 0.314 . . . . 0.0 110.783 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.091 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -53.59 -62.7 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.602 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.808 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.848 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 2.3 p -50.13 -43.69 51.99 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.609 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.5 OUTLIER -70.16 -50.27 42.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.457 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.442 ' N ' ' CG2' ' B' ' 130' ' ' THR . 54.8 m -55.9 -43.46 77.29 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.51 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.013 ' HE2' HG23 ' A' ' 24' ' ' ILE . 4.6 mtt -61.08 -57.63 11.74 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.897 178.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -40.39 37.21 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.067 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -56.04 12.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.242 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.566 ' HB2' HD21 ' A' ' 17' ' ' LEU . 14.0 mm-40 -69.41 -13.45 62.37 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.544 0.211 . . . . 0.0 111.293 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.735 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -86.49 -38.18 17.52 Favored 'General case' 0 C--O 1.227 -0.1 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -47.61 45.4 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.3 ttp85 . . . . . 0 N--CA 1.441 -0.878 0 CA-C-N 114.075 -1.42 . . . . 0.0 110.613 -179.371 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 36.3 mmtt . . . . . 0 N--CA 1.476 0.83 0 CA-C-O 120.559 0.218 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.621 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.5 OUTLIER -102.72 101.8 11.93 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.711 0.767 . . . . 0.0 112.07 -179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.89 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.2 ttp-105 -79.68 98.85 7.13 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.919 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 1.113 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -107.42 108.77 26.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.727 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.264 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.63 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -103.77 123.9 47.91 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.068 -176.33 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.691 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -100.63 105.83 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.2 p -70.23 90.63 0.69 Allowed 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.013 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.942 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.7 t -83.28 -134.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.494 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 26.8 t70 90.56 -5.79 0.3 Allowed 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.23 -58.56 0.59 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.27 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.734 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -43.65 -92.08 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.51 ' O ' ' HB2' ' B' ' 132' ' ' MET . 0.6 OUTLIER -179.02 37.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.388 0.995 . . . . 0.0 112.034 -179.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.942 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.76 -43.75 16.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.083 0.953 . . . . 0.0 112.56 179.472 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.626 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 38.6 mt-30 -50.05 -44.12 51.4 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.924 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.2 mt -48.1 -30.4 4.46 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.267 0.485 . . . . 0.0 112.291 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.8 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -78.26 -57.35 3.83 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.408 177.518 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.626 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -63.18 -25.49 68.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.842 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.428 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -26.31 33.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.335 178.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.557 ' O ' ' CB ' ' A' ' 21' ' ' ASP . 9.6 m-30 -87.85 -40.62 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.557 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.3 t0 120.91 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 122.34 1.067 . . . . 0.0 111.086 177.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.7 ' CG1' HD12 ' A' ' 17' ' ' LEU . 8.1 p -151.49 92.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.852 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.888 ' O ' HD12 ' A' ' 24' ' ' ILE . 1.7 m120 -65.75 48.8 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.46 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.05 HG21 ' SD ' ' B' ' 132' ' ' MET . 1.3 pp 31.68 9.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.642 ' HA ' HG22 ' B' ' 107' ' ' VAL . 67.2 m -36.47 -63.06 0.42 Allowed 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.036 0.446 . . . . 0.0 111.252 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -17.38 70.27 Favored Glycine 0 C--N 1.335 0.493 0 CA-C-N 115.848 -0.614 . . . . 0.0 112.62 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.788 ' CB ' HG22 ' A' ' 24' ' ' ILE . 2.3 tm? -67.54 -61.21 2.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.749 HG22 HG22 ' B' ' 128' ' ' VAL . 87.2 t -45.02 -67.67 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.361 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.565 ' HA ' ' HG2' ' A' ' 32' ' ' MET . 1.2 p -48.43 -36.92 15.81 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.581 0.752 . . . . 0.0 112.396 178.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.6 m -68.54 -52.75 28.55 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.421 HG21 HG21 ' B' ' 131' ' ' THR . 15.7 m -55.95 -35.71 66.98 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.756 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.864 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 1.3 mmt -56.94 -55.03 39.91 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.983 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.533 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -56.09 -49.91 72.5 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.745 0.307 . . . . 0.0 111.259 179.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -59.6 -51.44 69.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.871 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.815 ' HB3' HD11 ' B' ' 117' ' ' LEU . 5.2 tp10 -74.13 -14.89 61.03 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.392 178.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.959 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -84.26 -32.7 24.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -52.03 13.31 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.772 0.796 . . . . 0.0 109.475 178.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.729 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.506 -178.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.481 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 1.4 mmpt? . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 120.899 0.38 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.774 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 4.5 tp60 -115.27 116.52 28.45 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.208 0.528 . . . . 0.0 110.648 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.453 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.02 111.08 14.86 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.083 -178.607 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.862 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -115.31 118.84 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 175.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.662 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -123.98 131.19 53.53 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 120.285 -0.566 . . . . 0.0 111.722 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.691 HG12 HG12 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -101.23 86.45 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.89 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 68.2 p -64.88 77.1 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 -179.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.723 HG11 ' HB2' ' B' ' 114' ' ' TYR . 7.2 p -108.92 -120.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.893 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.621 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 1.1 t70 94.47 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.963 1.363 . . . . 0.0 109.506 -176.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.672 ' H ' HG22 ' B' ' 109' ' ' VAL . 45.7 t -154.46 -52.45 0.09 Allowed 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 112.507 -2.133 . . . . 0.0 111.845 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.523 ' O ' ' HB2' ' A' ' 29' ' ' SER . 55.1 m-20 -75.33 54.14 0.7 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -177.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.533 ' OG ' ' HB2' ' A' ' 33' ' ' GLN . 2.4 m 70.48 -3.31 1.92 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.113 ' CE1' HG21 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -55.1 -53.92 49.75 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.482 0.583 . . . . 0.0 111.204 179.491 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.541 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 14.3 mt-30 -49.85 -42.79 48.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -177.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.959 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -52.09 -31.38 30.32 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.428 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.815 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -77.75 -53.69 7.23 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.603 179.403 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.6 -28.11 68.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.57 -29.87 66.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.213 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.607 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.9 OUTLIER -88.5 -43.02 11.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.372 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.607 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 151.39 31.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 176.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 121' ' ' ASP . 74.5 t -162.37 97.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.407 0.146 . . . . 0.0 111.08 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.801 ' O ' ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.1 -83.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 178.09 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.023 HD11 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -165.2 3.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 178.543 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.433 ' C ' ' O ' ' B' ' 124' ' ' ILE . 7.0 p -38.24 -63.74 0.47 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.39 0.995 . . . . 0.0 111.19 -177.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -84.81 -29.47 29.0 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.195 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.712 HD22 HD22 ' B' ' 117' ' ' LEU . 14.2 tp -59.72 -59.87 4.75 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.956 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -50.97 -59.69 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.734 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.1 m -50.03 -40.32 44.53 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 17.7 m -71.07 -53.01 16.18 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.536 HG22 ' HA ' ' B' ' 128' ' ' VAL . 4.9 t -59.6 -36.97 77.34 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.857 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.05 ' SD ' HG21 ' A' ' 24' ' ' ILE . 3.5 mmt -60.6 -58.3 9.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.892 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.487 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 1.8 tt0 -55.67 -39.99 71.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.445 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -49.63 55.74 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.311 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.478 ' OE1' ' HA ' ' B' ' 135' ' ' GLU . 3.7 mm-40 -69.87 -26.99 64.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.924 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -63.93 -48.17 77.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 176.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -53.92 49.0 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.276 -0.875 . . . . 0.0 108.833 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.33 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.289 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 10.0 mmtt . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 110.857 -0.053 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.483 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -110.41 106.38 15.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.1 ttm105 -78.62 102.32 7.91 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.247 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 1.106 HD13 ' CD2' ' B' ' 114' ' ' TYR . 4.5 pt -104.0 130.12 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.837 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.06 126.07 34.88 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.052 0.453 . . . . 0.0 111.681 -176.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.608 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -99.67 106.7 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.62 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' B' ' 102' ' ' LYS . 1.8 p -70.21 73.93 0.49 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.418 0.628 . . . . 0.0 109.388 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.054 HG21 ' HB3' ' A' ' 14' ' ' TYR . 7.3 p -76.85 -135.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.411 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.824 ' H ' HG22 ' A' ' 9' ' ' VAL . 16.0 t70 89.07 -7.31 0.44 Allowed 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.064 1.302 . . . . 0.0 108.964 -176.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 67.8 m -132.13 -54.77 0.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.404 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.762 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -46.14 -93.39 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.2 OUTLIER -178.32 38.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 118.964 0.802 . . . . 0.0 111.288 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.054 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.2 -41.85 17.95 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.318 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.7 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.6 mm100 -48.79 -40.6 29.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -173.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.901 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -57.58 -52.12 66.69 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 119.031 0.832 . . . . 0.0 112.141 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.096 HD22 ' HA ' ' B' ' 132' ' ' MET . 1.5 tp -61.66 -36.48 80.95 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 119.805 -0.758 . . . . 0.0 112.971 -177.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.7 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -79.89 -29.3 39.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.509 0.671 . . . . 0.0 110.737 177.71 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.495 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -75.19 -32.16 61.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.851 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.632 ' CE1' HD12 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -87.63 -41.92 13.06 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.655 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.622 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 165.42 12.36 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 176.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.435 HG23 ' C ' ' A' ' 21' ' ' ASP . 78.6 t -155.79 86.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 118.377 0.535 . . . . 0.0 111.354 -177.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.455 ' O ' ' CE ' ' B' ' 132' ' ' MET . 4.9 p30 -58.9 -95.1 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.116 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.81 -0.31 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 177.825 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.454 ' C ' ' O ' ' A' ' 24' ' ' ILE . 73.7 p -41.38 -64.36 0.57 Allowed 'General case' 0 C--O 1.244 0.796 0 C-N-CA 119.126 -1.029 . . . . 0.0 109.22 -179.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.46 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.06 -29.0 24.11 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.121 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.644 ' CD1' HD23 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -56.06 -61.86 2.1 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 116.812 0.306 . . . . 0.0 110.81 179.518 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.116 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.5 t -52.33 -61.6 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.163 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.723 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.5 p -50.25 -48.62 54.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.46 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.11 -51.3 25.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.65 ' OG1' HG21 ' B' ' 131' ' ' THR . 2.6 m -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.311 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 1.017 ' HE2' HG23 ' B' ' 124' ' ' ILE . 16.7 mtt -61.65 -49.95 74.47 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.986 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.476 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.69 -43.58 80.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.334 0.515 . . . . 0.0 109.862 178.731 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.476 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -66.07 -48.06 72.21 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.651 ' HB3' ' CD2' ' B' ' 117' ' ' LEU . 3.9 tp10 -64.37 -30.05 71.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.887 177.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.623 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -69.47 -49.52 54.1 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 177.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.39 -51.47 66.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.736 0.779 . . . . 0.0 109.004 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.426 ' NE ' ' OD1' ' A' ' 34' ' ' ASN . 2.0 mtm-85 . . . . . 0 N--CA 1.448 -0.551 0 CA-C-N 113.918 -1.492 . . . . 0.0 111.406 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.575 ' HE3' ' HA ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.377 0 CA-C-O 120.87 0.367 . . . . 0.0 111.122 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.575 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 4.9 tp60 -100.5 110.02 22.17 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.532 0.682 . . . . 0.0 111.111 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.527 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.1 OUTLIER -79.4 101.48 8.17 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.362 -178.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.809 HD13 ' CD2' ' A' ' 14' ' ' TYR . 5.5 pt -108.0 122.53 62.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.837 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.0 125.0 32.15 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.966 -178.176 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.61 HG13 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -100.75 101.8 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.839 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.1 p -66.81 86.23 0.12 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.384 0.611 . . . . 0.0 110.83 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.036 HG21 ' CD1' ' B' ' 114' ' ' TYR . 28.6 m -81.71 -141.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.849 -178.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.691 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.8 t70 93.1 -7.24 0.15 Allowed 'General case' 0 C--N 1.356 0.86 0 CA-C-O 121.97 0.89 . . . . 0.0 108.757 -176.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.04 -58.16 1.01 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.283 177.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.723 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.07 -89.69 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.395 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.8 m 179.91 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.266 0.939 . . . . 0.0 112.03 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.106 ' CD2' HD13 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -82.7 -40.8 20.12 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.742 0.817 . . . . 0.0 113.18 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.662 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 3.8 mt-30 -48.84 -42.03 34.98 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -175.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.623 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -58.42 -45.95 87.43 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.015 1.28 . . . . 0.0 112.091 -179.383 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.924 HD23 ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -55.39 -45.63 76.61 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.532 0.682 . . . . 0.0 111.132 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.662 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.18 -34.37 43.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 179.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.52 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -60.3 -28.45 68.12 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.701 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.62 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.32 -45.34 10.1 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.52 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.5 m-20 147.63 41.82 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 176.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.448 ' HB ' ' CD1' ' B' ' 117' ' ' LEU . 24.6 t -150.87 -37.92 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' B' ' 122' ' ' VAL . 17.0 m-80 64.26 -112.16 0.31 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.05 HG21 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.5 -0.99 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 179.169 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.449 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.1 OUTLIER -40.01 -64.39 0.5 Allowed 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.769 -178.706 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.22 -31.48 16.78 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.01 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.613 HD12 ' HG ' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.07 -61.18 2.39 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.562 0.345 . . . . 0.0 110.143 178.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.991 HG22 HG21 ' A' ' 24' ' ' ILE . 2.4 t -52.58 -61.31 0.82 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.121 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.762 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 28.8 t -48.92 -45.21 41.18 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -71.93 -51.42 22.23 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.65 HG21 ' OG1' ' A' ' 31' ' ' THR . 21.0 m -58.58 -47.81 83.03 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.027 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.096 ' HA ' HD22 ' A' ' 17' ' ' LEU . 5.5 mmt -56.25 -57.75 10.89 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.131 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.447 ' HA ' ' HB3' ' B' ' 136' ' ' ALA . 42.0 tt0 -51.66 -37.52 50.82 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.485 0.183 . . . . 0.0 111.301 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -55.38 14.43 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.639 ' HB3' HD11 ' A' ' 17' ' ' LEU . 3.2 mt-10 -74.92 -9.69 58.78 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.736 0.303 . . . . 0.0 110.72 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.901 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.33 -29.62 21.43 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 -48.34 11.45 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 122.153 0.977 . . . . 0.0 109.027 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 . . . . . 0 CA--C 1.545 0.763 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.103 -178.027 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.6 mtmm . . . . . 0 N--CA 1.468 0.463 0 CA-C-O 120.504 0.192 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.678 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -126.62 122.74 35.87 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.39 0.614 . . . . 0.0 112.488 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.92 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.72 111.46 14.85 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.697 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -111.75 122.91 66.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.435 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.717 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.04 128.8 41.02 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 119.99 -0.684 . . . . 0.0 112.641 -177.385 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.652 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.86 109.91 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 175.614 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.4 p -70.59 77.47 0.59 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.79 0.805 . . . . 0.0 109.392 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.888 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.9 p -92.51 -147.45 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-N 114.044 -1.435 . . . . 0.0 111.086 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.729 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 20.1 t70 106.7 13.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.477 1.132 . . . . 0.0 109.658 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -160.22 -40.3 0.05 Allowed 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.529 -1.668 . . . . 0.0 109.911 179.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.845 ' HB2' HG23 ' A' ' 9' ' ' VAL . 0.6 OUTLIER -69.81 35.11 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.53 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 28.7 m 72.18 4.08 4.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 177.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.001 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -58.0 -55.09 39.45 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.167 0.508 . . . . 0.0 111.959 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.551 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.6 mt-30 -49.74 -40.38 40.63 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -176.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.823 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -54.86 -32.49 60.8 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.917 HD22 HD22 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -77.35 -51.78 10.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.645 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.671 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -68.16 -26.09 65.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.398 0.618 . . . . 0.0 109.788 178.478 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -60.63 -30.61 69.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.749 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.679 ' CE2' ' HG ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -88.35 -44.32 10.87 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 118.677 -0.677 . . . . 0.0 110.041 178.704 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.597 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 160.4 24.22 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.533 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.662 ' O ' HD23 ' A' ' 17' ' ' LEU . 68.1 t -160.65 101.22 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.671 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 1.5 m120 -58.77 -82.92 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 106.287 -1.745 . . . . 0.0 106.287 177.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.872 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -161.04 -1.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.647 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.468 ' C ' ' O ' ' A' ' 24' ' ' ILE . 0.5 OUTLIER -38.81 -62.87 0.57 Allowed 'General case' 0 C--O 1.241 0.617 0 CA-C-N 118.872 0.76 . . . . 0.0 109.686 -178.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.34 -33.44 31.89 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.802 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.917 HD22 HD22 ' A' ' 17' ' ' LEU . 26.5 tp -59.13 -60.93 3.07 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.031 0.416 . . . . 0.0 111.21 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.921 HG13 ' HE2' ' A' ' 32' ' ' MET . 3.2 t -48.91 -68.49 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 O-C-N 123.351 0.407 . . . . 0.0 109.995 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.712 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -47.16 -41.49 17.93 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.183 0.593 . . . . 0.0 112.561 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -69.94 -50.04 45.92 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.856 0.836 . . . . 0.0 108.981 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.758 HG22 HD11 ' B' ' 127' ' ' LEU . 8.1 m -63.77 -28.83 70.14 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.205 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.921 ' HE2' HG13 ' A' ' 28' ' ' VAL . 4.0 mmt -55.87 -47.42 77.39 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.649 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -56.42 -57.17 13.44 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.521 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 2.8 t-20 -50.65 -51.31 50.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.013 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 1.024 ' HG2' HD13 ' B' ' 127' ' ' LEU . 2.0 tp10 -68.57 -36.94 79.43 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.653 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -57.93 -42.95 85.92 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -52.13 18.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.17 178.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.92 -177.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.494 0 CA-C-O 120.941 0.401 . . . . 0.0 111.413 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.729 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.0 tp60 -98.3 109.73 22.44 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.468 0.652 . . . . 0.0 109.815 178.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.504 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.1 OUTLIER -78.83 99.82 6.89 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.283 -178.304 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.811 HD13 ' CD1' ' A' ' 14' ' ' TYR . 7.2 pt -102.41 123.41 55.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.717 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.6 OUTLIER -131.24 123.35 28.23 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.914 -177.518 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.619 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.05 96.82 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 175.464 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.92 HG22 ' HG3' ' A' ' 4' ' ' ARG . 67.3 p -68.79 94.31 0.6 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.291 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.727 HG21 ' HB2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -116.49 -108.78 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.401 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.678 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 2.4 t0 81.95 25.51 0.2 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 123.211 1.481 . . . . 0.0 107.844 -174.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.8 p -151.21 -57.77 0.16 Allowed 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 112.005 -2.362 . . . . 0.0 111.196 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.712 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 65.3 m-20 -72.87 59.14 0.48 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.56 ' O ' ' HB3' ' A' ' 32' ' ' MET . 64.8 m 60.68 2.65 0.52 Allowed 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.84 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -59.97 -49.91 75.82 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.473 0.654 . . . . 0.0 109.584 178.715 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.716 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -49.46 -39.56 33.79 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.66 -177.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.653 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -54.99 -45.62 75.07 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.134 0.879 . . . . 0.0 110.238 179.578 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.93 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.3 OUTLIER -56.51 -53.89 52.2 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.843 179.208 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.716 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 17.8 pttt -68.92 -25.29 64.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.537 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -55.66 -28.0 53.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.3 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.568 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 87.6 m-85 -87.92 -42.75 12.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 177.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.568 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.6 t70 118.27 61.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.648 178.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.918 ' CG1' HD12 ' B' ' 117' ' ' LEU . 3.2 p -151.62 -33.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.46 -178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.433 ' OD1' ' HB3' ' B' ' 118' ' ' LYS . 67.9 m-80 61.83 -123.38 0.78 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -178.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 0.884 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -137.28 9.93 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.598 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.436 ' C ' ' O ' ' B' ' 124' ' ' ILE . 91.9 p -38.84 -63.42 0.52 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.107 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.07 -34.64 14.19 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.681 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 1.024 HD13 ' HG2' ' A' ' 35' ' ' GLU . 34.0 tp -52.85 -61.64 2.16 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 117.33 0.565 . . . . 0.0 110.993 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.884 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.6 t -50.05 -63.86 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.251 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.835 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.81 -47.0 42.58 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 123.773 0.829 . . . . 0.0 112.916 178.085 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -65.46 -56.83 10.28 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.547 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -55.49 -40.48 71.77 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.835 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.001 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 31.6 mtt -58.94 -53.76 54.77 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.816 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.53 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -53.32 -45.14 68.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.438 0.563 . . . . 0.0 110.843 178.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -65.41 -56.95 9.69 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.085 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -64.22 -24.14 67.56 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.823 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -71.76 -49.42 39.14 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.045 0.45 . . . . 0.0 109.863 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -52.23 64.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.706 0.765 . . . . 0.0 109.83 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . 0.574 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.442 -0.869 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.905 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.444 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 8.4 mtmm . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.475 0.179 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.573 ' O ' ' HA ' ' B' ' 108' ' ' THR . 44.4 tt0 -100.19 118.73 37.11 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.218 0.533 . . . . 0.0 111.833 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.982 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.12 103.12 7.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.67 0.748 . . . . 0.0 111.594 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.811 HD13 ' CD1' ' B' ' 114' ' ' TYR . 2.6 pt -108.08 122.83 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.662 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.39 125.97 32.07 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.859 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.646 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.69 109.83 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.393 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.3 p -70.34 85.93 0.59 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.37 0.605 . . . . 0.0 110.484 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.204 HG21 ' CD1' ' A' ' 14' ' ' TYR . 26.6 m -77.98 -146.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.088 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.664 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 22.9 t0 91.95 -7.88 0.22 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.777 0.799 . . . . 0.0 109.153 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.5 t -130.91 -59.72 0.99 Allowed 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.053 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.769 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.7 OUTLIER -44.4 -94.26 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -178.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.538 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 3.1 m -179.8 38.15 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 118.978 0.808 . . . . 0.0 111.526 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.204 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.92 -44.29 15.53 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.655 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 3.4 mt-30 -48.78 -38.78 22.92 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.809 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -53.74 -57.18 11.79 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.673 0.67 . . . . 0.0 112.331 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.923 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -54.25 -42.68 70.18 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 120.211 -0.596 . . . . 0.0 112.437 -178.05 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.655 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.7 -28.4 40.65 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.371 179.615 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -56.29 -24.86 45.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.587 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.615 ' HE2' ' HA ' ' B' ' 136' ' ' ALA . 2.8 m-85 -87.98 -49.15 7.25 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.146 -0.934 . . . . 0.0 108.82 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.562 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 3.8 m-20 143.46 37.15 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 O-C-N 124.443 1.089 . . . . 0.0 110.504 178.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 t -147.87 77.74 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.652 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.537 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 18.9 m-80 -59.0 -105.17 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.053 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -147.62 7.4 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.43 ' C ' ' O ' ' A' ' 24' ' ' ILE . 31.0 p -41.86 -64.42 0.58 Allowed 'General case' 0 C--O 1.24 0.594 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.335 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.8 -30.85 13.79 Favored Glycine 0 C--N 1.333 0.39 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.991 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.674 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -52.3 -61.5 2.24 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 122.486 0.315 . . . . 0.0 110.226 178.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.053 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -51.23 -58.7 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.749 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 9.7 p -48.67 -42.4 34.56 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.403 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -79.59 -45.12 19.76 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.13 0.49 . . . . 0.0 110.256 179.826 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.575 HG22 HD21 ' B' ' 127' ' ' LEU . 3.2 m -59.3 -44.64 92.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.803 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.933 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.16 -48.52 61.84 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.436 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -61.38 -37.42 83.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.825 -0.17 . . . . 0.0 111.315 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.445 HD22 ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -68.82 -51.31 42.0 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.712 ' HG2' HD13 ' B' ' 127' ' ' LEU . 20.5 tp10 -65.77 -34.45 78.21 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.586 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -62.45 -45.16 94.33 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -50.42 71.77 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 122.121 0.962 . . . . 0.0 108.785 177.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.2 ttp85 . . . . . 0 CA--C 1.55 0.969 0 CA-C-N 113.322 -1.763 . . . . 0.0 113.673 -178.013 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.664 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.266 0 CA-C-O 121.204 0.526 . . . . 0.0 111.122 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.683 ' HB3' HG23 ' A' ' 9' ' ' VAL . 13.9 tt0 -105.21 107.63 18.72 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.823 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.452 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 5.2 ttm105 -78.6 101.48 7.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.393 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 1.092 HD13 ' CD2' ' A' ' 14' ' ' TYR . 20.0 pt -102.94 116.6 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.65 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.662 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -115.92 119.19 35.12 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.223 -177.844 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.795 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.63 92.21 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 176.03 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.982 HG22 ' HG3' ' A' ' 4' ' ' ARG . 81.7 p -62.08 90.87 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.089 0.471 . . . . 0.0 110.412 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.911 HG21 ' HB2' ' B' ' 114' ' ' TYR . 2.1 t -84.12 -136.43 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.04 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.7 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 90.14 -12.26 0.32 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -175.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 39.5 t -122.31 -63.11 1.32 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.161 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.749 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -43.49 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.365 0.416 . . . . 0.0 112.071 -179.018 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER 176.24 44.24 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.744 0.702 . . . . 0.0 110.671 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.911 ' HB2' HG21 ' B' ' 109' ' ' VAL . 0.3 OUTLIER -83.1 -41.9 18.03 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.471 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.616 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.58 -43.62 36.06 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -176.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.586 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -48.83 -30.61 5.96 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.713 0.688 . . . . 0.0 112.163 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.933 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.34 -60.11 2.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.374 178.351 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.616 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.1 OUTLIER -63.38 -25.8 68.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.241 179.754 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.407 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.93 -29.17 55.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.518 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.594 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 14.4 m-30 -94.23 -42.32 9.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.594 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 27.6 t70 125.15 54.7 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 122.343 1.068 . . . . 0.0 110.177 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.891 ' CG1' HD13 ' B' ' 117' ' ' LEU . 4.8 p -142.84 -38.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 CA-C-N 113.846 -1.525 . . . . 0.0 111.856 -177.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.708 ' O ' HD12 ' B' ' 117' ' ' LEU . 21.9 m-80 54.65 -117.05 1.12 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 0.995 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.78 5.86 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -179.296 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.456 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -39.18 -63.78 0.51 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.978 -178.471 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.419 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -85.98 -31.24 21.02 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.347 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.739 HD23 HG23 ' B' ' 124' ' ' ILE . 20.3 tp -55.5 -61.67 2.19 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 116.824 0.312 . . . . 0.0 110.664 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.995 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.2 t -52.76 -63.22 0.5 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.974 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.057 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.769 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 11.3 p -49.52 -46.78 48.91 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -72.74 -47.4 47.21 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.537 HG21 ' OG1' ' A' ' 31' ' ' THR . 16.7 m -57.78 -53.98 52.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.4 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.923 ' SD ' HD12 ' A' ' 17' ' ' LEU . 6.1 mmt -50.06 -52.65 32.78 Favored 'General case' 0 C--O 1.205 -1.246 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.118 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.538 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 3.6 tt0 -53.96 -49.1 69.5 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 117.735 0.243 . . . . 0.0 111.369 179.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -65.04 -43.42 92.43 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -76.19 -8.65 57.5 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.124 177.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.809 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.43 -47.21 8.95 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 123.158 0.583 . . . . 0.0 109.909 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -56.82 6.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.486 0.66 . . . . 0.0 109.867 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.545 0.757 0 CA-C-N 114.579 -1.191 . . . . 0.0 114.126 -177.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.487 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.2 mmtm . . . . . 0 C--O 1.235 0.29 0 CA-C-O 121.114 0.483 . . . . 0.0 110.149 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.508 ' HG2' ' CG2' ' A' ' 5' ' ' ILE . 1.0 OUTLIER -88.88 114.62 25.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.489 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.975 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -78.94 98.57 6.46 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.936 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 1.115 HG21 ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -114.67 109.8 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.526 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.788 ' CB ' ' HB ' ' B' ' 106' ' ' THR . 0.3 OUTLIER -108.87 133.81 52.39 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.582 -177.252 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.725 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -99.44 101.18 11.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.0 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.438 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 25.9 p -62.39 88.46 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.632 0.73 . . . . 0.0 110.189 -178.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.236 HG21 ' CD2' ' A' ' 14' ' ' TYR . 28.7 m -80.05 -137.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 114.258 -1.337 . . . . 0.0 112.032 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.548 ' N ' HG23 ' A' ' 9' ' ' VAL . 24.6 t0 81.82 -10.54 1.13 Allowed 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -177.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.0 m -120.49 -69.68 0.83 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.674 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.7 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 0.2 OUTLIER -51.32 -89.41 0.0 OUTLIER 'General case' 0 C--N 1.353 0.747 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.146 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.514 ' HB3' ' O ' ' B' ' 129' ' ' SER . 29.2 t -177.14 47.55 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.249 0.931 . . . . 0.0 111.529 -178.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.236 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -80.35 -46.8 15.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -179.796 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.64 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 2.3 mm100 -49.18 -39.78 30.65 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -176.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.529 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.7 OUTLIER -56.01 -56.15 24.26 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.704 HD13 ' CE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -45.5 -52.91 9.66 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.804 0.812 . . . . 0.0 111.508 -177.695 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.729 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 5.8 pttt -78.99 -26.58 43.35 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.772 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -62.2 -22.84 66.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.251 177.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.704 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -87.83 -43.37 11.88 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 118.666 -0.683 . . . . 0.0 109.441 178.322 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.608 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 164.34 21.79 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 177.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.519 ' H ' ' HA ' ' A' ' 18' ' ' LYS . 59.0 t -153.54 101.82 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.824 ' O ' HD12 ' A' ' 24' ' ' ILE . 46.8 m-80 -66.25 52.37 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.083 HG21 ' HE3' ' B' ' 132' ' ' MET . 1.9 pp 35.61 -2.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 120.068 3.359 . . . . 0.0 120.068 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.504 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -38.05 -57.66 1.03 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 118.917 0.78 . . . . 0.0 110.204 -179.537 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.61 -29.55 43.25 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.868 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.754 HD12 ' CG2' ' A' ' 24' ' ' ILE . 1.1 tm? -60.83 -56.13 24.82 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.943 HG12 ' SD ' ' A' ' 32' ' ' MET . 90.7 t -45.52 -67.95 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 109.987 178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.628 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.1 p -50.57 -42.24 55.28 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.577 0.751 . . . . 0.0 112.71 178.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.2 m -66.46 -57.44 7.36 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.456 ' HA ' HD22 ' A' ' 34' ' ' ASN . 0.8 OUTLIER -52.85 -41.64 64.46 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.038 178.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.943 ' SD ' HG12 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -48.68 -49.59 37.0 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.389 178.713 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.42 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -57.68 -45.49 85.55 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.361 179.556 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.456 HD22 ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -65.6 -51.79 57.02 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.185 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.881 ' HG3' HD21 ' B' ' 127' ' ' LEU . 1.4 mm-40 -64.5 -28.31 69.57 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.576 178.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.569 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.61 -45.57 61.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.002 0.43 . . . . 0.0 110.491 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -73.23 -56.54 4.94 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.088 0.471 . . . . 0.0 111.233 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.525 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.6 OUTLIER . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.388 0.137 . . . . 0.0 110.654 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.807 ' HB3' HG23 ' A' ' 9' ' ' VAL . 12.5 tp60 -114.62 116.98 29.61 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.324 0.583 . . . . 0.0 111.472 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.676 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.38 106.49 11.45 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.29 -0.868 . . . . 0.0 112.042 -179.124 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.883 HD13 ' CD1' ' A' ' 14' ' ' TYR . 2.8 pt -115.03 115.65 50.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.788 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -124.46 132.12 53.5 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.612 -177.521 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 1.055 HG13 HD11 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.37 99.28 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 174.676 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.975 HG22 ' HG3' ' A' ' 4' ' ' ARG . 71.8 p -69.15 71.92 0.27 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.773 HG21 ' HB3' ' B' ' 112' ' ' ASP . 14.4 p -101.81 -131.56 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.919 -176.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.754 ' H ' HG22 ' B' ' 109' ' ' VAL . 1.0 OUTLIER 155.38 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -178.335 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 8.3 t -80.43 -1.23 40.58 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.773 ' HB3' HG21 ' B' ' 109' ' ' VAL . 4.9 t0 -74.91 52.75 0.56 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 120.303 1.41 . . . . 0.0 109.534 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 32' ' ' MET . 2.8 m 65.17 -11.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.115 ' CZ ' HG21 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -53.53 -60.04 3.82 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 118.207 0.458 . . . . 0.0 110.326 179.719 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 85.8 mt-30 -49.56 -41.04 40.5 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.979 -177.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.508 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.93 -28.08 21.85 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.833 HD12 ' CG1' ' B' ' 122' ' ' VAL . 0.5 OUTLIER -77.52 -55.4 5.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.44 0.638 . . . . 0.0 110.885 178.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.702 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -64.01 -25.87 68.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.26 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.87 -27.8 45.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.379 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.584 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 13.0 m-30 -88.5 -42.53 12.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.078 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 18.7 t70 124.95 63.67 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 O-C-N 124.548 1.155 . . . . 0.0 110.469 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.833 ' CG1' HD12 ' B' ' 117' ' ' LEU . 3.7 p -159.7 -32.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.507 -178.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.472 ' H ' ' HA ' ' B' ' 118' ' ' LYS . 6.7 p30 54.64 -102.91 0.16 Allowed 'General case' 0 C--N 1.343 0.29 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.166 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -158.4 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 179.3 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.448 ' OG ' ' N ' ' B' ' 126' ' ' GLY . 8.8 p -39.61 -64.63 0.46 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.436 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.747 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.04 -32.78 16.56 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.724 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.881 HD21 ' HG3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -56.57 -62.92 1.4 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.852 0.326 . . . . 0.0 111.12 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.166 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -55.22 -69.16 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.748 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 1.1 t -51.38 -41.21 60.53 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.747 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -76.05 -50.08 15.75 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 118.754 0.706 . . . . 0.0 109.282 179.12 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.613 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 1.3 m -51.47 -35.96 42.23 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.083 ' HE3' HG21 ' A' ' 24' ' ' ILE . 2.4 mtt -55.4 -48.76 73.87 Favored 'General case' 0 C--O 1.201 -1.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.439 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -53.98 -36.44 62.92 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.216 0.916 . . . . 0.0 110.561 179.42 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . 0.471 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 1.3 m-20 -75.19 -48.49 23.27 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.704 ' CG ' HD21 ' A' ' 17' ' ' LEU . 2.7 tp10 -68.92 -21.94 64.19 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.834 177.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.64 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -76.71 -47.37 22.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.672 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -56.41 13.43 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.659 0.742 . . . . 0.0 109.549 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.444 -0.759 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.445 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt . . . . . 0 N--CA 1.47 0.527 0 CA-C-O 121.011 0.434 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.563 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -98.76 106.78 19.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.454 0.645 . . . . 0.0 110.397 179.516 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 1.014 ' HG2' HG22 ' B' ' 106' ' ' THR . 0.0 OUTLIER -79.48 103.91 9.72 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.187 -179.221 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.909 HG21 ' CE1' ' B' ' 114' ' ' TYR . 9.0 pt -100.05 128.88 51.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.846 ' CG2' HG23 ' B' ' 106' ' ' THR . 0.3 OUTLIER -132.52 124.37 28.36 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 117.992 -1.483 . . . . 0.0 113.997 -177.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.677 HG22 HG22 ' A' ' 9' ' ' VAL . 1.2 p -100.33 101.72 12.47 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 176.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.546 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 37.7 p -69.98 80.71 0.48 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.447 0.641 . . . . 0.0 110.471 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.963 HG11 ' HB3' ' A' ' 14' ' ' TYR . 4.0 t -72.93 -124.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.912 -178.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.712 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 0.4 OUTLIER 99.95 6.02 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.179 0.992 . . . . 0.0 109.88 -176.294 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.722 ' H ' HG12 ' A' ' 9' ' ' VAL . 38.7 t -167.44 -42.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.876 -1.056 . . . . 0.0 112.161 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.65 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 0.5 OUTLIER -62.24 47.92 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -177.274 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.565 ' O ' ' HB3' ' B' ' 132' ' ' MET . 1.0 OUTLIER 53.66 7.51 0.11 Allowed 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 177.181 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.972 ' CE1' HD11 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -66.59 -52.57 43.95 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.278 0.49 . . . . 0.0 111.141 179.181 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.77 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.54 -36.88 24.92 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.72 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -55.5 -56.47 19.82 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.477 0.58 . . . . 0.0 111.224 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.806 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.5 -54.09 15.62 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.288 0.566 . . . . 0.0 111.355 -178.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 7.5 pttt -71.9 -25.74 62.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.153 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -58.5 -20.12 42.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.469 178.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.648 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 23.5 m-85 -87.69 -53.58 4.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.65 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 O-C-N 124.303 1.002 . . . . 0.0 111.821 178.57 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.805 ' CG1' HD12 ' A' ' 17' ' ' LEU . 9.7 p -147.03 80.61 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.522 0.677 . . . . 0.0 112.439 -178.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 1.054 ' O ' HD12 ' A' ' 24' ' ' ILE . 48.8 m-80 -65.42 63.44 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.883 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.095 HD11 HD12 ' B' ' 105' ' ' ILE . 0.5 OUTLIER 39.53 -7.94 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 118.336 2.717 . . . . 0.0 118.336 179.176 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -37.71 -60.07 0.75 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 120.432 1.469 . . . . 0.0 110.318 -178.28 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.53 -28.27 40.05 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.143 -0.551 . . . . 0.0 112.279 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.737 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -65.09 -61.35 2.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 122.677 0.391 . . . . 0.0 111.202 179.961 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.846 HG22 ' CG2' ' B' ' 128' ' ' VAL . 15.4 t -47.89 -61.25 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.478 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.812 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 7.7 p -49.2 -44.8 43.46 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 124.814 1.246 . . . . 0.0 113.417 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 97.4 m -67.07 -51.09 58.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.679 HG22 HD21 ' B' ' 127' ' ' LEU . 1.2 m -60.37 -34.07 73.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.288 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.925 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 3.3 mmt -57.73 -57.28 13.45 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.933 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.432 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -57.98 -45.42 86.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.606 0.241 . . . . 0.0 110.866 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.432 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 2.4 t-20 -64.06 -55.49 21.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.615 179.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.914 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.7 tp10 -67.57 -22.1 65.4 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.745 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -72.1 -42.94 65.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.71 -56.63 5.0 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.783 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.479 ' HA ' ' HD3' ' A' ' 38' ' ' ARG . 22.3 mmt180 . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -176.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.712 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.465 0.302 0 CA-C-O 120.716 0.293 . . . . 0.0 111.389 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.543 ' O ' ' HA ' ' A' ' 8' ' ' THR . 3.7 tt0 -122.79 125.65 45.88 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.808 ' NH2' HG21 ' B' ' 106' ' ' THR . 4.3 ttt-85 -78.32 112.51 15.4 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.958 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 1.095 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -95.45 122.47 46.95 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.542 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 175.069 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 1.014 HG22 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -131.89 109.83 10.36 Favored 'General case' 0 C--N 1.299 -1.589 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.889 -177.03 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.817 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -102.92 107.71 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.364 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.822 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 6.1 p -70.97 98.19 1.57 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.464 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.758 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.94 -148.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.888 -178.449 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.598 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 15.6 t70 106.55 6.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 122.197 0.998 . . . . 0.0 108.591 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.68 -41.68 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.6 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.812 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -78.57 42.32 0.43 Allowed 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -176.875 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.497 ' O ' ' HB3' ' A' ' 32' ' ' MET . 41.0 m 67.97 -2.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 177.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.909 ' CE1' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -54.23 -51.02 65.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.878 0.763 . . . . 0.0 110.604 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.586 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 6.2 mm-40 -50.0 -43.99 50.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.94 -176.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.745 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -53.55 -27.9 28.65 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.764 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.925 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -77.58 -55.46 5.34 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.622 0.725 . . . . 0.0 110.906 178.184 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.6 OUTLIER -65.87 -25.44 67.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.832 179.848 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.82 -28.35 48.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.007 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.563 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 16.0 m-30 -88.57 -42.56 11.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.897 178.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 25.3 t70 121.29 62.4 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 124.58 1.175 . . . . 0.0 109.775 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 51.3 t -144.21 -48.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.975 -178.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 64.54 -113.95 0.34 Allowed 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -178.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 0.981 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -146.93 4.28 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 114.66 1.355 . . . . 0.0 114.66 179.245 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.427 ' C ' ' O ' ' B' ' 124' ' ' ILE . 27.6 t -40.58 -64.6 0.5 Allowed 'General case' 0 C--O 1.241 0.643 0 C-N-CA 120.139 -0.625 . . . . 0.0 109.905 -178.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.451 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.71 -25.41 35.36 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.787 177.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.766 HD11 ' HG2' ' A' ' 35' ' ' GLU . 4.3 tp -60.84 -61.41 2.61 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 179.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.981 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.1 t -52.48 -65.57 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.884 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.65 ' HB3' ' CB ' ' A' ' 12' ' ' ASP . 8.8 p -46.94 -44.23 19.75 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.451 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -75.24 -43.81 49.57 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 119.097 0.862 . . . . 0.0 109.392 178.605 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.602 ' OG1' HG21 ' A' ' 31' ' ' THR . 18.9 m -59.58 -39.9 85.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.479 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.806 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 6.4 mmt -61.05 -57.5 12.34 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.341 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -34.24 56.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 118.152 0.433 . . . . 0.0 111.745 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -79.23 -47.86 15.2 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.182 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.685 ' HB3' HD21 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -72.87 -22.2 60.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.988 0.423 . . . . 0.0 109.925 177.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.72 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -71.71 -45.2 62.56 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.6 mmt85 -67.5 -56.05 11.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.104 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . 0.435 ' HD2' ' C ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.751 0 CA-C-N 114.052 -1.431 . . . . 0.0 114.287 -177.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.6 ' HA ' ' CB ' ' B' ' 110' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.412 0 CA-C-O 121.193 0.52 . . . . 0.0 111.746 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.612 ' O ' ' HA ' ' B' ' 108' ' ' THR . 15.8 tt0 -129.6 113.12 14.42 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 121.491 0.662 . . . . 0.0 110.997 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.863 ' HG3' HG22 ' B' ' 108' ' ' THR . 4.3 ttm180 -78.77 109.8 13.35 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.598 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.909 HD12 HD11 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -102.54 109.82 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.059 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 176.153 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.858 ' CG2' ' HG2' ' B' ' 104' ' ' ARG . 1.5 m -117.25 118.55 32.59 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 120.264 -0.574 . . . . 0.0 111.463 -175.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.916 HG13 HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.75 106.22 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.24 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.83 79.91 0.62 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.209 0.528 . . . . 0.0 110.375 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.162 HG21 ' CD1' ' A' ' 14' ' ' TYR . 6.2 m -72.84 -158.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.37 -178.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.596 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 10.9 t70 93.55 -22.66 0.06 Allowed 'General case' 0 C--N 1.351 0.643 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -176.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.47 ' OG ' ' HE3' ' B' ' 102' ' ' LYS . 0.4 OUTLIER -116.37 -1.58 12.27 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.896 177.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.758 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -110.7 -95.58 0.42 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.774 177.596 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.78 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.3 OUTLIER -173.85 30.34 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 118.481 0.582 . . . . 0.0 111.96 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.162 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -70.34 -39.11 74.89 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.533 0.733 . . . . 0.0 112.243 179.091 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.571 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.8 OUTLIER -49.79 -47.94 50.9 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -176.442 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.73 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -49.53 -28.96 6.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -179.468 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.845 HD12 HG23 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -78.26 -60.16 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.391 0.615 . . . . 0.0 111.057 178.101 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -62.67 -25.5 68.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.648 179.496 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.4 -27.11 34.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.647 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.679 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 14.8 m-30 -88.58 -52.32 5.22 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.862 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.679 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 16.6 p-10 147.02 40.86 0.0 OUTLIER 'General case' 0 C--N 1.357 0.924 0 O-C-N 124.638 1.211 . . . . 0.0 111.395 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.799 HG11 HD22 ' A' ' 17' ' ' LEU . 14.4 p -138.08 89.33 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.162 0.506 . . . . 0.0 112.317 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.975 ' O ' HD12 ' A' ' 24' ' ' ILE . 5.4 m-20 -76.78 50.89 0.73 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.161 0.505 . . . . 0.0 110.636 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.993 ' HB ' HG23 ' A' ' 28' ' ' VAL . 1.4 pp 33.76 5.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.888 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.4 p -37.49 -63.55 0.44 Allowed 'General case' 0 C--O 1.247 0.961 0 CA-C-N 119.092 0.86 . . . . 0.0 110.743 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.445 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -76.44 -25.64 65.21 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.003 177.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.827 HD12 ' CG2' ' A' ' 24' ' ' ILE . 3.2 tm? -65.84 -60.21 3.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.51 -0.281 . . . . 0.0 110.791 179.369 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.993 HG23 ' HB ' ' A' ' 24' ' ' ILE . 61.8 t -42.14 -71.6 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 CA-C-N 117.586 0.175 . . . . 0.0 110.642 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.673 ' O ' ' HB2' ' B' ' 113' ' ' SER . 88.2 p -49.57 -34.17 16.95 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.1 m -75.2 -52.14 11.65 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 121.043 -1.036 . . . . 0.0 110.308 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.624 ' CG2' HD11 ' B' ' 127' ' ' LEU . 0.8 OUTLIER -56.8 -28.45 61.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.403 -179.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.912 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -54.2 -54.44 39.88 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.698 178.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.461 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.55 -33.14 65.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 111.633 -179.416 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.461 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.8 t-20 -76.33 -47.68 22.7 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.733 ' HB3' HD21 ' B' ' 117' ' ' LEU . 5.1 tp10 -67.41 -31.47 71.7 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.327 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.745 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -72.41 -39.47 67.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.74 179.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -70.14 -56.2 7.45 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.57 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 . . . . . 0 N--CA 1.446 -0.652 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.823 -177.477 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.596 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 5.7 mmtm . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.581 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -100.72 111.76 24.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.823 0.821 . . . . 0.0 112.627 -178.567 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.858 ' HG2' ' CG2' ' A' ' 6' ' ' THR . 0.1 OUTLIER -79.59 101.31 8.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.7 -178.602 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.916 HG12 HG13 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -107.3 128.52 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 176.101 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.681 HG22 HG23 ' A' ' 6' ' ' THR . 0.5 OUTLIER -132.09 129.12 39.54 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.659 -178.494 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.888 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.23 88.08 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 175.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.863 HG22 ' HG3' ' A' ' 4' ' ' ARG . 57.9 p -70.82 67.27 0.38 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.467 0.651 . . . . 0.0 109.691 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.137 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -63.77 -101.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 114.716 -1.129 . . . . 0.0 112.341 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.632 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.2 t70 75.75 -1.89 2.89 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 -173.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.447 ' H ' ' C ' ' B' ' 109' ' ' VAL . 54.9 p -94.26 -73.8 0.56 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.034 -1.439 . . . . 0.0 109.758 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' B' ' 114' ' ' TYR . 1.1 p-10 -144.83 156.1 43.84 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -175.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.673 ' HB2' ' O ' ' A' ' 29' ' ' SER . 1.0 OUTLIER 48.19 -27.3 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 175.539 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.137 ' CB ' HG21 ' B' ' 109' ' ' VAL . 1.7 t80 -54.6 -60.04 3.89 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.321 0.964 . . . . 0.0 109.393 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.655 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 48.0 mt-30 -49.75 -42.22 45.79 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.669 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.745 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -50.71 -55.7 15.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.468 0.651 . . . . 0.0 109.375 178.169 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.733 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -46.72 -53.89 10.82 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.318 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.655 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -74.5 -25.47 59.38 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.085 179.666 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.501 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.82 -29.83 60.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.647 178.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.673 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 15.0 m-30 -87.94 -40.63 13.77 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.673 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 4.5 p-10 132.92 17.33 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 O-C-N 124.988 1.43 . . . . 0.0 111.751 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.558 ' HB ' ' CD1' ' B' ' 117' ' ' LEU . 26.1 t -105.34 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.177 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.87 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -67.43 45.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.092 0.472 . . . . 0.0 111.199 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.014 HG22 HD12 ' B' ' 127' ' ' LEU . 1.8 pp 32.74 6.56 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 119.457 3.132 . . . . 0.0 119.457 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.517 ' N ' ' O ' ' B' ' 123' ' ' ASN . 3.7 p -37.93 -62.93 0.51 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 117.973 0.351 . . . . 0.0 111.347 -178.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.452 ' N ' ' OG ' ' B' ' 125' ' ' SER . . . -82.85 -24.36 53.15 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.058 178.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 1.014 HD12 HG22 ' B' ' 124' ' ' ILE . 2.3 tm? -66.81 -61.51 1.92 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.807 HG23 ' HB ' ' B' ' 124' ' ' ILE . 2.6 t -52.43 -60.64 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-O 121.007 0.432 . . . . 0.0 109.889 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.758 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 63.3 p -54.82 -33.25 61.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.075 -0.966 . . . . 0.0 113.397 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 3.4 m -79.57 -54.22 6.11 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 121.728 -0.607 . . . . 0.0 111.073 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.04 -36.64 40.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.915 -178.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.83 ' HE3' HG21 ' A' ' 24' ' ' ILE . 3.9 mtt -56.77 -53.23 60.18 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.36 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.78 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -56.26 -40.48 74.27 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.742 -179.777 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . 0.55 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 73.9 m-80 -67.98 -55.08 14.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.299 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -34.58 77.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.925 0.393 . . . . 0.0 110.248 178.369 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.73 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -66.38 -45.69 79.21 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.057 178.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -52.17 65.27 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.814 0.816 . . . . 0.0 109.378 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.444 -0.737 0 CA-C-N 114.003 -1.453 . . . . 0.0 112.145 -178.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.54 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.831 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.61 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 33.6 tp60 -112.59 110.34 20.45 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.276 178.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 1.145 ' HG2' HG22 ' B' ' 106' ' ' THR . 5.4 ttm105 -80.0 117.03 20.47 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-O 121.641 0.734 . . . . 0.0 112.662 -178.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.82 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.96 131.95 55.59 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 177.036 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.918 ' CB ' HG23 ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.48 121.93 32.08 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.557 -177.422 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.689 ' CG1' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -102.72 96.94 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 174.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.617 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 69.7 p -70.92 87.35 0.72 Allowed 'General case' 0 C--N 1.317 -0.84 0 O-C-N 121.102 -0.999 . . . . 0.0 109.921 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.041 HG23 ' HB3' ' A' ' 14' ' ' TYR . 14.0 m -144.86 55.47 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 117.217 2.302 . . . . 0.0 117.217 -177.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.818 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 0.8 OUTLIER -73.98 54.33 0.51 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 123.761 1.743 . . . . 0.0 108.277 173.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.44 ' H ' ' C ' ' A' ' 9' ' ' VAL . 28.6 t -164.65 -47.78 0.03 OUTLIER 'General case' 0 C--N 1.27 -2.85 0 CA-C-N 111.463 -2.608 . . . . 0.0 110.905 -178.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.628 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 20.4 m-20 -73.4 47.25 0.22 Allowed 'General case' 0 C--N 1.348 0.502 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.717 -178.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.549 ' O ' ' HB3' ' B' ' 132' ' ' MET . 51.0 m 69.5 -3.07 1.71 Allowed 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.041 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -61.64 -45.23 94.96 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.556 0.693 . . . . 0.0 110.213 179.26 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.752 ' HG3' ' HA ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -48.17 -44.68 32.75 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.092 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.603 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.1 OUTLIER -60.36 -49.01 79.3 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -178.63 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.953 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.1 -44.78 52.22 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.393 0.616 . . . . 0.0 111.372 -179.66 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.751 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 21.2 pttt -79.63 -33.85 41.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.32 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.503 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -62.07 -28.99 70.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.362 178.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.603 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -88.15 -45.29 10.24 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 117.772 -1.109 . . . . 0.0 110.864 179.218 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.603 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 152.35 31.46 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.453 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.533 HG23 ' HE1' ' A' ' 20' ' ' TYR . 27.1 t -145.52 -33.67 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.502 -0.879 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.603 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 9.9 p30 53.89 -104.42 0.21 Allowed 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -176.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.053 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -153.66 -0.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 178.456 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.481 ' C ' ' O ' ' A' ' 24' ' ' ILE . 51.8 p -39.01 -64.31 0.46 Allowed 'General case' 0 C--O 1.241 0.648 0 CA-C-N 119.265 0.938 . . . . 0.0 109.505 -178.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.45 -28.64 24.13 Favored Glycine 0 CA--C 1.522 0.475 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.208 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.746 HD13 HD11 ' A' ' 17' ' ' LEU . 2.9 tp -56.45 -58.29 8.67 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.815 0.308 . . . . 0.0 110.357 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.053 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.6 t -53.99 -62.6 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.7 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 59.9 p -49.43 -45.16 46.11 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.72 -46.07 26.89 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.861 0.362 . . . . 0.0 110.221 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.635 ' CG2' HD21 ' B' ' 127' ' ' LEU . 36.3 m -61.2 -38.52 86.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.399 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 1.021 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -51.3 -43.34 61.63 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.135 179.258 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.507 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -63.49 -46.2 87.21 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.558 0.218 . . . . 0.0 110.731 179.02 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.507 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.27 -48.17 79.29 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.581 ' HG3' ' HG ' ' B' ' 127' ' ' LEU . 2.5 mm-40 -66.26 -36.14 82.24 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.501 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -59.38 -42.78 92.45 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.719 -0.613 . . . . 0.0 109.466 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -78.36 -56.46 4.43 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.922 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -176.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 121.173 0.511 . . . . 0.0 111.927 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.818 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 1.4 tp60 -97.0 121.59 39.05 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.864 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.597 ' HG3' ' OG1' ' A' ' 6' ' ' THR . 2.7 ttm105 -77.8 105.99 9.34 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.734 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.727 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -99.8 108.69 23.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.022 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 178.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 1.145 HG22 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -119.35 112.74 19.81 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.416 -173.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.512 HG22 ' CG1' ' B' ' 109' ' ' VAL . 1.2 p -100.59 112.13 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.45 177.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.784 HG23 ' HG3' ' A' ' 4' ' ' ARG . 3.3 p -70.93 87.51 0.73 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.994 HG21 ' CD2' ' B' ' 114' ' ' TYR . 13.2 m -89.37 -143.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.653 ' N ' HG23 ' B' ' 109' ' ' VAL . 6.4 t70 87.95 -7.49 0.56 Allowed 'General case' 0 C--N 1.351 0.633 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -176.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.34 -65.52 1.1 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.244 -1.344 . . . . 0.0 107.839 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.7 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -43.53 -86.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.172 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 2.2 m 175.97 41.31 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 118.428 0.558 . . . . 0.0 111.454 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.994 ' CD2' HG21 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -83.6 -45.46 13.47 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.631 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -48.58 -40.68 28.19 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.048 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.501 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -53.81 -56.28 18.97 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.115 0.87 . . . . 0.0 111.705 179.387 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.832 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -55.67 -45.74 77.68 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.925 -178.534 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.631 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -73.41 -26.85 61.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.948 179.037 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.404 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -70.21 -14.36 62.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.34 177.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.683 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.8 m-85 -87.72 -44.54 11.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.683 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.2 m-20 128.1 9.17 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 O-C-N 125.166 1.541 . . . . 0.0 111.278 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.777 ' HB ' HD13 ' B' ' 117' ' ' LEU . 98.3 t -101.91 -36.29 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.171 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.701 ' O ' HD12 ' B' ' 117' ' ' LEU . 1.3 m-20 54.31 -119.86 1.54 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.021 HG23 ' HE2' ' A' ' 32' ' ' MET . 0.3 OUTLIER -137.52 0.56 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 179.399 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.43 ' C ' ' O ' ' B' ' 124' ' ' ILE . 10.8 p -43.0 -64.63 0.59 Allowed 'General case' 0 C--O 1.243 0.734 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.414 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -83.31 -29.19 34.14 Favored Glycine 0 C--N 1.334 0.444 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.893 178.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.73 HD12 ' HG ' ' B' ' 117' ' ' LEU . 4.8 tt -59.57 -61.99 2.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 117.418 0.609 . . . . 0.0 110.944 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.944 HG22 HG21 ' A' ' 24' ' ' ILE . 3.2 t -50.97 -66.44 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 C-N-CA 120.526 -0.47 . . . . 0.0 109.902 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.628 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 22.0 p -48.34 -47.32 37.12 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.429 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.9 OUTLIER -71.3 -46.39 60.87 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 118.799 0.727 . . . . 0.0 110.457 -179.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.591 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.8 OUTLIER -66.37 -34.91 79.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.654 -179.82 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.953 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -60.77 -57.05 14.33 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.287 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.494 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -52.75 -42.0 64.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.651 0.262 . . . . 0.0 111.656 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . 0.513 ' O ' ' HD3' ' B' ' 138' ' ' ARG . 1.7 m-20 -62.29 -55.31 29.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.679 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.63 ' HB3' HD21 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -74.64 -8.96 58.01 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.634 178.473 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.603 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -82.32 -42.55 18.62 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -74.56 -51.99 13.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.398 177.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . 0.528 ' N ' ' HD2' ' B' ' 138' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.443 -0.804 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.568 -178.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.676 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.32 0 CA-C-O 120.872 0.368 . . . . 0.0 110.473 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.478 ' O ' HG22 ' B' ' 109' ' ' VAL . 33.1 tp60 -120.35 111.52 17.86 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.283 0.564 . . . . 0.0 111.294 -179.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.976 ' HG2' HG22 ' B' ' 106' ' ' THR . 0.0 OUTLIER -79.4 112.61 16.81 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.049 -179.557 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.787 HG12 HG13 ' B' ' 107' ' ' VAL . 0.6 OUTLIER -114.0 129.3 70.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.486 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.81 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.0 OUTLIER -133.01 135.59 45.54 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 117.886 -1.526 . . . . 0.0 113.768 -179.029 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.777 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.75 95.61 4.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.351 177.052 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 14.5 p -70.62 69.24 0.41 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.801 HG11 ' HB2' ' A' ' 14' ' ' TYR . 10.3 p -92.28 -133.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.835 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.782 ' H ' HG22 ' A' ' 9' ' ' VAL . 25.6 t70 97.81 13.34 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.309 1.052 . . . . 0.0 109.348 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.405 ' H ' HG22 ' A' ' 9' ' ' VAL . 28.0 t -145.25 -51.75 0.26 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 113.875 -1.511 . . . . 0.0 111.473 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.798 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.2 m-20 -72.82 41.41 0.1 Allowed 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 115.003 1.482 . . . . 0.0 115.003 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.497 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.2 OUTLIER 80.89 4.95 1.54 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 176.464 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.877 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 3.5 t80 -58.16 -59.58 5.07 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.545 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 11.7 mt-30 -49.73 -40.05 39.37 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.874 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -48.65 -33.33 9.76 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.426 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.082 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.7 OUTLIER -78.25 -57.24 3.88 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.187 -0.605 . . . . 0.0 111.921 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.546 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -63.29 -25.18 68.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.718 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.415 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.94 -30.63 61.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.987 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.614 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 11.3 m-30 -88.34 -38.64 14.98 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.614 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 37.6 t70 133.19 43.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 O-C-N 124.336 1.022 . . . . 0.0 109.578 178.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.795 ' CG1' HD22 ' A' ' 17' ' ' LEU . 6.1 p -160.89 78.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.932 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.703 -177.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.636 ' O ' ' HE3' ' B' ' 132' ' ' MET . 0.0 OUTLIER -64.1 -86.9 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.487 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.153 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -166.9 9.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 115.791 1.775 . . . . 0.0 115.791 178.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.442 ' C ' ' O ' ' A' ' 24' ' ' ILE . 29.0 t -38.36 -65.2 0.36 Allowed 'General case' 0 C--O 1.242 0.704 0 C-N-CA 120.211 -0.596 . . . . 0.0 110.551 -177.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.562 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -90.25 -24.91 27.8 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.584 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.824 HD11 ' HG2' ' B' ' 135' ' ' GLU . 0.7 OUTLIER -60.6 -56.94 15.26 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.105 -0.056 . . . . 0.0 111.008 179.317 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.153 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.0 t -57.21 -61.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.737 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 57.5 p -50.63 -41.92 55.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.562 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -75.21 -50.19 16.99 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.685 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.462 ' N ' ' CG2' ' A' ' 30' ' ' THR . 17.2 m -53.15 -43.76 67.25 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.947 ' HE3' HG12 ' B' ' 124' ' ' ILE . 11.7 mtt -52.59 -52.7 54.0 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.499 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -55.53 -37.38 67.86 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.828 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.435 HD22 ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -72.52 -48.46 40.23 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.761 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -68.41 -27.35 66.13 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.259 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.565 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -83.1 -46.27 12.98 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.746 0.818 . . . . 0.0 110.73 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -51.98 -51.64 55.84 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 121.819 0.819 . . . . 0.0 109.482 178.423 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.187 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.14 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 111.051 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.673 ' HB2' ' HB2' ' A' ' 10' ' ' ASP . 3.8 tm0? -95.62 123.2 39.06 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.541 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.441 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 14.3 ttm-85 -77.14 101.81 6.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.713 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 1.031 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -93.34 107.64 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.392 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 177.354 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.976 HG22 ' HG2' ' A' ' 4' ' ' ARG . 1.2 m -118.18 110.91 18.16 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.317 0.579 . . . . 0.0 112.328 -175.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.787 HG13 HG12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -102.13 106.3 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.987 177.138 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.848 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 4.7 p -70.92 88.36 0.75 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.844 0.354 . . . . 0.0 110.1 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 1.121 HG21 ' CD2' ' B' ' 114' ' ' TYR . 10.9 m -80.34 -142.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.488 -178.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.681 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 0.4 OUTLIER 86.28 -15.75 0.46 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -176.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.4 m -112.23 -68.93 0.9 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.944 -1.026 . . . . 0.0 108.691 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.737 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 2.2 m-20 -43.71 -93.24 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -178.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 29' ' ' SER . 1.8 t -177.98 47.71 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 121.567 0.699 . . . . 0.0 111.257 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 1.121 ' CD2' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.79 -45.51 14.24 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.082 -179.493 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.543 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.1 OUTLIER -48.59 -42.48 34.02 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.568 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.565 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -51.81 -47.37 64.33 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 119.305 0.957 . . . . 0.0 112.073 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.821 HD11 HD12 ' B' ' 127' ' ' LEU . 0.2 OUTLIER -59.72 -51.8 68.22 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.313 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.595 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -74.13 -28.6 61.41 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.618 179.773 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -60.31 -28.2 67.93 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.33 178.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.579 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 0.1 OUTLIER -88.44 -44.64 10.58 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.235 -0.888 . . . . 0.0 109.602 178.18 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.58 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 176.631 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.635 ' O ' HD12 ' B' ' 117' ' ' LEU . 38.8 t -146.64 94.71 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 1.067 ' O ' HD12 ' B' ' 124' ' ' ILE . 28.9 m-20 -71.43 57.12 0.25 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.86 178.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.067 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER 43.06 0.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 -179.483 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.777 ' HA ' HG22 ' A' ' 7' ' ' VAL . 14.9 p -38.66 -64.52 0.43 Allowed 'General case' 0 C--O 1.246 0.902 0 CA-C-N 119.144 0.884 . . . . 0.0 110.516 -178.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.676 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.9 -15.12 68.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.229 177.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.935 ' HB3' HG22 ' B' ' 124' ' ' ILE . 4.8 tt -72.63 -62.04 1.59 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 117.318 0.559 . . . . 0.0 110.348 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.116 HG22 ' CG2' ' A' ' 28' ' ' VAL . 75.1 t -44.78 -63.86 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.379 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.798 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 53.6 p -53.09 -51.45 61.82 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.676 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -67.55 -47.06 70.93 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 118.746 0.703 . . . . 0.0 110.103 -178.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.547 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.9 OUTLIER -53.22 -37.61 62.2 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.812 179.597 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.082 ' SD ' HD12 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -49.83 -49.17 50.0 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.774 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -43.66 98.35 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -67.06 -51.51 53.73 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.824 ' HG2' HD11 ' A' ' 27' ' ' LEU . 4.7 tp10 -58.73 -36.18 73.9 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.888 178.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.874 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -71.25 -42.42 68.86 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 121.026 0.441 . . . . 0.0 110.077 178.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -61.42 -52.6 63.89 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.617 0.723 . . . . 0.0 110.139 178.244 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.439 -1.017 0 CA-C-N 114.228 -1.351 . . . . 0.0 113.865 -176.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.457 ' O ' ' N ' ' B' ' 109' ' ' VAL . 10.1 tp60 -105.63 111.57 24.32 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.465 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.829 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 1.3 ttm105 -79.3 105.93 10.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.954 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -112.59 122.32 66.56 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.767 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -125.41 129.67 50.34 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.921 -177.098 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -100.36 107.07 20.32 Favored 'Isoleucine or valine' 0 C--N 1.343 0.295 0 N-CA-C 106.973 -1.492 . . . . 0.0 106.973 176.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 16.6 p -70.57 95.64 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.189 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.01 HG21 ' CB ' ' A' ' 14' ' ' TYR . 1.5 t -89.51 -143.55 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.21 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 33.7 t70 95.94 -10.14 0.09 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.5 t -126.0 -58.78 1.37 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 114.77 -1.105 . . . . 0.0 109.378 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.67 ' HB2' HG13 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -47.6 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.51 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 m -177.54 38.48 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.248 -0.908 . . . . 0.0 110.933 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.01 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -80.56 -39.17 28.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.346 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.575 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.78 -43.25 48.21 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.364 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.713 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -48.33 -32.24 7.17 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.891 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -78.16 -60.09 2.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.092 179.028 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -61.79 -25.79 67.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.982 178.707 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.81 -30.85 71.79 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.75 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.662 ' CZ ' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -88.6 -35.47 16.84 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.772 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.659 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 27.7 t70 142.99 31.2 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 123.724 0.64 . . . . 0.0 112.211 176.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.598 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.0 t -160.95 100.85 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.412 ' OD1' ' HB3' ' A' ' 18' ' ' LYS . 70.1 m-20 -55.78 -89.75 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 178.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.014 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -157.01 6.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.888 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.7 t -38.92 -64.44 0.45 Allowed 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.201 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.35 -23.36 51.5 Favored Glycine 0 C--N 1.335 0.496 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.02 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 1.014 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -65.65 -57.9 7.01 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 122.621 0.369 . . . . 0.0 111.2 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.955 HG23 ' HB ' ' A' ' 24' ' ' ILE . 3.8 t -51.55 -63.29 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.547 0.689 . . . . 0.0 109.21 178.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.754 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -50.16 -46.91 54.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.836 -1.075 . . . . 0.0 113.382 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.6 m -69.61 -50.27 46.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 121.311 0.577 . . . . 0.0 109.502 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.609 ' OG1' HG21 ' B' ' 131' ' ' THR . 1.8 m -55.16 -39.27 69.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.408 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.95 ' HE1' HG12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -60.58 -57.28 13.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.429 179.006 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -40.43 66.0 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.25 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.69 -48.91 52.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.34 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.85 ' CB ' HD21 ' B' ' 117' ' ' LEU . 3.5 mm-40 -68.67 -24.92 64.57 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.27 178.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.594 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.26 -47.23 58.33 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -65.56 -54.79 22.97 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.49 0.662 . . . . 0.0 109.929 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.526 0 CA-C-N 114.438 -1.256 . . . . 0.0 110.928 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.409 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.838 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.602 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 1.3 tt0 -96.43 111.92 23.85 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.099 0.475 . . . . 0.0 111.747 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.46 ' HB2' HH11 ' B' ' 104' ' ' ARG . 0.1 OUTLIER -77.93 102.39 7.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.76 . . . . 0.0 112.198 -178.625 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.75 HD11 HG11 ' B' ' 128' ' ' VAL . 0.4 OUTLIER -104.92 117.44 50.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 177.114 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.767 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -120.81 123.25 42.14 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -175.364 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.985 HG12 HG22 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -100.26 103.32 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.111 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.829 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.6 p -71.65 91.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.994 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -93.33 -139.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 118.028 -0.987 . . . . 0.0 111.332 -178.143 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.629 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 28.4 t70 119.86 5.1 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.003 0.921 . . . . 0.0 109.49 -177.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -175.15 -26.87 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.754 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.2 OUTLIER -70.77 41.57 0.06 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -176.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.622 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.8 m 62.57 -0.32 0.55 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.994 ' CG ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -57.55 -52.04 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 179.856 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.559 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.98 -36.83 18.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.505 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.594 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.05 -56.49 21.32 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -179.661 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.85 HD21 ' CB ' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -48.26 -51.64 24.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.334 0.588 . . . . 0.0 111.603 -178.583 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.555 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.9 pttt -76.73 -26.68 54.88 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.891 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -63.55 -25.63 68.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.856 178.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.796 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -87.96 -42.38 12.51 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 118.524 -0.751 . . . . 0.0 109.8 178.698 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.541 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 158.41 37.04 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 177.264 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.706 ' O ' HG13 ' B' ' 122' ' ' VAL . 0.8 OUTLIER -163.21 92.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.109 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 1.015 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -70.71 61.89 0.25 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.176 0.512 . . . . 0.0 110.531 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.141 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.6 OUTLIER 39.37 -8.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 119.162 3.023 . . . . 0.0 119.162 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.522 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.61 -62.59 0.59 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.675 1.125 . . . . 0.0 110.944 -178.233 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.37 -30.15 25.62 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.44 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.57 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -60.87 -61.44 2.58 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 122.631 0.372 . . . . 0.0 111.447 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.141 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.2 t -55.18 -58.02 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-O 120.636 0.255 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.64 ' CB ' ' CB ' ' A' ' 12' ' ' ASP . 12.0 p -50.29 -41.56 50.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.187 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.8 m -74.38 -52.87 10.87 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.609 HG21 ' OG1' ' A' ' 31' ' ' THR . 0.6 OUTLIER -51.93 -44.18 63.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.174 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.0 ' HE2' HG23 ' A' ' 24' ' ' ILE . 25.9 mtt -49.29 -40.77 35.99 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.872 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -43.92 94.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.757 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -49.76 67.56 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.719 ' CG ' HD21 ' A' ' 17' ' ' LEU . 2.6 tp10 -60.71 -37.49 81.86 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.713 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -67.41 -49.94 61.62 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.904 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.65 -48.22 63.46 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 121.965 0.888 . . . . 0.0 109.187 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? . . . . . 0 CA--C 1.541 0.618 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.753 -179.291 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.342 0 CA-C-O 120.996 0.426 . . . . 0.0 111.207 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.641 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 2.0 tt0 -101.39 109.02 20.79 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 1.063 ' HG3' HG23 ' B' ' 108' ' ' THR . 4.2 ttm105 -78.5 103.84 8.71 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.748 HD11 HG11 ' A' ' 28' ' ' VAL . 1.7 pt -97.41 126.98 50.13 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.775 HG21 ' NH1' ' B' ' 104' ' ' ARG . 0.6 OUTLIER -131.73 123.95 28.76 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.08 -1.048 . . . . 0.0 113.561 -177.139 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.827 HG13 HG12 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -101.28 106.22 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 175.772 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 37.5 p -70.86 98.18 1.53 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.014 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.4 t -87.9 -137.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.78 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 24.6 t70 99.27 -9.82 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.901 0.881 . . . . 0.0 108.836 -176.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.2 m -136.98 -55.71 0.72 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.515 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.733 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.68 -92.33 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.462 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' B' ' 129' ' ' SER . 2.7 m 176.44 36.76 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 118.866 0.757 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.014 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.77 -43.99 14.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.174 -0.921 . . . . 0.0 113.162 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.573 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -49.1 -44.06 41.9 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.5 OUTLIER -54.04 -56.26 19.64 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.501 0.591 . . . . 0.0 112.265 179.821 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.692 HD13 ' CE2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -46.17 -51.22 14.55 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.567 0.699 . . . . 0.0 111.302 -178.207 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.573 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 17.6 pttt -79.05 -29.27 43.42 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.483 ' HB3' ' HA ' ' A' ' 16' ' ' LEU . . . -61.45 -23.52 65.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.491 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.692 ' CE2' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -87.97 -44.4 11.04 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 118.255 -0.879 . . . . 0.0 109.746 178.302 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.658 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 163.13 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 177.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.557 ' CG1' ' O ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -169.59 106.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -178.816 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.955 ' O ' HD12 ' A' ' 24' ' ' ILE . 9.2 m-20 -66.68 55.85 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.672 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.97 HG21 ' HE3' ' B' ' 132' ' ' MET . 1.6 pp 36.24 1.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.464 ' N ' ' O ' ' A' ' 23' ' ' ASN . 7.0 p -37.74 -63.59 0.45 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.913 0.779 . . . . 0.0 112.372 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.446 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -75.34 -20.3 78.93 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.259 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.762 HD12 ' CG2' ' A' ' 24' ' ' ILE . 2.2 tm? -72.93 -58.55 3.24 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 122.597 0.359 . . . . 0.0 110.934 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.969 HG12 ' SD ' ' A' ' 32' ' ' MET . 59.7 t -45.43 -69.99 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.728 0.299 . . . . 0.0 110.973 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.554 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 45.6 p -49.43 -34.11 15.73 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.026 0.53 . . . . 0.0 112.099 178.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.5 m -69.74 -53.93 16.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 m -52.0 -43.39 63.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.182 178.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.969 ' SD ' HG12 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -55.75 -48.59 74.99 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.906 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.525 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -60.06 -42.78 95.28 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.355 0.525 . . . . 0.0 110.608 179.638 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 83.0 m-20 -67.33 -49.58 63.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.749 ' HB3' HD21 ' B' ' 117' ' ' LEU . 17.3 tp10 -65.04 -29.15 70.03 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.341 177.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.708 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -68.16 -45.48 73.41 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -54.27 36.27 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.248 177.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.54 0.581 0 CA-C-N 114.503 -1.226 . . . . 0.0 113.284 -177.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.78 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 120.69 0.281 . . . . 0.0 111.09 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.672 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 1.1 tt0 -109.84 116.73 32.19 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.072 0.463 . . . . 0.0 111.671 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.775 ' NH1' HG21 ' A' ' 6' ' ' THR . 2.6 ttp85 -78.08 106.5 10.0 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.827 HG12 HG13 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -103.88 130.08 55.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.81 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.736 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -131.06 126.12 35.0 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.795 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.882 HG22 HG22 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -101.86 102.94 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.319 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 1.063 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -70.76 67.24 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 122.131 -0.356 . . . . 0.0 111.398 -179.472 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.882 HG22 HG22 ' B' ' 107' ' ' VAL . 3.7 m -99.31 -124.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.661 ' HB2' ' O ' ' B' ' 109' ' ' VAL . 10.4 t0 157.02 -83.13 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.543 ' HA ' ' CD ' ' B' ' 115' ' ' GLN . 3.8 t -102.63 12.56 36.18 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.638 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 29' ' ' SER . 1.8 t0 -75.56 59.28 1.11 Allowed 'General case' 0 C--N 1.36 1.059 0 CA-C-N 120.191 1.359 . . . . 0.0 108.304 178.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 29' ' ' SER . 13.3 m 64.11 -20.55 0.07 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.177 -177.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.787 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -46.61 -60.33 2.45 Favored 'General case' 0 C--N 1.351 0.674 0 CA-C-O 121.383 0.611 . . . . 0.0 110.326 179.305 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.654 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.8 pt20 -49.53 -40.39 37.77 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.766 -1.107 . . . . 0.0 112.643 -177.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.708 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -55.55 -42.09 74.16 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.751 HD11 ' HG ' ' B' ' 127' ' ' LEU . 0.5 OUTLIER -59.03 -52.4 65.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.633 179.753 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.704 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.5 pttt -73.38 -30.45 63.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.209 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.478 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.48 -29.21 67.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.198 178.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.703 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -87.7 -41.64 13.21 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.475 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.519 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 155.1 24.01 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 176.786 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 121' ' ' ASP . 71.0 t -162.38 101.58 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.629 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 33.4 m-80 -53.14 -84.62 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.11 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -161.89 3.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 178.308 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.416 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -38.54 -63.5 0.5 Allowed 'General case' 0 C--O 1.241 0.658 0 CA-C-N 118.249 0.477 . . . . 0.0 110.691 -177.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -88.14 -29.91 18.61 Favored Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.234 178.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.751 ' HG ' HD11 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -58.6 -60.4 3.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.854 0.462 . . . . 0.0 111.127 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.11 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.3 t -55.16 -61.54 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.963 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.733 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.6 p -50.71 -42.17 56.8 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 178.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 16.5 m -67.82 -55.17 14.0 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.698 HG22 ' O ' ' B' ' 128' ' ' VAL . 1.8 t -53.55 -42.63 67.68 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.242 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.97 ' HE3' HG21 ' A' ' 24' ' ' ILE . 4.3 mtt -58.18 -54.93 41.38 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.587 178.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.17 -37.46 22.48 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.944 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -52.62 13.15 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.407 ' CB ' HD21 ' A' ' 17' ' ' LEU . 3.0 mp0 -69.45 -15.3 63.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.928 0.394 . . . . 0.0 110.343 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.625 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.96 -50.18 9.43 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.263 0.625 . . . . 0.0 109.512 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -54.33 29.59 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.718 0.77 . . . . 0.0 109.595 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 . . . . . 0 N--CA 1.441 -0.905 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.916 -178.99 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.685 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 46.1 tt0 -116.22 118.76 33.68 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.301 0.572 . . . . 0.0 110.601 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.945 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.18 105.9 10.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.206 -178.503 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.821 HD12 HD11 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -104.06 109.86 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.093 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.126 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -115.14 121.91 44.46 Favored 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.146 -176.587 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.872 HG13 HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.23 106.45 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 176.723 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.558 ' HB ' ' HB3' ' B' ' 102' ' ' LYS . 18.1 p -70.06 81.01 0.49 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.022 0.439 . . . . 0.0 110.601 -178.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 1.162 HG21 ' CD1' ' A' ' 14' ' ' TYR . 14.8 m -73.69 -141.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.627 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.644 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 27.4 t70 88.88 -12.45 0.41 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -124.53 -58.93 1.49 Allowed 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.664 ' HB2' ' OG ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.96 -98.59 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.546 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.5 OUTLIER -176.12 41.32 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.212 -0.93 . . . . 0.0 111.82 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 1.162 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -81.97 -41.49 20.71 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.94 0.896 . . . . 0.0 113.169 -179.474 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.536 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 1.8 mp0 -49.47 -46.59 48.25 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.522 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -50.02 -30.77 11.36 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.419 0.554 . . . . 0.0 111.917 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.045 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -78.14 -55.14 5.51 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.54 178.614 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.673 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -69.06 -25.54 64.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.335 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.54 -33.17 59.59 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.064 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.629 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 20.0 m-85 -88.87 -45.99 9.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.905 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.629 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 143.1 46.37 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 O-C-N 124.413 1.071 . . . . 0.0 110.824 178.85 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.596 ' HB ' HD22 ' A' ' 17' ' ' LEU . 7.5 t -128.24 73.45 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.333 -178.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.963 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -76.14 45.35 0.36 Allowed 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.983 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 39.91 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 118.316 2.71 . . . . 0.0 118.316 177.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 1.039 ' HA ' HG22 ' B' ' 107' ' ' VAL . 3.1 p -39.35 -64.9 0.43 Allowed 'General case' 0 C--O 1.253 1.256 0 CA-C-N 119.272 0.942 . . . . 0.0 110.667 -177.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.416 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -80.53 -26.63 53.88 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.929 -0.653 . . . . 0.0 111.984 177.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.898 HD22 HD11 ' A' ' 17' ' ' LEU . 6.6 tp -66.2 -61.34 2.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.01 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.983 HG23 ' HB ' ' A' ' 24' ' ' ILE . 6.5 t -44.23 -66.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.486 ' HB3' ' O ' ' B' ' 112' ' ' ASP . 0.7 OUTLIER -50.03 -37.44 33.06 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 178.424 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.5 m -71.92 -58.5 3.4 Favored 'General case' 0 CA--C 1.507 -0.691 0 O-C-N 121.81 -0.556 . . . . 0.0 109.916 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.572 ' CG2' HD11 ' B' ' 127' ' ' LEU . 1.0 OUTLIER -54.47 -31.61 56.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.586 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.991 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.7 mmt -56.32 -57.26 13.02 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.083 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.581 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 2.6 tt0 -50.12 -34.16 21.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -72.33 -48.99 37.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.79 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.541 ' HB3' HD21 ' B' ' 117' ' ' LEU . 3.5 mm-40 -79.63 -15.25 57.97 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.754 0.312 . . . . 0.0 110.311 177.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.605 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -88.06 -29.96 20.27 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.159 0.584 . . . . 0.0 110.418 178.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -75.73 -55.41 5.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.582 0.706 . . . . 0.0 110.299 179.625 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 . . . . . 0 N--CA 1.442 -0.839 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.04 -178.527 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.558 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.566 ' HB3' HG23 ' A' ' 9' ' ' VAL . 28.8 tp60 -98.72 116.52 31.14 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.242 0.544 . . . . 0.0 111.048 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.447 ' HB2' HH11 ' B' ' 104' ' ' ARG . 0.0 OUTLIER -78.55 99.9 6.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.483 -178.399 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.872 HG12 HG13 ' A' ' 7' ' ' VAL . 0.4 OUTLIER -103.05 118.51 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.067 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.682 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -122.33 129.4 52.11 Favored 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.871 -176.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 1.039 HG22 ' HA ' ' A' ' 25' ' ' SER . 0.9 OUTLIER -99.04 96.06 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.868 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.945 HG22 ' HG3' ' A' ' 4' ' ' ARG . 46.6 p -70.01 67.65 0.29 Allowed 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.957 HG11 ' CB ' ' B' ' 114' ' ' TYR . 6.7 p -80.56 -117.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.264 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.685 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 35.6 t70 85.47 1.29 0.7 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -174.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.54 ' H ' HG22 ' B' ' 109' ' ' VAL . 0.4 OUTLIER -101.45 -67.02 0.88 Allowed 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.269 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -133.78 142.3 47.85 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -176.512 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.64 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 46.48 -23.79 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 118.824 2.898 . . . . 0.0 118.824 174.89 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.957 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.6 OUTLIER -52.13 -61.99 1.92 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 120.079 1.309 . . . . 0.0 111.6 -178.314 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.635 ' HA ' ' HE3' ' B' ' 118' ' ' LYS . 77.6 mt-30 -49.56 -37.62 28.02 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.113 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.49 -57.16 14.17 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.991 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -49.5 -45.67 47.37 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.187 0.518 . . . . 0.0 111.674 -178.176 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.685 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.4 pttp -80.26 -36.83 34.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.249 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.558 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -68.29 -23.88 64.8 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.914 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.745 ' CE2' HD23 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -87.76 -42.71 12.41 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.04 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.45 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 163.34 17.91 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.535 ' C ' ' H ' ' B' ' 124' ' ' ILE . 72.4 t -146.98 85.28 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.349 0 O-C-N 121.581 -0.699 . . . . 0.0 112.709 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.883 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.4 OUTLIER -69.11 50.21 0.08 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.557 0.694 . . . . 0.0 109.977 178.515 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.034 HG22 HD12 ' B' ' 127' ' ' LEU . 1.6 pp 33.28 0.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 120.103 3.372 . . . . 0.0 120.103 179.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.531 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.4 OUTLIER -38.27 -62.47 0.58 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 118.525 0.602 . . . . 0.0 110.791 -178.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.403 ' N ' ' OG ' ' B' ' 125' ' ' SER . . . -80.66 -27.08 52.34 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.695 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 1.034 HD12 HG22 ' B' ' 124' ' ' ILE . 1.9 tm? -67.04 -61.49 1.91 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.929 0.365 . . . . 0.0 110.978 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.022 HG23 ' HB ' ' B' ' 124' ' ' ILE . 12.3 t -48.63 -68.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.249 0 C-N-CA 121.139 -0.224 . . . . 0.0 111.386 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.664 ' OG ' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -49.86 -31.27 11.65 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.0 m -71.65 -54.67 9.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.46 ' HA ' HD22 ' B' ' 134' ' ' ASN . 7.2 m -53.9 -36.47 62.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.183 178.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 1.045 ' SD ' HD12 ' A' ' 17' ' ' LEU . 5.3 mmm -53.15 -57.05 11.77 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.12 178.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.546 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -58.53 -36.01 73.2 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.109 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . 0.499 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.67 -48.42 22.12 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.087 -179.249 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.48 -19.25 60.45 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.692 177.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.522 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -72.37 -47.72 47.29 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 177.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.524 ' HA ' ' NE ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -65.84 -56.4 12.07 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-O 121.444 0.64 . . . . 0.0 109.912 178.22 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 . . . . . 0 N--CA 1.444 -0.766 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.32 -179.095 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.618 ' HE3' ' HA ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.584 0.706 . . . . 0.0 111.517 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.657 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 43.4 tp60 -117.69 109.15 16.28 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.373 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 1.062 ' HG3' HG23 ' B' ' 108' ' ' THR . 17.8 ttp-105 -79.31 111.58 15.69 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.819 179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.787 HD11 HG11 ' A' ' 28' ' ' VAL . 3.3 pt -102.34 127.8 55.61 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.771 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -131.71 124.73 30.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -177.791 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.622 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -99.43 105.56 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.206 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 14.5 p -70.19 89.72 0.65 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 178.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.852 HG11 ' CB ' ' A' ' 14' ' ' TYR . 3.8 p -108.36 -119.89 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.814 -177.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.681 ' N ' HG22 ' A' ' 9' ' ' VAL . 0.8 OUTLIER 77.41 10.25 2.41 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-O 122.491 1.138 . . . . 0.0 109.089 -174.747 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.443 ' OG ' ' NZ ' ' B' ' 102' ' ' LYS . 0.5 OUTLIER -128.46 -66.83 0.82 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.507 178.59 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.824 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 1.1 m-20 -51.74 -79.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -177.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.728 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 1.0 OUTLIER 177.28 40.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.39 0.995 . . . . 0.0 111.683 -178.513 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.852 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.67 -49.84 9.38 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.333 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.56 ' CD ' ' HA ' ' A' ' 10' ' ' ASP . 1.1 mp0 -49.33 -37.69 25.31 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.984 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.7 OUTLIER -56.61 -56.73 17.63 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.598 0.636 . . . . 0.0 111.687 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.786 ' HB2' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.48 -48.11 56.91 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.108 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.559 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 1.9 pttt -80.28 -35.59 35.65 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.475 -178.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.518 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -70.39 -22.64 62.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.256 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.532 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -87.83 -41.54 13.18 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.855 179.269 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.518 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 168.52 -7.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 177.382 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.685 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 72.2 t -122.08 85.95 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -177.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 1.028 ' O ' HD12 ' A' ' 24' ' ' ILE . 11.2 p30 -65.08 48.41 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.701 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.028 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 48.08 -15.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 117.203 2.298 . . . . 0.0 117.203 -179.546 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 23' ' ' ASN . 30.4 t -38.28 -62.84 0.54 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 119.137 0.88 . . . . 0.0 109.509 -178.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.483 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.28 -27.21 40.78 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.245 177.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.59 ' CD1' ' HG3' ' B' ' 132' ' ' MET . 0.1 OUTLIER -60.02 -62.24 2.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.972 0.386 . . . . 0.0 110.703 179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.918 HG23 ' CG2' ' A' ' 24' ' ' ILE . 12.4 t -51.43 -66.38 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.775 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.535 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 15.5 p -47.2 -40.84 16.97 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.483 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -78.1 -47.82 17.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.558 1.072 . . . . 0.0 109.304 178.321 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.788 HG21 HG21 ' B' ' 131' ' ' THR . 9.0 m -53.24 -47.37 69.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.796 ' HA ' HD23 ' B' ' 117' ' ' LEU . 6.2 mmt -55.05 -46.83 75.4 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.656 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.528 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -57.3 -49.1 77.17 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.936 0.398 . . . . 0.0 110.336 178.445 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.477 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.64 -50.49 69.11 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.906 ' HB3' HD21 ' B' ' 117' ' ' LEU . 2.9 mm-40 -72.13 -8.59 55.53 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.808 178.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.612 ' HA ' ' HE2' ' B' ' 120' ' ' TYR . . . -88.39 -44.1 11.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 122.667 0.387 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -57.36 4.39 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.546 0.689 . . . . 0.0 110.004 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 . . . . . 0 N--CA 1.442 -0.873 0 CA-C-N 114.55 -1.204 . . . . 0.0 113.352 -178.204 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.443 ' NZ ' ' OG ' ' A' ' 11' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.668 0.271 . . . . 0.0 110.651 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.671 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 1.6 tp60 -114.2 121.77 44.75 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.146 0.498 . . . . 0.0 110.22 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.542 ' HA ' ' HA ' ' A' ' 8' ' ' THR . 0.3 OUTLIER -78.83 112.39 15.93 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.071 -179.454 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 0.755 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -113.7 114.04 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.771 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -117.57 129.01 55.51 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.999 HG23 HG13 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -102.37 102.59 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 174.667 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 1.062 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -71.22 67.29 0.45 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.371 -0.531 . . . . 0.0 111.223 -179.18 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.999 HG13 HG23 ' B' ' 107' ' ' VAL . 4.7 m -96.14 -127.64 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.736 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.657 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 1.4 t70 154.12 -89.18 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . 0.647 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 39.0 t -94.19 9.47 37.8 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 118.685 -0.674 . . . . 0.0 111.521 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.535 ' O ' ' HA ' ' A' ' 29' ' ' SER . 2.3 m-20 -74.64 56.2 0.69 Allowed 'General case' 0 C--N 1.365 1.277 0 CA-C-N 119.943 1.247 . . . . 0.0 109.271 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.55 ' HA ' HD12 ' B' ' 116' ' ' LEU . 0.9 OUTLIER 62.07 -14.78 0.05 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.983 -178.774 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.825 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.2 OUTLIER -53.87 -54.67 35.32 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.117 0.484 . . . . 0.0 110.135 178.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.657 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.38 -41.11 27.9 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.168 -178.17 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 3.9 mt -52.46 -53.89 39.56 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.044 -0.41 . . . . 0.0 111.433 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.906 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -53.12 -41.1 64.71 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.764 0.792 . . . . 0.0 111.727 179.785 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.825 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.6 pttt -79.81 -25.74 40.75 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.51 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -59.24 -23.36 62.27 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.643 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 2.1 m-85 -88.35 -37.88 15.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.987 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.643 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.2 t70 117.98 75.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.629 1.205 . . . . 0.0 111.948 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.848 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -166.8 -40.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.859 -179.306 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 65.59 -108.04 0.15 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 0.965 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -153.06 2.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 178.576 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.445 ' C ' ' O ' ' B' ' 124' ' ' ILE . 81.8 p -39.04 -63.26 0.55 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . 0.472 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.27 -31.52 19.37 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.303 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.723 ' HB3' HG22 ' B' ' 124' ' ' ILE . 8.4 tp -56.97 -62.2 1.91 Allowed 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 117.3 0.55 . . . . 0.0 111.52 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 0.965 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.5 t -53.48 -59.55 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.797 0.808 . . . . 0.0 109.079 178.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.824 ' HB3' ' CB ' ' A' ' 12' ' ' ASP . 3.5 m -48.29 -50.09 31.28 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.194 -1.366 . . . . 0.0 112.965 179.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . 0.472 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -83.57 -50.3 8.37 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 122.163 -0.336 . . . . 0.0 111.587 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.788 HG21 HG21 ' A' ' 31' ' ' THR . 0.5 OUTLIER -55.62 -41.94 74.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -179.153 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.953 ' SD ' HG13 ' B' ' 128' ' ' VAL . 0.0 OUTLIER -60.73 -46.72 89.32 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.333 178.912 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.728 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.6 OUTLIER -49.26 -35.87 18.9 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.179 0.445 . . . . 0.0 110.526 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -70.71 -49.22 49.29 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.513 179.279 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.591 ' CB ' HD21 ' A' ' 17' ' ' LEU . 30.3 mm-40 -77.92 -13.67 59.8 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.964 0.411 . . . . 0.0 110.612 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.984 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -83.55 -34.64 25.18 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.371 0.669 . . . . 0.0 110.074 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.81 -50.89 8.18 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.985 0.898 . . . . 0.0 109.933 178.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.685 0 CA-C-N 113.849 -1.523 . . . . 0.0 114.143 -177.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 121.07 0.462 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.583 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 2.0 tt0 -108.8 112.38 24.62 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.531 0.681 . . . . 0.0 111.535 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.911 ' HG2' HG22 ' B' ' 106' ' ' THR . 8.3 ttm-85 -79.57 99.98 7.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.171 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.914 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -101.87 130.3 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.969 0 N-CA-C 106.787 -1.561 . . . . 0.0 106.787 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.974 ' HB ' HG23 ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.09 134.23 50.28 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.344 -0.942 . . . . 0.0 112.765 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 1.009 ' O ' HG23 ' B' ' 105' ' ' ILE . 0.9 OUTLIER -99.53 81.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.493 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.536 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 69.7 p -68.89 71.3 0.22 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.162 -0.961 . . . . 0.0 110.85 -178.191 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.852 HG21 ' HB3' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -77.89 -102.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.729 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.722 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 27.3 t0 113.88 14.09 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.363 0.665 . . . . 0.0 110.719 -178.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 177.73 -23.09 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.68 ' HB2' HG11 ' A' ' 9' ' ' VAL . 2.4 m-20 -72.27 56.01 0.34 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 -176.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.542 ' O ' ' HB3' ' B' ' 132' ' ' MET . 61.6 m 57.91 0.91 0.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.852 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.02 -49.31 62.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.507 ' HG3' ' CD2' ' A' ' 14' ' ' TYR . 4.5 mt-30 -49.41 -36.94 23.66 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -176.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -63.16 -56.37 17.35 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.736 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -46.47 -47.17 19.27 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 112.169 -178.159 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.518 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 1.4 pttt -79.57 -29.67 41.36 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.818 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.443 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -74.82 -25.35 58.96 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.019 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.512 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -87.9 -38.13 15.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.234 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.507 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 158.28 12.97 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 177.255 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.484 ' O ' HG12 ' A' ' 22' ' ' VAL . 75.8 t -134.34 79.91 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.584 -0.697 . . . . 0.0 111.716 -178.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.983 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.7 OUTLIER -66.66 52.92 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.945 0.403 . . . . 0.0 111.349 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.983 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER 41.6 -8.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 118.375 2.731 . . . . 0.0 118.375 178.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.996 ' HA ' HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.73 -62.48 0.61 Allowed 'General case' 0 C--O 1.245 0.837 0 CA-C-N 120.13 1.332 . . . . 0.0 109.852 -178.464 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.85 -24.89 57.31 Favored Glycine 0 CA--C 1.522 0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.621 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.7 ' HB3' HG22 ' A' ' 24' ' ' ILE . 7.8 tp -67.49 -61.5 1.87 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 117.207 0.503 . . . . 0.0 111.471 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.986 HG22 ' CG2' ' B' ' 128' ' ' VAL . 33.5 t -45.0 -63.0 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.61 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.778 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 7.4 p -48.78 -47.32 41.97 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.988 1.315 . . . . 0.0 113.091 177.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.6 m -61.5 -51.26 69.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.45 ' OG1' HG21 ' B' ' 131' ' ' THR . 7.1 m -59.11 -41.84 89.12 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.27 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.881 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -52.64 -52.23 56.54 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.174 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.471 ' HB2' ' CB ' ' B' ' 113' ' ' SER . 2.3 tt0 -62.79 -51.71 66.01 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.269 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -56.28 -51.35 68.47 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HG2' HD21 ' B' ' 127' ' ' LEU . 3.0 tp10 -65.8 -29.07 69.5 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.204 178.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.67 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -70.48 -44.31 67.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.116 0.484 . . . . 0.0 110.257 178.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -56.28 7.19 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.38 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.789 0 CA-C-N 114.704 -1.134 . . . . 0.0 113.646 -176.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 102' ' ' LYS . . . . . 0.722 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 121.069 0.461 . . . . 0.0 110.351 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 103' ' ' GLN . . . . . 0.478 ' CG ' ' HE2' ' A' ' 14' ' ' TYR . 57.6 tp60 -121.95 117.5 26.57 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.938 0.875 . . . . 0.0 110.553 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 104' ' ' ARG . . . . . 0.661 ' NH1' HG21 ' A' ' 6' ' ' THR . 39.6 ttt85 -79.26 109.43 13.59 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.095 -1.412 . . . . 0.0 112.899 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 105' ' ' ILE . . . . . 1.009 HG23 ' O ' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -96.58 116.87 39.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.892 0 N-CA-C 103.739 -2.689 . . . . 0.0 103.739 174.4 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.974 HG23 ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -118.52 112.18 19.57 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.593 -174.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 107' ' ' VAL . . . . . 0.996 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.0 OUTLIER -102.44 106.17 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.525 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 108' ' ' THR . . . . . 0.79 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 25.6 p -72.07 90.38 1.18 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.822 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.68 -146.75 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 118.882 -0.58 . . . . 0.0 111.832 -178.38 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 110' ' ' ASP . . . . . 0.591 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 8.7 t70 105.13 5.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 24.6 t -150.23 -41.18 0.13 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 113.66 -1.609 . . . . 0.0 110.414 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 112' ' ' ASP . . . . . 0.778 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.3 OUTLIER -74.71 33.78 0.1 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.501 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.471 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.2 OUTLIER 72.21 3.86 4.82 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 177.383 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 114' ' ' TYR . . . . . 0.914 ' CE1' HG21 ' A' ' 5' ' ' ILE . 1.9 t80 -57.75 -55.63 32.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.203 0.456 . . . . 0.0 111.507 179.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 115' ' ' GLN . . . . . 0.562 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 15.2 mt-30 -49.68 -42.7 46.27 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -177.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 116' ' ' LEU . . . . . 0.67 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -49.19 -30.66 7.21 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.692 0.282 . . . . 0.0 111.726 179.774 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 117' ' ' LEU . . . . . 0.697 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.56 -57.55 3.71 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.372 0.606 . . . . 0.0 111.574 178.314 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 118' ' ' LYS . . . . . 0.61 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -65.09 -25.48 67.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.995 -179.909 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 119' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.95 -27.98 47.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.079 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 120' ' ' TYR . . . . . 0.554 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.1 m-30 -88.21 -47.41 8.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.667 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.554 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 5.0 m-20 143.45 41.51 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.193 0.933 . . . . 0.0 110.52 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 122' ' ' VAL . . . . . 0.737 ' O ' HG13 ' B' ' 122' ' ' VAL . 6.1 p -160.25 87.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-O 121.661 0.743 . . . . 0.0 111.592 -177.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 123' ' ' ASN . . . . . 0.702 ' O ' ' HE1' ' A' ' 32' ' ' MET . 1.2 m120 -63.22 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 124' ' ' ILE . . . . . 1.025 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -146.86 4.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 125' ' ' SER . . . . . 0.872 ' HA ' HG22 ' A' ' 7' ' ' VAL . 1.2 t -39.51 -64.63 0.46 Allowed 'General case' 0 C--O 1.244 0.814 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.011 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.94 -21.53 45.98 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . 0.696 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -64.43 -56.72 12.38 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 122.73 0.412 . . . . 0.0 110.911 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 128' ' ' VAL . . . . . 1.025 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.2 t -56.67 -60.99 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 129' ' ' SER . . . . . 0.656 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.2 p -47.15 -38.8 12.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.147 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 93.1 m -70.96 -48.58 52.59 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 131' ' ' THR . . . . . 0.463 HG23 HD21 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -66.62 -31.86 72.81 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.124 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 132' ' ' MET . . . . . 0.736 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 4.7 mmt -65.39 -57.04 9.33 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 133' ' ' GLN . . . . . 0.51 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -48.79 -37.13 18.28 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 -75.05 -41.41 59.14 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.997 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.669 ' CB ' HD21 ' A' ' 17' ' ' LEU . 1.6 mm-40 -84.25 -12.75 54.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.81 0.338 . . . . 0.0 110.832 177.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 136' ' ' ALA . . . . . 0.622 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -87.34 -29.61 21.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.42 0.688 . . . . 0.0 109.313 178.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 137' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 2.1 mmt180 -81.45 -48.25 12.13 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.763 0.792 . . . . 0.0 110.102 178.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 113.958 -1.474 . . . . 0.0 112.969 -177.688 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.1 ttp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 120.303 0.096 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HD3' ' HB3' ' B' ' 110' ' ' ASP . 8.8 mmtm -78.46 179.89 6.76 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.739 -0.209 . . . . 0.0 110.84 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.485 ' O ' ' HA ' ' B' ' 108' ' ' THR . 7.5 tt0 -130.26 120.74 24.9 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.916 0.389 . . . . 0.0 111.795 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 1.041 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -81.95 116.99 21.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.885 ' CG1' HG13 ' B' ' 107' ' ' VAL . 0.5 OUTLIER -113.78 122.22 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.105 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.721 ' OG1' ' H72' ' C' ' 178' ' ' ' DT' . 0.5 OUTLIER -131.59 129.85 41.44 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.025 -1.07 . . . . 0.0 112.954 -177.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.674 HG22 HG12 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -100.22 103.54 14.93 Favored 'Isoleucine or valine' 0 C--N 1.346 0.421 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 175.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.77 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.1 OUTLIER -69.77 67.17 0.25 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 122.009 0.909 . . . . 0.0 109.774 -178.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.716 HG21 ' HB3' ' A' ' 12' ' ' ASP . 9.4 p -106.09 -132.32 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.196 -1.365 . . . . 0.0 110.389 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.635 ' H ' HG22 ' A' ' 9' ' ' VAL . 3.2 t70 148.34 -87.16 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 -178.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 70.7 m -74.65 -5.67 44.34 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.716 ' HB3' HG21 ' A' ' 9' ' ' VAL . 4.2 t0 -79.68 56.76 2.32 Favored 'General case' 0 C--N 1.353 0.727 0 CA-C-N 120.437 1.471 . . . . 0.0 109.936 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' B' ' 132' ' ' MET . 13.2 m 65.25 -18.5 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.722 ' CE1' ' HB ' ' B' ' 105' ' ' ILE . 0.1 OUTLIER -50.63 -56.03 13.71 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 118.347 0.521 . . . . 0.0 110.777 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.745 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -50.75 -43.84 58.36 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.641 -0.708 . . . . 0.0 112.763 -177.906 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.641 HD13 ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -54.43 -40.59 68.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.905 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -58.93 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.665 0.745 . . . . 0.0 110.634 179.782 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 13.9 pttt -69.06 -25.78 64.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.655 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -59.17 -22.04 60.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 178.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.664 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 15.1 m-30 -87.84 -54.09 4.42 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.664 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 12.4 p-10 163.92 35.15 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 O-C-N 123.764 0.665 . . . . 0.0 112.117 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.655 HG13 ' O ' ' A' ' 22' ' ' VAL . 9.6 p -154.39 99.12 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.524 0.678 . . . . 0.0 112.622 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.7 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 16.0 m-20 -60.71 13.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.962 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.987 HG21 ' CE ' ' B' ' 132' ' ' MET . 1.7 pp 65.12 -5.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 N-CA-C 117.484 2.401 . . . . 0.0 117.484 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.757 ' HA ' ' HB ' ' B' ' 107' ' ' VAL . 9.8 p -38.49 -62.35 0.6 Allowed 'General case' 0 C--N 1.308 -1.233 0 O-C-N 123.243 0.339 . . . . 0.0 111.734 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.539 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -67.05 -38.72 92.74 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.663 -0.779 . . . . 0.0 113.059 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.492 ' CD2' HG22 ' A' ' 24' ' ' ILE . 3.5 tp -63.5 -61.44 2.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 117.208 0.504 . . . . 0.0 112.299 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.925 HG13 HG21 ' B' ' 124' ' ' ILE . 53.6 t -40.1 -73.4 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -178.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.735 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 0.1 OUTLIER -57.71 -32.55 67.5 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -178.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.539 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.9 OUTLIER -66.54 -54.09 27.53 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 177.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.498 HG21 ' OG1' ' B' ' 131' ' ' THR . 9.4 m -51.78 -47.83 64.03 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.317 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.848 ' HE1' ' CG1' ' B' ' 124' ' ' ILE . 5.3 mtt -49.07 -48.99 43.68 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.242 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -49.15 -36.33 18.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.446 0.566 . . . . 0.0 110.394 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -67.8 -51.42 48.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.467 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.91 ' HB3' HD21 ' B' ' 117' ' ' LEU . 2.4 tp10 -75.34 -17.23 60.29 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.625 0.25 . . . . 0.0 110.84 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.815 ' O ' HD11 ' A' ' 39' ' ' LEU . . . -86.28 -25.74 25.33 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 123.193 0.597 . . . . 0.0 109.691 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -82.22 -47.83 12.0 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 121.858 0.837 . . . . 0.0 109.756 177.916 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.472 ' O ' ' C ' ' A' ' 39' ' ' LEU . 5.7 mtt85 -83.15 -36.06 25.06 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.414 -177.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.878 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.0 OUTLIER 12.29 82.15 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -177.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.528 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -89.61 -50.93 5.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.768 179.724 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.556 ' HB2' ' HA2' ' B' ' 151' ' ' GLY . . . 168.39 138.33 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.245 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -72.06 149.15 45.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.956 0.408 . . . . 0.0 110.99 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mmm180 -88.36 94.18 9.76 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.125 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 7.2 m0 -47.5 115.13 1.03 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.051 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -80.52 112.6 18.02 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.003 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.1 p -85.57 157.88 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.09 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.13 -170.89 1.9 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.973 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.75 47.62 0.44 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.043 0.449 . . . . 0.0 111.29 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -96.71 134.16 40.34 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.171 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.25 163.83 23.69 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.169 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -147.62 49.13 0.62 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.981 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.1 mtm -122.89 153.38 39.72 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.784 0.326 . . . . 0.0 111.316 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.4 p -159.0 157.12 3.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.304 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.79 -178.8 3.68 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.823 0.344 . . . . 0.0 111.481 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 84.0 t -132.42 -79.74 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-O 121.441 0.639 . . . . 0.0 111.529 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.434 ' O ' ' HD2' ' A' ' 57' ' ' ARG . . . 56.67 94.97 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.961 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.434 ' HD2' ' O ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -140.74 150.32 43.26 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.551 179.891 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.514 ' N ' ' CD1' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -170.46 97.15 0.25 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.153 0.501 . . . . 0.0 111.519 -179.698 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -92.89 -130.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.947 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.41 173.27 15.87 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.823 0.283 . . . . 0.0 111.308 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.67 100.41 2.97 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.006 0.432 . . . . 0.0 111.291 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -111.74 148.45 33.46 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.39 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.41 171.07 23.89 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.84 179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 53.3 p -112.08 -175.5 2.7 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.784 0.326 . . . . 0.0 111.196 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -134.02 169.92 16.42 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.147 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -136.7 152.79 50.78 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.418 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.08 -76.25 0.51 Allowed 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.961 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 65.43 -176.02 0.18 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.806 0.336 . . . . 0.0 111.751 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -178.19 -99.11 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.024 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.4 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER 178.72 -33.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -179.86 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.8 80.37 0.23 Allowed 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.46 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.071 -0.966 . . . . 0.0 111.086 -179.393 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.758 0 N-CA-C 110.877 -0.046 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.37 112.35 24.05 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 110.242 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.55 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 52.9 tp60 -105.58 113.32 26.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.772 0.796 . . . . 0.0 110.31 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.7 ' NH1' ' HB3' ' B' ' 104' ' ' ARG . 7.9 ttp-105 -79.31 103.55 9.31 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.712 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.722 ' HB ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.66 129.03 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.342 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.645 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -128.61 115.6 18.32 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.859 -177.868 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.885 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.14 98.72 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.701 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 1.041 HG22 ' HG3' ' A' ' 4' ' ' ARG . 41.6 p -68.13 84.3 0.24 Allowed 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.006 HG21 ' HB2' ' B' ' 114' ' ' TYR . 6.4 t -72.56 -116.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.413 -177.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.628 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 4.9 t70 75.63 -7.48 1.78 Allowed 'General case' 0 C--N 1.351 0.649 0 CA-C-O 121.443 0.64 . . . . 0.0 109.597 -176.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 2.4 m -127.18 -69.43 0.75 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.46 179.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.735 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 0.6 OUTLIER -42.36 -78.28 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.476 ' H ' ' HB2' ' A' ' 29' ' ' SER . 1.7 m 169.0 46.78 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.55 0.691 . . . . 0.0 110.662 -178.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.006 ' HB2' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -83.89 -52.55 6.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.9 OUTLIER -48.69 -35.31 13.66 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -175.494 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.766 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -62.47 -57.03 12.68 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.632 0.651 . . . . 0.0 111.658 179.582 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.91 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -46.37 -48.76 18.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.506 0.67 . . . . 0.0 111.411 -178.375 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.715 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 5.2 pttt -79.35 -27.88 42.03 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.004 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -58.45 -28.06 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.878 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -88.42 -45.81 9.66 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.254 177.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 157.04 22.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 175.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.567 HG12 ' O ' ' B' ' 122' ' ' VAL . 49.5 t -138.93 82.57 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -178.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 1.042 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -64.54 56.74 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.006 0.431 . . . . 0.0 111.489 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.042 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER 44.66 -11.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.474 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.1 OUTLIER -38.19 -60.64 0.75 Allowed 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.362 1.437 . . . . 0.0 110.542 -178.523 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -81.11 -27.84 47.73 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.608 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.668 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -66.95 -62.35 1.48 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 122.701 0.4 . . . . 0.0 111.101 -179.901 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.924 HG22 HG22 ' A' ' 28' ' ' VAL . 3.0 t -47.08 -66.6 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-O 121.144 0.497 . . . . 0.0 109.877 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.558 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 13.7 p -47.99 -34.97 10.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.267 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.7 m -73.77 -56.24 5.23 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.498 ' OG1' HG21 ' A' ' 31' ' ' THR . 0.7 OUTLIER -51.74 -39.16 58.0 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.365 -0.834 . . . . 0.0 108.914 178.668 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.987 ' CE ' HG21 ' A' ' 24' ' ' ILE . 19.0 mmt -52.91 -54.08 39.86 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.042 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.2 -46.85 79.29 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.34 -54.57 30.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.882 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.732 ' CB ' HD21 ' A' ' 17' ' ' LEU . 21.7 mm-40 -62.76 -27.14 69.08 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.282 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.641 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -72.31 -46.45 55.58 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.571 0.348 . . . . 0.0 110.72 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -56.59 5.77 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.213 0.53 . . . . 0.0 111.545 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.477 ' HD2' ' HG3' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -83.75 -34.35 24.85 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -176.635 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.583 ' CD1' ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 37.16 70.68 0.17 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -179.133 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' B' ' 138' ' ' ARG . 3.6 ptp180 171.34 -71.89 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 177.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 179.45 148.15 0.24 Allowed 'General case' 0 C--O 1.239 0.551 0 CA-C-O 120.764 0.316 . . . . 0.0 111.67 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.477 ' HG3' ' HD2' ' B' ' 138' ' ' ARG . 1.4 mp0 -137.92 177.31 7.97 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.514 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.93 137.66 16.13 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.08 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.421 ' O ' ' NZ ' ' B' ' 145' ' ' LYS . 0.0 OUTLIER -125.54 -151.43 0.48 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.715 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.421 ' NZ ' ' O ' ' B' ' 144' ' ' TRP . 8.6 mmtm -130.53 -163.78 1.35 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 21.2 m -47.17 142.63 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-O 120.936 0.398 . . . . 0.0 111.878 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -53.37 -41.08 65.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.85 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 55.15 30.69 14.91 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.693 0.282 . . . . 0.0 111.604 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -143.27 141.43 31.03 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.735 0.302 . . . . 0.0 111.077 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -82.46 139.22 34.08 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.387 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . 0.556 ' HA2' ' HB2' ' A' ' 41' ' ' ALA . . . -102.13 84.46 0.5 Allowed Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.966 -0.635 . . . . 0.0 113.228 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.1 tpt -115.1 67.01 0.69 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.859 0.361 . . . . 0.0 111.399 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 19.4 t -129.87 143.91 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.164 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.6 -175.06 2.8 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.932 0.396 . . . . 0.0 111.903 -179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.859 HG13 ' O ' ' B' ' 120' ' ' TYR . 12.0 t -114.7 -122.38 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.213 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.485 ' N ' HG12 ' B' ' 155' ' ' VAL . . . 71.69 34.73 1.54 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.805 0.442 . . . . 0.0 111.383 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.34 126.69 13.58 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.124 0.488 . . . . 0.0 112.007 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -151.32 80.94 1.3 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.263 0.554 . . . . 0.0 111.701 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 16.8 mt -148.92 -56.88 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.582 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -78.28 125.88 29.99 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.895 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . 0.46 ' HA ' ' CE ' ' B' ' 161' ' ' MET . 2.4 mmt -163.21 107.74 1.07 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.851 0.357 . . . . 0.0 111.748 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . 0.454 ' HB3' " H4'" ' C' ' 178' ' ' ' DT' . 2.7 t-20 -176.53 -175.95 0.7 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 127.26 136.92 4.4 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.028 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.5 t -166.55 171.87 11.32 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.549 0.214 . . . . 0.0 111.203 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -179.81 129.95 0.09 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.39 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -139.02 106.91 5.66 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.293 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -76.78 121.78 23.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.032 0.444 . . . . 0.0 111.324 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -145.69 28.33 1.17 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.547 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 5.7 p30 176.26 -116.38 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.48 ' O ' ' CB ' ' B' ' 171' ' ' ASP . 0.0 OUTLIER 168.29 -33.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.072 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.48 ' CB ' ' O ' ' B' ' 170' ' ' LYS . 3.7 t0 98.05 88.87 0.01 OUTLIER 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.584 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.332 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.838 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.871 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 O4'-C1'-C2' 107.152 0.956 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.871 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.748 0 P-O3'-C3' 120.93 1.025 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.584 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 C4'-C3'-C2' 104.092 0.892 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.77 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.846 0 C1'-O4'-C4' 106.908 -1.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.529 ' OP2' ' HA ' ' A' ' 7' ' ' VAL . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C4'-C3'-C2' 104.619 1.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.721 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.882 0 C3'-C2'-C1' 105.397 1.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.592 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.522 0 C3'-C2'-C1' 105.146 1.747 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.844 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 C3'-C2'-C1' 100.65 -1.465 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.844 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.585 0 O4'-C1'-C2' 107.024 0.84 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.581 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -0.964 0 C4'-C3'-C2' 104.674 1.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.586 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.634 0 O4'-C1'-C2' 106.923 0.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.586 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C4'-C3'-C2' 103.791 0.591 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C4'-C3'-C2' 100.882 -2.318 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.533 ' H73' " H2'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C4'-C3'-C2' 102.379 -0.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.533 " H2'" ' H73' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C1'-C2' 106.826 0.66 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.634 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.636 0 O4'-C4'-C3' 106.13 0.53 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.634 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.6 0 O4'-C1'-C2' 106.991 0.81 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.605 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.0 0 C3'-C2'-C1' 105.416 1.94 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.563 ' C4 ' ' C5 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 104.807 1.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.597 " O5'" ' H8 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 C3'-C2'-C1' 106.318 2.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.503 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 N19-C1'-C2' 115.033 0.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.503 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.411 -0.728 0 C4'-C3'-C2' 104.464 1.264 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.416 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.078 0 C1'-O4'-C4' 106.756 -2.103 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.448 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C1'-O4'-C4' 111.075 0.982 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.751 0 C4'-C3'-C2' 103.987 0.787 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.584 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 C3'-C2'-C1' 102.077 -0.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.424 ' O ' ' C ' ' A' ' 2' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 110.84 -0.059 . . . . 0.0 110.84 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.583 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 7.4 mmmm -27.82 112.92 0.06 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' B' ' 109' ' ' VAL . 25.1 tt0 -95.31 115.97 28.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.24 0.543 . . . . 0.0 111.556 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.986 ' HG3' HG22 ' B' ' 108' ' ' THR . 7.9 ttm-85 -79.55 100.01 7.56 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.75 HG12 HG13 ' B' ' 107' ' ' VAL . 0.7 OUTLIER -103.28 130.54 53.37 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.842 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 176.367 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.833 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -130.05 127.66 40.36 Favored 'General case' 0 C--N 1.311 -1.083 0 C-N-CA 118.73 -1.188 . . . . 0.0 113.893 -177.1 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.868 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.1 t -101.02 112.54 34.26 Favored 'Isoleucine or valine' 0 C--N 1.347 0.49 0 C-N-CA 124.39 1.076 . . . . 0.0 108.789 176.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.417 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 2.0 p -70.92 85.17 0.69 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.826 0.739 . . . . 0.0 110.386 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.945 HG21 ' CD1' ' A' ' 14' ' ' TYR . 10.3 m -72.26 -162.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.981 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.567 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 7.6 t70 84.7 -23.59 0.17 Allowed 'General case' 0 C--N 1.351 0.636 0 C-N-CA 123.396 0.679 . . . . 0.0 109.365 -177.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.36 -75.52 0.53 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.294 177.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.914 ' CB ' ' HB2' ' B' ' 129' ' ' SER . 1.0 OUTLIER -51.46 -87.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 -176.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.516 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 5.2 t -176.85 41.91 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.256 0.935 . . . . 0.0 112.259 -178.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.945 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -83.2 -43.8 15.74 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.688 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 16.8 mt-30 -47.84 -37.8 14.66 Favored 'General case' 0 C--O 1.221 -0.418 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -174.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.892 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -58.42 -56.22 24.93 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.473 1.033 . . . . 0.0 111.693 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.796 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -48.05 -47.89 33.47 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.454 0.645 . . . . 0.0 111.63 -178.214 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.2 OUTLIER -76.74 -27.16 55.27 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.41 178.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -66.03 -27.61 68.24 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.855 178.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.743 ' CD2' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.8 -40.48 14.01 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.57 178.482 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.545 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.8 OUTLIER 151.21 21.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.267 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.469 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 68.4 t -155.9 89.51 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.512 -0.515 0 C-N-CA 120.886 -0.326 . . . . 0.0 111.833 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.467 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 1.1 m120 -61.2 -100.28 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.064 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -146.26 4.79 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.431 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 89.5 p -44.38 -64.82 0.61 Allowed 'General case' 0 C--O 1.244 0.794 0 C-N-CA 119.395 -0.922 . . . . 0.0 108.826 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.4 -28.65 29.58 Favored Glycine 0 CA--C 1.519 0.319 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.593 177.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.913 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.1 OUTLIER -58.74 -59.6 5.16 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 122.198 0.199 . . . . 0.0 110.858 179.489 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.064 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.1 t -52.31 -61.65 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.835 ' HB3' ' CB ' ' B' ' 112' ' ' ASP . 12.1 p -50.55 -42.73 55.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 89.3 m -71.34 -53.29 14.68 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.47 -41.46 89.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.129 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.968 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -56.0 -52.99 62.24 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.446 178.433 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.444 ' HG3' ' HB3' ' B' ' 113' ' ' SER . 53.2 mt-30 -53.68 -56.68 15.17 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.35 -53.27 56.11 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.598 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.955 ' HB3' HD21 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -66.83 -23.33 66.02 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.145 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.775 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -72.19 -47.57 49.66 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -62.79 -51.58 66.52 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.529 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -60.73 -52.14 66.36 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 114.429 -1.26 . . . . 0.0 110.151 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.842 HD21 ' HB2' ' B' ' 120' ' ' TYR . 0.2 OUTLIER 34.59 81.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.953 0.901 . . . . 0.0 113.008 178.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.8 mtt180 69.58 50.02 0.53 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.398 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.52 -57.92 1.72 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.0 158.86 10.2 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.015 0.436 . . . . 0.0 111.963 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -99.57 -58.67 1.88 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.962 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 9.9 t-105 -171.15 173.69 4.9 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.5 0.19 . . . . 0.0 110.827 -179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HB3' ' HB2' ' B' ' 142' ' ' GLU . 1.8 mtmp? -147.25 164.46 33.14 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.539 0.209 . . . . 0.0 111.143 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.437 ' HB ' ' O ' ' B' ' 143' ' ' ARG . 21.8 t -129.06 -102.66 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.615 ' O ' ' HB2' ' A' ' 48' ' ' ASN . 18.2 mt-10 -149.07 90.95 1.8 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -178.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.785 ' HB3' ' HB3' ' B' ' 144' ' ' TRP . 10.0 t-20 134.36 -125.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.47 1.108 . . . . 0.0 112.077 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.614 ' O ' ' HB2' ' B' ' 144' ' ' TRP . 23.7 mt-30 -122.76 -176.07 3.31 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-O 120.983 0.421 . . . . 0.0 111.87 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.441 ' CD ' ' H ' ' A' ' 50' ' ' GLU . 1.8 pm0 -73.93 138.97 44.59 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.978 0.418 . . . . 0.0 111.603 -179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.581 ' HA3' ' CZ3' ' B' ' 144' ' ' TRP . . . 174.66 -147.88 9.4 Favored Glycine 0 C--N 1.336 0.563 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.059 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.608 ' O ' HG12 ' A' ' 53' ' ' VAL . 4.8 ttt -72.26 -39.99 67.98 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.608 HG12 ' O ' ' A' ' 52' ' ' MET . 2.8 p 50.9 24.26 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -93.01 135.04 34.53 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.761 0.315 . . . . 0.0 111.365 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.4 t -137.12 -125.66 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.376 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -174.23 -101.28 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.401 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 39.6 mmt-85 -156.74 170.64 21.96 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.96 0.41 . . . . 0.0 111.862 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -177.97 103.47 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.374 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 32.2 mm -140.9 106.8 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.038 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -101.62 156.75 17.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.435 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 12.9 mtm -137.12 109.32 7.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.148 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -141.33 149.0 40.62 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.291 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -138.39 -162.73 9.31 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.123 -0.56 . . . . 0.0 112.833 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.5 t -161.74 177.76 9.62 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.861 0.362 . . . . 0.0 111.411 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -136.9 164.23 28.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.336 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -147.5 151.33 36.19 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.136 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -128.4 -79.09 0.57 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.355 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.83 -163.07 0.83 Allowed 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.661 0.267 . . . . 0.0 111.461 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -154.4 -71.27 0.13 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.987 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.49 ' NZ ' ' O ' ' A' ' 71' ' ' ASP . 0.1 OUTLIER -179.92 -37.0 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.49 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.1 t70 86.28 179.89 0.03 OUTLIER 'General case' 0 N--CA 1.432 -1.357 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.131 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.141 -0.933 . . . . 0.0 111.566 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.414 ' O ' ' C ' ' B' ' 102' ' ' LYS . 4.7 mpp? . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 120.276 0.084 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.473 ' HE2' " H3'" ' C' ' 175' ' ' ' DA' . 12.3 mptt -29.11 114.7 0.09 Allowed 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.445 0.466 . . . . 0.0 111.997 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.821 ' HB3' HG23 ' A' ' 9' ' ' VAL . 3.5 tp60 -99.36 125.06 44.96 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.976 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.472 ' NE ' ' O4 ' ' C' ' 178' ' ' ' DT' . 0.3 OUTLIER -77.91 114.61 16.94 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.279 -177.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 1.04 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -102.89 108.98 25.48 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.949 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 177.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.833 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -115.25 114.02 24.65 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.986 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.75 HG13 HG12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.21 101.35 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 176.849 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.986 HG22 ' HG3' ' A' ' 4' ' ' ARG . 77.0 p -68.61 95.2 0.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.297 0.57 . . . . 0.0 110.156 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.01 HG21 ' CG ' ' B' ' 114' ' ' TYR . 16.5 m -91.29 -148.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 114.652 -1.158 . . . . 0.0 112.613 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.529 ' N ' HG23 ' B' ' 109' ' ' VAL . 15.9 t70 88.84 -13.33 0.39 Allowed 'General case' 0 C--N 1.346 0.445 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 -176.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.4 t -114.46 -62.48 1.59 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.835 ' CB ' ' HB3' ' A' ' 29' ' ' SER . 0.6 OUTLIER -48.66 -89.34 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 O-C-N 123.591 0.557 . . . . 0.0 111.865 -179.655 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.444 ' HB3' ' HG3' ' A' ' 33' ' ' GLN . 1.3 m 176.04 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.865 0.757 . . . . 0.0 111.438 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.01 ' CG ' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.37 -44.36 16.23 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -179.312 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.578 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 4.4 mt-30 -48.78 -42.63 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.775 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.8 OUTLIER -52.32 -30.19 27.11 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.955 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -77.5 -53.62 7.41 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 121.599 0.714 . . . . 0.0 111.204 179.534 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.625 ' HG2' ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -70.43 -28.83 65.35 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.556 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -60.57 -28.13 68.23 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.864 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.842 ' HB2' HD21 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -89.16 -36.81 15.48 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.022 179.097 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.719 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 33.2 t70 146.83 25.36 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 176.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.582 ' HB ' ' CE1' ' B' ' 120' ' ' TYR . 61.8 t -159.67 101.13 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 O-C-N 121.841 -0.537 . . . . 0.0 112.396 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.557 ' O ' ' HE1' ' A' ' 32' ' ' MET . 67.8 m-80 -58.9 -92.51 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 177.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.011 HG22 ' HB3' ' B' ' 127' ' ' LEU . 0.1 OUTLIER -154.84 6.76 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.727 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.868 ' HA ' HG22 ' A' ' 7' ' ' VAL . 54.0 p -38.6 -64.27 0.45 Allowed 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.076 -177.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.588 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.25 -20.25 46.41 Favored Glycine 0 CA--C 1.522 0.471 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.834 177.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 1.011 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -62.82 -61.21 2.56 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.061 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.913 HG22 HG21 ' A' ' 24' ' ' ILE . 26.0 t -55.15 -65.16 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 CA-C-O 121.687 0.755 . . . . 0.0 109.136 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.914 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 3.0 p -49.44 -47.96 47.8 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.588 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -81.14 -48.53 12.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.441 1.019 . . . . 0.0 111.198 -178.404 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.736 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -55.98 -37.91 69.72 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.102 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.913 ' SD ' HD12 ' A' ' 27' ' ' LEU . 1.6 mmt -64.21 -48.19 76.83 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.389 178.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 14.6 tt0 -48.79 -42.13 34.83 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 118.096 0.407 . . . . 0.0 110.659 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . 0.712 ' HB3' ' HG2' ' B' ' 142' ' ' GLU . 1.5 m-20 -63.51 -55.68 22.06 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.177 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.631 ' O ' ' HA ' ' B' ' 139' ' ' LEU . 23.9 tp10 -71.31 -9.76 58.65 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.102 178.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.892 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -88.19 -46.93 8.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.985 0.421 . . . . 0.0 109.925 178.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -63.3 -56.17 18.65 Favored 'General case' 0 CA--C 1.5 -0.961 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.623 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.607 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 2.8 tpt85 -83.06 -41.35 18.72 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.236 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.743 HD11 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER 57.21 58.38 3.95 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.445 0.64 . . . . 0.0 112.417 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.51 ' HG2' ' C ' ' B' ' 139' ' ' LEU . 2.0 ptt-85 167.45 -50.64 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.241 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' B' ' 138' ' ' ARG . . . -170.46 130.44 0.89 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 122.47 0.308 . . . . 0.0 110.542 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.712 ' HG2' ' HB3' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -105.07 131.81 52.11 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.247 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.611 ' HB3' ' O ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 171.36 -64.03 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.785 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 2.1 t90 -88.3 -128.7 0.06 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.142 0.177 . . . . 0.0 111.296 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' B' ' 145' ' ' LYS . 0.0 OUTLIER -134.73 -174.32 3.55 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.813 0.34 . . . . 0.0 111.194 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 5.9 p -82.33 139.3 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 120.914 0.388 . . . . 0.0 111.849 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -162.75 162.09 26.57 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.063 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -90.11 133.69 34.71 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.13 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.08 58.03 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.12 -174.79 3.03 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.892 0.377 . . . . 0.0 111.511 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 147.76 35.86 0.05 OUTLIER Glycine 0 CA--C 1.523 0.571 0 CA-C-N 115.977 -0.556 . . . . 0.0 113.71 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . 0.439 ' O ' HG13 ' B' ' 153' ' ' VAL . 2.6 ttp -86.26 48.63 1.65 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.45 0.625 . . . . 0.0 111.626 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.439 HG13 ' O ' ' B' ' 152' ' ' MET . 0.7 OUTLIER -157.35 130.2 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.709 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.3 151.68 19.5 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.856 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.2 t -125.5 -4.49 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 54.62 56.13 7.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.209 0.528 . . . . 0.0 111.364 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.84 97.01 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.906 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.88 82.63 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.072 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 67.4 mt -141.5 -61.14 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.002 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.05 122.09 32.04 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.756 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 5.0 ttt -113.92 -13.2 12.57 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.077 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 70.46 179.72 0.24 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.0 0.429 . . . . 0.0 111.755 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 175.06 -150.48 11.15 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 121.048 -0.596 . . . . 0.0 112.716 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 20.9 t -164.49 172.81 12.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.599 0.238 . . . . 0.0 111.365 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -175.66 119.92 0.17 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.459 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -160.09 139.66 11.17 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.095 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -120.05 92.58 3.81 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.21 0.529 . . . . 0.0 111.765 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -143.17 71.56 1.34 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.593 0.711 . . . . 0.0 109.947 179.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -115.04 171.36 7.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.744 -179.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.16 -34.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 71.33 -59.98 0.53 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.798 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 8.4 m95 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.852 179.502 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.518 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.568 0 O4'-C1'-N19 108.264 0.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.551 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 C3'-C2'-C1' 100.726 -1.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.572 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 O4'-C1'-C2' 107.326 1.115 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.574 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.406 -1.082 0 C1'-O4'-C4' 107.134 -1.833 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.58 ' OP1' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.426 -0.891 0 C3'-C2'-C1' 104.54 1.314 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.649 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.847 0 C4'-C3'-C2' 104.616 1.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.8 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.552 0 C3'-C2'-C1' 104.468 1.263 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.8 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.514 -0.532 0 C3'-C2'-C1' 101.296 -1.003 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C1'-O4'-C4' 110.913 0.866 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.524 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.931 0 C4'-C3'-C2' 104.748 1.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.524 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.704 0 C4'-C3'-C2' 104.193 0.993 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.423 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 101.651 -0.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 C4'-C3'-C2' 100.856 -2.344 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 N19-C1'-C2' 115.598 0.874 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.587 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 C3'-C2'-C1' 102.131 -0.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.587 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.667 0 C1'-O4'-C4' 110.783 0.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.489 H2'' " O5'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.795 0 C1'-O4'-C4' 106.952 -1.963 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.733 ' C8 ' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C4'-C3'-C2' 104.797 1.597 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.733 ' H72' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.828 0 C4'-C3'-C2' 103.92 0.72 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.428 " H2'" ' C7 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 C3'-C2'-C1' 106.386 2.633 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.528 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.656 0 N19-C1'-C2' 115.868 1.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.528 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C3'-C2'-C1' 105.762 2.187 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.524 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.811 0 C4'-C3'-C2' 104.382 1.182 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.451 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 C4'-C3'-C2' 104.139 0.939 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.428 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 N19-C1'-C2' 115.472 0.795 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.572 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.647 0 C4'-C3'-C2' 103.713 0.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.416 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 62.2 mtm . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 120.805 0.336 . . . . 0.0 110.999 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 3.5 mptt 70.02 111.54 0.05 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.986 -178.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.446 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 29.7 tp60 -104.64 109.62 21.61 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.13 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.856 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 2.3 ttm105 -78.91 104.6 9.65 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.331 -179.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.656 HG12 HG13 ' B' ' 107' ' ' VAL . 0.2 OUTLIER -104.08 130.21 55.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 177.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.7 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -131.36 128.41 39.6 Favored 'General case' 0 C--N 1.311 -1.103 0 C-N-CA 119.117 -1.033 . . . . 0.0 112.901 -177.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.69 HG22 ' HA ' ' B' ' 125' ' ' SER . 1.2 t -100.1 107.64 21.33 Favored 'Isoleucine or valine' 0 C--N 1.35 0.598 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 6.2 p -71.23 98.34 1.71 Allowed 'General case' 0 C--N 1.33 -0.26 0 O-C-N 121.94 -0.475 . . . . 0.0 110.442 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.005 HG21 ' HB3' ' A' ' 14' ' ' TYR . 3.8 t -92.35 -130.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 119.094 -0.479 . . . . 0.0 112.077 -178.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.541 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 31.4 t70 85.18 -9.23 0.84 Allowed 'General case' 0 C--N 1.351 0.641 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.4 m -132.23 -56.54 0.97 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.856 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.8 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 2.8 m-20 -49.86 -98.36 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -177.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 41.3 t -178.41 36.78 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.376 -0.828 . . . . 0.0 110.606 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.005 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.79 -45.71 14.0 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.99 -1.004 . . . . 0.0 112.794 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.685 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.1 -39.24 27.4 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -176.014 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.795 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -59.14 -56.84 17.07 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.439 0.563 . . . . 0.0 112.284 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.95 HD12 ' HA ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -59.61 -39.46 84.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 120.027 -0.669 . . . . 0.0 112.744 -177.471 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.685 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -80.14 -35.47 36.58 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.041 0.448 . . . . 0.0 112.123 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.569 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -73.66 -21.57 60.23 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.896 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.057 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -87.79 -40.08 14.36 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 118.913 -0.565 . . . . 0.0 109.642 178.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.602 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 7.0 t70 171.52 -5.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.81 ' HB ' HD22 ' A' ' 17' ' ' LEU . 74.4 t -121.57 82.0 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -177.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.025 ' O ' HD12 ' A' ' 24' ' ' ILE . 45.5 p30 -67.19 51.44 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 111.068 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.025 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 46.11 -15.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -37.99 -63.01 0.51 Allowed 'General case' 0 C--O 1.238 0.486 0 CA-C-N 120.166 1.348 . . . . 0.0 110.838 -177.688 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.52 -29.16 30.69 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.473 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.796 ' CD1' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -58.0 -62.33 1.9 Allowed 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.463 179.511 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.015 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.8 t -48.48 -63.48 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.382 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.828 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 94.2 p -49.55 -38.73 32.05 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 81.3 m -67.31 -54.41 20.96 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.586 HG22 HD11 ' B' ' 127' ' ' LEU . 93.0 m -58.15 -40.85 82.45 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.257 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.948 ' SD ' HD12 ' B' ' 117' ' ' LEU . 8.1 mmt -53.52 -54.27 39.63 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.974 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? -62.73 -45.11 94.22 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.935 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.47 -50.72 71.62 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.554 ' HG2' ' CD1' ' B' ' 127' ' ' LEU . 5.6 tp10 -64.57 -37.93 89.24 Favored 'General case' 0 C--O 1.226 -0.184 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.922 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -56.11 -43.5 78.18 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 177.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -53.24 19.86 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -37.04 71.3 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.187 -1.369 . . . . 0.0 113.224 -177.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -26.29 -48.25 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 113.912 1.079 . . . . 0.0 113.912 -178.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.403 ' O ' ' NH1' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -70.46 60.74 0.22 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.228 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -162.56 125.65 2.88 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.749 0.309 . . . . 0.0 111.493 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -74.56 59.3 0.82 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 112.31 13.14 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.988 0.423 . . . . 0.0 110.754 178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -129.72 -174.94 3.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.541 -179.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.6 mtmm -130.44 162.65 28.69 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.626 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.7 m -138.47 45.58 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.034 0.445 . . . . 0.0 111.066 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -138.57 60.29 1.61 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.218 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.482 ' HB3' ' OE1' ' A' ' 49' ' ' GLN . 4.2 m120 -120.48 -94.75 0.5 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.542 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' OE1' ' HB3' ' A' ' 48' ' ' ASN . 2.2 pm0 -131.87 56.09 1.84 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.284 0.564 . . . . 0.0 110.806 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.04 -163.27 0.85 Allowed 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.294 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -175.8 121.64 0.82 Allowed Glycine 0 C--N 1.334 0.443 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.782 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 87.8 mtp -73.69 70.23 1.35 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.971 0.415 . . . . 0.0 110.895 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 13.5 p -58.93 131.99 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.878 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -107.1 -172.72 2.13 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.337 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 6.1 t -99.26 -3.59 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' ' 55' ' ' VAL . . . 71.21 -57.99 0.59 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.234 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -128.6 138.33 52.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.282 179.481 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -142.31 75.59 1.5 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.666 0.746 . . . . 0.0 112.245 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 38.4 mm -112.84 91.81 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.767 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -76.44 132.91 39.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.864 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -129.27 -54.97 1.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.4 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -134.08 -160.4 1.05 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.976 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.51 -112.08 0.46 Allowed Glycine 0 C--N 1.338 0.664 0 C-N-CA 120.873 -0.68 . . . . 0.0 113.152 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.419 ' OG ' ' N ' ' A' ' 65' ' ' PHE . 48.4 t 60.89 -149.91 0.41 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.643 0.259 . . . . 0.0 110.772 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.419 ' N ' ' OG ' ' A' ' 64' ' ' SER . 0.4 OUTLIER -111.01 -53.54 2.69 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.536 0.207 . . . . 0.0 111.219 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.27 40.3 3.75 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 36.11 73.11 0.09 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.221 0.534 . . . . 0.0 112.387 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -67.61 124.8 24.25 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.876 0.37 . . . . 0.0 110.616 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -82.94 -52.93 6.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.643 -179.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER 174.27 -29.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.533 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 4.5 t70 84.57 122.47 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.553 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.837 -1.078 . . . . 0.0 110.633 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 1.4 mmm . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 111.218 0.081 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.516 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 12.0 mmmt -148.31 174.59 11.87 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.529 ' N ' ' HB2' ' A' ' 10' ' ' ASP . 33.8 tp60 -121.15 112.53 18.78 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.535 0.683 . . . . 0.0 112.121 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.488 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 5.5 ttm105 -79.55 111.91 16.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.895 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.7 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.8 OUTLIER -101.47 130.06 51.61 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.758 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.255 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.66 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.96 116.56 17.3 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.281 -177.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.793 HG22 HG22 ' B' ' 109' ' ' VAL . 0.8 OUTLIER -101.66 104.54 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 174.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.856 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 8.9 p -70.02 95.29 0.94 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.855 HG11 ' HB3' ' B' ' 114' ' ' TYR . 0.9 OUTLIER -93.2 -145.3 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.992 -178.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 28.2 t0 92.69 -10.62 0.18 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 -175.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.46 -64.35 1.26 Allowed 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.354 177.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.828 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -44.0 -94.44 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -179.436 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -177.59 42.33 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.699 -0.625 . . . . 0.0 110.94 -179.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.855 ' HB3' HG11 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.13 -45.52 15.05 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.055 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.548 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 3.9 mt-30 -49.86 -43.67 49.26 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.922 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -50.43 -33.82 22.29 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 1.057 HD12 HD22 ' B' ' 127' ' ' LEU . 0.4 OUTLIER -78.1 -53.94 6.83 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.894 -0.722 . . . . 0.0 111.771 178.594 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.548 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.1 OUTLIER -63.44 -25.49 68.3 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.995 178.621 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.62 -26.18 31.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.775 178.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.63 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 97.4 m-85 -87.64 -49.11 7.37 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.295 178.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.63 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 25.0 p-10 136.46 34.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 124.844 1.34 . . . . 0.0 112.078 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.599 ' CG1' HD13 ' B' ' 117' ' ' LEU . 5.5 p -120.76 -39.7 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.419 ' O ' ' HE1' ' A' ' 32' ' ' MET . 36.8 m-80 59.95 -119.64 0.92 Allowed 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 0.87 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -139.21 4.02 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 179.477 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.69 ' HA ' HG22 ' A' ' 7' ' ' VAL . 0.4 OUTLIER -40.53 -64.96 0.46 Allowed 'General case' 0 C--O 1.243 0.744 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.466 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.445 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.5 -23.13 51.95 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.128 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 1.057 HD22 HD12 ' B' ' 117' ' ' LEU . 7.0 tp -63.99 -61.27 2.38 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-N 116.843 0.322 . . . . 0.0 111.187 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.87 HG23 ' CG2' ' B' ' 124' ' ' ILE . 24.8 t -51.83 -61.19 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.8 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 5.8 p -48.41 -49.08 36.45 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.445 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.5 OUTLIER -77.04 -43.73 33.45 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.61 0.641 . . . . 0.0 110.496 179.776 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.6 OUTLIER -63.14 -39.89 96.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.647 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.95 ' HA ' HD12 ' A' ' 17' ' ' LEU . 4.8 mmt -63.48 -57.05 11.45 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.62 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.442 ' O ' ' HB2' ' B' ' 137' ' ' ARG . 5.3 tp60 -48.82 -37.52 19.55 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.962 0.164 . . . . 0.0 111.225 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -65.18 -57.47 8.45 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.769 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.928 ' HB2' HD11 ' A' ' 17' ' ' LEU . 1.3 mm-40 -75.81 -8.56 57.17 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.569 0.223 . . . . 0.0 111.053 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.795 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.23 -32.48 19.75 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -82.39 -46.77 13.11 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.898 0.856 . . . . 0.0 110.326 178.245 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 11.4 mtt180 -78.39 -17.47 56.39 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 113.617 -1.629 . . . . 0.0 114.614 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.057 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -36.32 124.24 0.78 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 118.678 0.672 . . . . 0.0 111.841 -178.458 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.402 ' HE ' ' CG ' ' B' ' 142' ' ' GLU . 1.1 ptt180 81.79 143.76 0.07 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.022 -179.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.39 113.05 1.6 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.777 0.322 . . . . 0.0 110.833 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.402 ' CG ' ' HE ' ' B' ' 140' ' ' ARG . 2.1 mm-40 -142.64 167.9 20.99 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.148 0.499 . . . . 0.0 112.1 -179.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.51 41.46 0.7 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.364 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -92.87 175.88 6.64 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.088 0.47 . . . . 0.0 111.83 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.99 -69.6 0.6 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.444 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 13.5 p -172.99 154.98 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.119 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -99.41 109.58 22.15 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.105 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -178.7 -51.16 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.174 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.14 123.8 0.72 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.881 0.372 . . . . 0.0 111.204 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -92.85 45.36 1.18 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.044 0.45 . . . . 0.0 111.19 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -105.07 85.22 0.45 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 121.238 -0.506 . . . . 0.0 112.709 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 1.1 ttt -69.96 86.95 0.54 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.954 0.407 . . . . 0.0 111.153 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 15.3 t -122.19 137.06 57.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.115 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -102.2 171.84 7.25 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.057 0.456 . . . . 0.0 111.419 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.4 t -133.37 -125.53 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.082 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 60.84 93.01 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.005 0.431 . . . . 0.0 112.14 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 5.0 ptt180 -81.7 153.56 26.51 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.917 0.389 . . . . 0.0 111.302 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -103.96 56.86 0.73 Allowed 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.641 0.734 . . . . 0.0 110.544 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 7.8 mm -123.93 88.74 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.493 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -149.16 163.96 36.09 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.852 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 77.9 mtp 49.34 59.35 4.54 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.068 0.461 . . . . 0.0 111.302 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -133.6 170.1 16.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.616 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 101.86 -164.15 17.34 Favored Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.017 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 34.0 t -153.78 165.77 34.98 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.963 0.411 . . . . 0.0 111.519 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.97 24.64 0.5 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.616 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -179.26 80.68 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.91 0.386 . . . . 0.0 111.198 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -94.26 -52.98 4.12 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.384 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 65.28 -151.55 0.26 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.413 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 70.2 -107.08 0.06 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 122.283 0.233 . . . . 0.0 110.825 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.466 ' NZ ' ' O ' ' B' ' 171' ' ' ASP . 0.4 OUTLIER 175.42 -32.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.466 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 2.0 t0 86.24 177.82 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.381 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.493 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.279 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.405 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.487 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.643 0 C1'-O4'-C4' 110.487 0.562 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.487 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 C3'-C2'-C1' 101.593 -0.79 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.576 ' C2 ' ' C2 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-C2' 107.392 1.175 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.02 0 C1'-O4'-C4' 106.427 -2.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.485 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.912 0 C4'-C3'-C2' 104.755 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.627 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.941 0 C4'-C3'-C2' 104.619 1.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.546 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.566 0 C3'-C2'-C1' 105.209 1.792 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.922 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C3'-C2'-C1' 100.703 -1.426 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.922 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 C1'-O4'-C4' 110.61 0.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.424 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.527 0.865 0 C3'-C2'-C1' 105.327 1.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.437 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.652 0 O4'-C1'-C2' 106.877 0.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.437 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 C4'-C3'-C2' 104.41 1.21 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 C4'-C3'-C2' 100.937 -2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.577 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.872 0 O4'-C1'-N19 109.12 1.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.577 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 P--O3' 1.614 0.553 0 C4'-C3'-C2' 104.337 1.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.735 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C3'-C2'-C1' 102.101 -0.428 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.749 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C4'-C3'-C2' 102.362 -0.838 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.749 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -1.013 0 C4'-C3'-C2' 104.752 1.552 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.638 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C5'-C4'-O4' 108.492 -0.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.59 ' N7 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C3'-C2'-C1' 104.252 1.108 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.512 -0.623 0 C4'-C3'-C2' 104.006 0.806 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.494 ' C5 ' ' C5 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.811 0 C4'-C3'-C2' 104.66 1.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.494 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.967 0 C1'-O4'-C4' 107.306 -1.71 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.636 0 C4'-C3'-C2' 104.07 0.87 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 O4'-C1'-C2' 105.218 -0.802 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.576 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 O4'-C4'-C3' 105.968 0.368 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.492 ' O ' ' HD2' ' A' ' 2' ' ' LYS . 30.7 mtt . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 120.038 -0.029 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.579 ' HE3' ' O ' ' B' ' 109' ' ' VAL . 1.7 mmmt -143.35 174.84 10.38 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 123.425 0.453 . . . . 0.0 110.598 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.715 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -119.28 107.64 13.64 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.312 0.577 . . . . 0.0 111.796 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.893 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.94 109.79 14.7 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.534 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.909 HD13 HG13 ' B' ' 107' ' ' VAL . 0.0 OUTLIER -121.28 112.93 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 177.396 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.787 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.0 OUTLIER -123.46 132.92 54.08 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.84 -177.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.834 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.41 112.27 32.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 176.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.402 HG23 ' NH1' ' B' ' 104' ' ' ARG . 6.5 p -67.06 92.76 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.623 -0.673 . . . . 0.0 110.07 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.813 HG11 ' CB ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -97.64 -155.13 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.404 -178.235 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 9' ' ' VAL . 24.7 t0 113.22 5.27 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.597 1.159 . . . . 0.0 108.837 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.7 t -152.18 -38.8 0.11 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.22 -1.354 . . . . 0.0 110.756 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.726 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -73.3 32.64 0.07 Allowed 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -177.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER 70.71 1.71 3.83 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 120.692 -1.255 . . . . 0.0 113.856 178.202 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.034 ' CZ ' HG21 ' B' ' 105' ' ' ILE . 0.7 OUTLIER -55.92 -53.6 54.88 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.919 0.39 . . . . 0.0 110.919 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.622 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 3.0 mp0 -49.91 -41.55 46.21 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -177.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.726 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -51.08 -29.71 13.88 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.94 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.65 -59.8 2.63 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.466 0.651 . . . . 0.0 110.919 178.2 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 4.4 pttt -63.63 -25.91 68.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.799 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.464 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.25 -25.64 34.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.098 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.61 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 21.0 m-85 -88.32 -50.24 6.46 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.565 178.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.61 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 19.7 t0 143.34 50.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.216 0.947 . . . . 0.0 110.166 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 22' ' ' VAL . 1.4 p -176.05 96.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.738 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -60.83 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.109 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.974 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -146.38 5.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.444 ' HB3' ' P ' ' D' ' 190' ' ' ' DG' . 36.2 p -39.11 -62.99 0.58 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.455 -177.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.18 -30.04 32.12 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.098 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.816 HD23 HG23 ' A' ' 24' ' ' ILE . 22.0 tp -60.56 -56.3 22.95 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.193 0.197 . . . . 0.0 111.28 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.992 HG22 HG21 ' B' ' 124' ' ' ILE . 3.1 t -53.96 -64.43 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.439 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.687 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.75 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 10.8 p -49.73 -42.19 45.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.411 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -73.11 -46.15 52.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.784 ' HB ' HD21 ' B' ' 127' ' ' LEU . 22.9 m -63.21 -36.13 82.63 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.981 179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 1.071 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -54.57 -47.86 72.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.184 179.071 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.5 -36.85 76.84 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 120.475 0.179 . . . . 0.0 111.182 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.43 -44.8 50.21 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.767 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.2 tp10 -69.86 -26.63 64.3 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.045 177.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.764 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.34 -44.72 64.54 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -55.55 11.73 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.509 0.671 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -82.08 -40.84 21.38 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 114.668 -1.151 . . . . 0.0 114.046 -176.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.571 HD11 ' CD2' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 48.58 -174.8 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -178.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.05 177.25 0.06 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.79 -179.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -76.71 164.6 25.72 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.004 0.43 . . . . 0.0 112.033 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.47 ' O ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -105.97 -176.04 2.96 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.132 0.492 . . . . 0.0 112.154 -179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.47 ' HD2' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -134.91 -164.67 1.55 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.361 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -137.97 163.88 30.42 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 120.751 0.31 . . . . 0.0 111.554 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -170.37 165.97 8.66 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.395 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.498 HG22 ' H ' ' A' ' 47' ' ' GLU . 2.0 p -109.6 170.66 2.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.169 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.732 ' OE2' ' H71' ' C' ' 176' ' ' ' DT' . 0.0 OUTLIER -159.94 159.58 32.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.135 0.493 . . . . 0.0 112.116 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 23.7 t-20 170.41 154.37 0.05 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.89 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 176.02 151.08 0.14 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.107 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -124.4 148.92 47.25 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.812 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -164.92 128.31 1.77 Allowed Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.436 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.12 59.08 0.52 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.26 0.553 . . . . 0.0 110.827 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.629 HG11 H5'' ' D' ' 193' ' ' ' DT' . 9.4 p -69.81 120.7 17.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.881 -179.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.3 77.35 1.85 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.273 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.603 HG13 ' H ' ' A' ' 56' ' ' ALA . 7.5 p -86.27 -117.28 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.051 -179.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.603 ' H ' HG13 ' A' ' 55' ' ' VAL . . . 69.93 52.44 0.4 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.121 0.486 . . . . 0.0 111.415 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.11 166.25 16.48 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.558 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -178.98 97.55 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.489 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.567 HG22 ' N ' ' A' ' 60' ' ' GLU . 22.8 mm -149.8 -89.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.409 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.567 ' N ' HG22 ' A' ' 59' ' ' ILE . 4.1 tp10 -160.55 166.18 29.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.505 0.322 . . . . 0.0 110.411 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.5 -84.92 0.2 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 176.94 -175.37 0.13 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.932 0.396 . . . . 0.0 111.788 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -100.51 119.16 6.41 Favored Glycine 0 C--N 1.336 0.537 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.414 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 73.7 m -62.73 80.6 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.929 0.395 . . . . 0.0 112.026 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -140.63 98.27 3.37 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.873 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -146.13 101.92 3.57 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.681 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -76.43 -56.29 4.76 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.664 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 57.02 72.27 0.52 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.08 0.467 . . . . 0.0 111.465 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -85.98 -104.17 0.06 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.32 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.35 -36.57 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 74.81 -78.19 0.05 OUTLIER 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 114.452 -1.249 . . . . 0.0 111.52 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 34.2 m0 . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.666 179.539 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 120.729 0.3 . . . . 0.0 111.751 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.681 ' CG ' ' HB3' ' A' ' 47' ' ' GLU . 1.8 mmtp -152.86 123.96 7.51 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.007 0.432 . . . . 0.0 111.982 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.487 ' HG2' HG22 ' B' ' 105' ' ' ILE . 2.0 tt0 -113.54 110.6 20.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.965 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.711 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 11.8 ttm-85 -79.23 99.14 6.91 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.183 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 1.034 HG21 ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -104.82 112.29 37.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.587 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.787 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -107.33 125.1 50.75 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.447 -175.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.909 HG13 HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -99.33 93.3 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.576 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.893 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 7.3 p -66.31 67.64 0.05 Allowed 'General case' 0 CA--C 1.523 -0.079 0 CA-C-O 122.276 1.036 . . . . 0.0 109.526 -177.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.061 HG11 ' CB ' ' B' ' 114' ' ' TYR . 7.1 p -69.92 -127.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.848 -178.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.715 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 3.6 t70 83.44 -3.35 1.19 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.914 0.864 . . . . 0.0 109.082 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 38.0 m -127.06 -64.66 0.99 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.358 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.75 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.8 OUTLIER -39.64 -85.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.712 0 O-C-N 123.696 0.623 . . . . 0.0 112.258 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.497 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.6 t 174.64 43.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.364 0.602 . . . . 0.0 110.881 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.061 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.4 OUTLIER -84.06 -42.27 16.31 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.57 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -47.42 -42.24 21.86 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -175.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.764 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -52.54 -49.79 64.18 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 118.996 0.816 . . . . 0.0 111.362 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.899 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.41 -48.98 78.75 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.819 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.571 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -71.27 -26.13 62.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.238 0.542 . . . . 0.0 110.529 179.534 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.16 -24.04 62.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.82 178.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.601 ' O ' ' HB3' ' B' ' 121' ' ' ASP . 10.4 m-30 -87.98 -43.64 11.6 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.601 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 1.9 p-10 121.72 19.36 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.137 0 O-C-N 125.007 1.442 . . . . 0.0 111.81 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 79.2 t -101.7 -40.64 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.25 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.605 ' O ' HD12 ' B' ' 117' ' ' LEU . 5.3 m-80 61.54 -124.96 0.84 Allowed 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.071 HG23 ' HE2' ' A' ' 32' ' ' MET . 0.3 OUTLIER -131.51 3.59 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.425 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.5 OUTLIER -39.43 -64.33 0.48 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.253 -178.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.426 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -87.23 -25.39 33.92 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.387 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.784 HD21 ' HB ' ' A' ' 31' ' ' THR . 6.1 tt -59.38 -61.44 2.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.188 0.518 . . . . 0.0 110.222 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.011 HG13 ' HE3' ' B' ' 132' ' ' MET . 3.4 t -50.67 -63.54 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.443 178.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.726 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 92.4 p -48.58 -46.9 39.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.438 ' CG2' ' N ' ' B' ' 131' ' ' THR . 0.6 OUTLIER -70.17 -48.01 59.14 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.689 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -65.02 -33.72 76.72 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.817 179.949 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.011 ' HE3' HG13 ' B' ' 128' ' ' VAL . 2.1 mmt -56.13 -52.92 62.62 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.187 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -58.16 -36.86 73.64 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.622 0.231 . . . . 0.0 111.622 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . 0.462 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.44 -51.05 13.95 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.774 ' HB3' HD21 ' A' ' 17' ' ' LEU . 12.0 tp10 -67.47 -24.46 65.6 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.965 -0.384 . . . . 0.0 109.965 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.726 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -69.41 -46.28 67.2 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -53.45 12.96 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.853 178.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.47 ' O ' ' C ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER -82.43 -17.8 44.11 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -175.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.597 HD12 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -2.85 95.9 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -179.218 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.49 151.74 19.12 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.205 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.17 63.29 0.7 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.892 0.377 . . . . 0.0 111.517 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 59.35 168.86 0.07 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.63 94.09 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.389 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 43.5 p-90 -170.1 170.21 7.56 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.774 0.321 . . . . 0.0 111.811 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.92 145.54 1.89 Allowed 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.734 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.8 p -125.18 144.2 36.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 120.847 0.356 . . . . 0.0 111.834 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -129.09 130.57 46.66 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -132.3 154.83 49.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.182 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -93.12 131.23 38.35 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.034 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -84.71 150.92 24.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.276 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -143.72 139.56 8.87 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.698 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 26.9 mmt -92.39 162.75 14.12 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.791 0.329 . . . . 0.0 111.269 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -133.89 -77.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.831 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.16 -159.71 0.73 Allowed 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 111.544 0.202 . . . . 0.0 111.544 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 4.5 t -108.43 -122.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.027 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -143.03 -49.52 0.33 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.93 128.54 33.59 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.63 0.253 . . . . 0.0 110.801 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.491 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -162.83 93.72 0.82 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.299 0.571 . . . . 0.0 111.668 -179.587 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 4.1 mt -91.26 -131.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.736 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -135.94 164.27 28.36 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.029 0.443 . . . . 0.0 111.386 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 2.1 ttp -150.77 -60.82 0.19 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.123 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.92 152.23 7.68 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.027 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 102.89 82.3 1.62 Allowed Glycine 0 C--N 1.333 0.386 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.568 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . 0.475 ' O ' ' HB2' ' B' ' 165' ' ' PHE . 6.3 p -67.17 -48.49 67.81 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.475 ' HB2' ' O ' ' B' ' 164' ' ' SER . 39.8 m-85 71.04 172.61 0.31 Allowed 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.365 0.416 . . . . 0.0 111.541 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -157.02 173.94 16.26 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.51 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.78 77.1 0.86 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.219 0.533 . . . . 0.0 111.374 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.52 -174.8 5.37 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.76 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -153.62 168.3 26.65 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.87 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.427 ' HE3' ' HB3' ' B' ' 170' ' ' LYS . 7.7 mtpp -161.29 27.63 0.13 Allowed 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 25.42 83.98 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.81 -1.086 . . . . 0.0 112.952 -178.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.167 0 CA-C-O 118.546 -0.74 . . . . 0.0 111.134 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.442 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.709 0 C5'-C4'-O4' 108.649 -0.469 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.68 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C3'-C2'-C1' 101.685 -0.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.68 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C3'-C2'-C1' 104.47 1.264 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.732 ' H71' ' OE2' ' A' ' 47' ' ' GLU . . . . . . . . 0 C3'--C2' 1.528 0.985 0 C1'-O4'-C4' 107.331 -1.692 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.489 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.404 -1.245 0 C3'-C2'-C1' 105.151 1.751 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.556 ' H73' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O5'--C5' 1.431 -0.54 0 C4'-C3'-C2' 103.94 0.74 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.579 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.556 0 C3'-C2'-C1' 105.06 1.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.579 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 C3'-C2'-C1' 101.474 -0.876 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 C1'-O4'-C4' 110.48 0.557 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.551 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.407 -1.009 0 C4'-C3'-C2' 104.689 1.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.551 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 C1'-O4'-C4' 110.421 0.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 C1'-O4'-C4' 110.493 0.567 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C4'-C3'-C2' 100.97 -2.23 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.402 " C2'" " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 N19-C1'-C2' 115.639 0.9 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.402 " O5'" " C2'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.922 0 C4'-C3'-C2' 104.676 1.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.461 ' P ' ' HD3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 O4'-C1'-C2' 107.411 1.192 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.495 H2'' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.411 -0.724 0 C4'-C3'-C2' 104.736 1.536 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.565 ' C8 ' ' C7 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.937 0 C1'-O4'-C4' 107.456 -1.603 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.565 ' C7 ' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.773 0 C1'-O4'-C4' 106.933 -1.976 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.603 H2'' " O5'" ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C3'-C2'-C1' 106.856 2.968 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.629 H5'' HG11 ' A' ' 53' ' ' VAL . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C3'-C2'-C1' 104.281 1.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.536 ' OP1' HG11 ' A' ' 55' ' ' VAL . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 C1'-O4'-C4' 110.711 0.722 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.493 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.954 0 C1'-O4'-C4' 107.251 -1.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.414 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.628 0 O4'-C1'-C2' 107.26 1.055 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.414 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.5 0.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C5'-C4'-O4' 108.809 -0.369 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.037 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -143.52 140.53 30.32 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.861 0.362 . . . . 0.0 110.45 178.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.64 ' N ' ' HB2' ' B' ' 110' ' ' ASP . 43.2 tp60 -124.96 116.28 21.92 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.148 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.858 ' HG3' HG22 ' B' ' 108' ' ' THR . 2.0 ttm105 -79.11 114.3 17.94 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.668 0.747 . . . . 0.0 111.667 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.949 HD13 ' CD1' ' B' ' 114' ' ' TYR . 4.4 pt -114.62 128.91 71.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.717 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.56 131.73 41.82 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.285 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.715 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.22 103.45 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 106.914 -1.514 . . . . 0.0 106.914 174.208 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.655 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 9.7 p -70.36 69.08 0.37 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.715 0.769 . . . . 0.0 109.837 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.9 HG11 ' HB2' ' A' ' 14' ' ' TYR . 14.3 p -85.89 -135.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.384 -1.28 . . . . 0.0 111.468 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.782 ' H ' HG22 ' A' ' 9' ' ' VAL . 20.4 t70 108.39 20.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 122.171 0.986 . . . . 0.0 109.607 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.552 ' H ' HG22 ' A' ' 9' ' ' VAL . 4.3 t -160.7 -45.69 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.5 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.751 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.4 OUTLIER -79.05 61.39 3.2 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 119.61 -0.836 . . . . 0.0 113.165 -177.317 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.534 ' HB2' ' O ' ' B' ' 129' ' ' SER . 3.7 m 68.19 -7.78 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 177.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.9 ' HB2' HG11 ' A' ' 9' ' ' VAL . 1.1 t80 -50.29 -57.61 7.48 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.674 1.125 . . . . 0.0 110.348 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.582 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 39.5 mt-30 -49.77 -38.81 35.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.878 -178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.79 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.5 mt -51.32 -33.09 27.62 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.942 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.3 OUTLIER -77.67 -52.55 8.79 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.245 0.545 . . . . 0.0 111.317 178.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.691 ' HD3' ' CE2' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -66.28 -25.5 66.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.388 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 -28.21 62.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.411 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.717 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 6.8 m-30 -88.29 -40.78 13.36 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.888 178.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.717 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 120.39 58.58 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 125.203 1.565 . . . . 0.0 109.496 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.8 t -141.71 -48.15 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.04 0 CA-C-N 114.421 -1.263 . . . . 0.0 111.068 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.406 ' OD1' ' HB3' ' A' ' 18' ' ' LYS . 18.3 m-80 67.39 -113.71 0.17 Allowed 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -178.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.053 HG23 ' HE2' ' B' ' 132' ' ' MET . 0.1 OUTLIER -143.04 -1.27 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 178.628 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.621 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 63.0 p -39.52 -64.9 0.43 Allowed 'General case' 0 C--O 1.245 0.853 0 CA-C-N 118.901 0.773 . . . . 0.0 110.468 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.537 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -79.0 -29.11 52.65 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.432 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.919 HD22 ' HG ' ' A' ' 17' ' ' LEU . 16.7 tp -62.41 -58.41 7.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.87 HG23 ' CG2' ' A' ' 24' ' ' ILE . 4.0 t -52.17 -71.39 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.396 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.81 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 93.7 p -47.37 -39.36 15.0 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.3 m -69.67 -48.0 61.32 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.251 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.428 ' HA ' HD22 ' A' ' 34' ' ' ASN . 25.3 m -65.34 -32.13 73.62 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.694 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.801 ' HE2' HG23 ' B' ' 124' ' ' ILE . 11.5 mmt -59.43 -57.42 13.04 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.959 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -55.56 -34.99 65.25 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.547 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.428 HD22 ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -74.73 -49.38 21.26 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 1.107 ' HB3' HD21 ' B' ' 117' ' ' LEU . 3.4 tp10 -72.15 -21.75 61.41 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.083 0.468 . . . . 0.0 109.776 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.612 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -70.38 -45.35 66.18 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.244 0.545 . . . . 0.0 109.628 178.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.71 -55.02 5.12 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.883 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.17 -35.98 58.9 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.895 -1.048 . . . . 0.0 113.747 -176.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.668 HD23 ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER 28.6 50.56 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.599 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 171.39 107.17 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.622 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -133.37 148.81 51.85 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.181 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -74.84 -159.92 0.1 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.683 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -149.26 81.27 1.42 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.435 ' CE3' ' HA ' ' A' ' 44' ' ' TRP . 1.3 t-105 -112.18 162.78 15.08 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.852 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -88.57 -68.88 0.74 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.874 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.413 HG13 ' O ' ' A' ' 46' ' ' VAL . 7.4 p 32.1 76.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.14 0.576 . . . . 0.0 112.403 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -157.7 110.75 2.46 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.437 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 169.18 59.89 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.123 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -140.4 154.25 46.63 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.11 0.481 . . . . 0.0 111.79 -179.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.68 87.49 2.46 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.741 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.68 -131.67 4.26 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.749 -0.738 . . . . 0.0 113.283 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.51 ' HA ' ' O ' ' B' ' 142' ' ' GLU . 0.9 OUTLIER -151.19 141.78 22.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.486 0.184 . . . . 0.0 110.908 -179.759 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.594 HG21 HG23 ' B' ' 146' ' ' VAL . 0.6 OUTLIER 58.99 -157.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.71 -179.703 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.534 ' H ' HG12 ' A' ' 53' ' ' VAL . 1.0 OUTLIER -167.16 138.99 3.28 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 122.178 -0.326 . . . . 0.0 111.374 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.617 HG21 ' HB2' ' B' ' 147' ' ' GLU . 6.7 t -110.0 -6.04 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 66.22 101.51 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.28 133.92 50.23 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.822 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -177.94 104.38 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.133 0.492 . . . . 0.0 111.779 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.1 mt -91.96 -36.81 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.669 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 56.62 -102.21 0.15 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.77 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 76.06 150.57 0.11 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.072 0.463 . . . . 0.0 111.604 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -138.16 145.62 41.76 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.443 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -90.35 -107.78 1.33 Allowed Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.627 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.0 m -179.81 166.86 1.34 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.699 0.285 . . . . 0.0 111.405 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.2 t80 77.54 153.1 0.14 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.958 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -161.47 131.52 4.9 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.099 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -111.63 69.08 0.68 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.039 0.447 . . . . 0.0 111.821 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.24 -173.99 0.13 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.385 179.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.07 144.67 47.35 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.151 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.424 ' NZ ' ' O ' ' A' ' 72' ' ' TRP . 0.0 OUTLIER 177.34 39.75 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 121.562 0.696 . . . . 0.0 109.165 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 35.59 67.4 0.28 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.112 -1.403 . . . . 0.0 112.823 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.424 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 44.0 m95 . . . . . 0 C--O 1.252 1.214 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.863 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 N-CA-C 111.401 0.148 . . . . 0.0 111.401 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.42 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 7.4 mptt -97.23 160.82 14.11 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.733 0.302 . . . . 0.0 110.937 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.727 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 7.7 tt0 -97.22 108.87 21.69 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.237 0.542 . . . . 0.0 110.942 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.757 ' NH2' HG21 ' B' ' 106' ' ' THR . 0.3 OUTLIER -78.34 99.09 6.2 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.428 0.632 . . . . 0.0 110.163 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.863 HD11 HG11 ' B' ' 128' ' ' VAL . 3.9 pt -100.34 126.93 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.757 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -131.75 122.85 26.53 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -175.669 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.732 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.01 106.73 19.94 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 175.499 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.858 HG22 ' HG3' ' A' ' 4' ' ' ARG . 76.8 p -70.07 98.7 1.35 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.908 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.73 -124.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.85 -178.22 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.64 ' HB2' ' N ' ' A' ' 3' ' ' GLN . 26.0 t0 95.84 9.99 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 122.098 0.952 . . . . 0.0 108.845 -175.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.4 t -164.51 -43.13 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.058 -1.428 . . . . 0.0 111.985 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.829 ' HB2' HG12 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -68.47 52.58 0.08 Allowed 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -177.153 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.632 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.1 m 56.03 7.97 0.34 Allowed 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 178.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.949 ' CD1' HD13 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -63.99 -54.6 31.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.973 0.416 . . . . 0.0 111.491 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.578 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.7 OUTLIER -48.95 -34.17 12.39 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.609 -176.421 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.609 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -52.15 -56.19 16.12 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.145 0.498 . . . . 0.0 110.781 178.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 1.107 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.5 OUTLIER -55.11 -50.85 68.18 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.031 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.606 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -71.85 -25.6 62.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.36 -179.386 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -58.1 -26.03 62.09 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.063 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.686 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 4.6 m-30 -88.27 -44.43 10.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.65 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.686 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.8 m-20 129.68 38.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.884 1.365 . . . . 0.0 111.284 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 91.0 t -122.74 -44.11 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.679 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.011 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.436 ' OD1' ' HE1' ' B' ' 114' ' ' TYR . 0.6 OUTLIER 61.55 -132.61 0.65 Allowed 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 -178.253 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.016 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -134.07 8.48 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.744 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.516 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.9 OUTLIER -39.72 -63.99 0.53 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 120.235 -0.586 . . . . 0.0 109.944 -178.023 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.474 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.0 -30.78 13.4 Favored Glycine 0 C--O 1.225 -0.439 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.712 177.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.822 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -52.57 -61.11 2.49 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.638 0.375 . . . . 0.0 110.61 179.038 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.016 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.4 t -54.27 -64.35 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.166 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.544 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.751 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 4.9 p -49.22 -44.8 43.71 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.75 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.474 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 1.3 m -69.91 -53.72 16.67 Favored 'General case' 0 CA--C 1.511 -0.551 0 O-C-N 121.767 -0.583 . . . . 0.0 109.843 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.5 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -57.9 -37.81 74.7 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.52 -179.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.053 ' HE2' HG23 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -49.19 -46.46 45.58 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.328 179.138 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -48.37 80.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.584 0.23 . . . . 0.0 111.35 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -58.14 -56.54 20.73 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.485 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.579 ' O ' HD12 ' B' ' 139' ' ' LEU . 1.7 mm-40 -59.98 -40.13 88.06 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.79 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -60.04 -44.33 94.73 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.605 178.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -56.51 7.7 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.315 0.579 . . . . 0.0 111.339 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' B' ' 140' ' ' ARG . 0.0 OUTLIER -68.05 -18.02 64.56 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.125 -177.39 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.713 HD13 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -54.8 75.6 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -179.548 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.479 ' N ' ' O ' ' B' ' 138' ' ' ARG . 0.2 OUTLIER -174.84 -59.29 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.417 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -179.68 154.87 0.62 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.966 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.51 ' O ' ' HA ' ' A' ' 52' ' ' MET . 0.4 OUTLIER -108.06 111.04 22.88 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.865 0.364 . . . . 0.0 111.22 -179.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.51 ' HB3' ' O ' ' A' ' 53' ' ' VAL . 0.0 OUTLIER 77.7 -161.6 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.37 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.481 ' CD1' ' HG2' ' B' ' 145' ' ' LYS . 0.1 OUTLIER -168.4 140.2 2.79 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -178.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.481 ' HG2' ' CD1' ' B' ' 144' ' ' TRP . 3.6 mmtp 73.01 96.1 0.07 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.995 179.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.594 HG23 HG21 ' A' ' 53' ' ' VAL . 8.7 p -102.94 127.43 56.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.052 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.617 ' HB2' HG21 ' A' ' 55' ' ' VAL . 1.0 OUTLIER -155.13 155.0 33.2 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.201 -179.601 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 178.39 101.63 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.703 0.287 . . . . 0.0 111.68 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -135.37 107.76 7.32 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.898 0.38 . . . . 0.0 111.162 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.16 170.81 15.96 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.756 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 167.86 158.61 12.21 Favored Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.425 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 1.6 mtm -145.89 166.07 27.05 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 120.734 0.302 . . . . 0.0 111.227 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 9.6 p -152.5 153.46 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.635 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -116.24 -171.5 2.01 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.09 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 2.9 t -117.47 -125.59 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.631 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -179.88 102.38 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.871 0.367 . . . . 0.0 111.454 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -98.21 130.07 44.95 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.212 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -178.05 105.35 0.05 OUTLIER 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.09 0.471 . . . . 0.0 110.735 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -105.73 -132.35 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.805 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -147.74 167.18 25.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 32.2 ttp -128.19 -48.22 1.33 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.331 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.3 -167.65 0.19 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.711 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 175.83 -176.79 47.6 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 120.692 -0.765 . . . . 0.0 113.129 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.2 m -178.17 162.45 1.58 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.624 0.25 . . . . 0.0 111.358 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -154.9 170.39 21.8 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.262 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -145.16 172.53 12.98 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.989 0.424 . . . . 0.0 111.595 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -97.73 -125.43 0.14 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.437 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -147.16 24.98 1.13 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' B' ' 170' ' ' LYS . 0.1 OUTLIER 56.01 -93.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 122.615 0.366 . . . . 0.0 111.962 179.533 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.489 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 0.1 OUTLIER 169.16 -30.28 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.423 0.63 . . . . 0.0 109.352 -179.654 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 15.7 m-20 76.66 -87.58 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.016 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 2.8 t-105 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.594 -0.717 . . . . 0.0 111.052 179.196 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.487 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-N19 108.193 0.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.667 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.494 0 C4'-C3'-C2' 102.52 -0.68 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.667 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.433 -0.443 0 C3'-C2'-C1' 104.512 1.294 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.655 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.742 0 C4'-C3'-C2' 104.293 1.093 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.516 ' OP1' ' HB2' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.427 -0.792 0 C3'-C2'-C1' 104.218 1.084 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.496 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.804 0 C4'-C3'-C2' 104.721 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.669 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.559 0 C3'-C2'-C1' 104.704 1.432 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.768 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.613 0 C3'-C2'-C1' 101.007 -1.209 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.768 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C1'-O4'-C4' 110.649 0.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.642 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.826 0 C3'-C2'-C1' 104.951 1.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.642 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 O4'-C1'-C2' 106.799 0.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.446 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.709 0 N19-C1'-C2' 115.065 0.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 C4'-C3'-C2' 100.896 -2.304 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 N19-C1'-C2' 115.347 0.717 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.595 0 C3'-C2'-C1' 105.227 1.805 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.486 " H2'" " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 C4'-C3'-C2' 102.637 -0.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.615 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C4'-C3' 103.822 -1.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.621 ' OP1' ' HA ' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.409 -0.852 0 C4'-C3'-C2' 104.607 1.407 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.709 ' H72' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 C2'--C1' 1.512 -0.657 0 C5'-C4'-O4' 108.316 -0.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.45 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.703 0 C3'-C2'-C1' 105.184 1.774 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.505 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 N19-C1'-C2' 115.525 0.828 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.877 0 C3'-C2'-C1' 105.148 1.748 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.894 0 C4'-C3'-C2' 104.552 1.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.647 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 O4'-C1'-C2' 107.037 0.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.647 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 N19-C1'-C2' 115.459 0.787 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 102.143 -0.398 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.828 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.473 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 11.1 mmtm -36.79 129.6 0.81 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.254 0.346 . . . . 0.0 111.509 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.4 tp60 -101.75 118.46 36.98 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.631 0.729 . . . . 0.0 112.087 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.931 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.39 101.03 7.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.94 -179.532 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.917 HD13 ' CD2' ' B' ' 114' ' ' TYR . 8.3 pt -104.52 128.79 57.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.788 HG21 ' CZ ' ' B' ' 104' ' ' ARG . 0.2 OUTLIER -131.56 124.59 30.35 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.882 -177.273 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.925 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -101.25 105.0 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 174.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.469 ' OG1' ' C6 ' ' C' ' 176' ' ' ' DT' . 9.9 p -69.14 87.77 0.41 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -178.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.925 HG22 HG22 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -86.78 -139.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.16 -178.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.67 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 2.4 t70 87.22 -5.15 0.64 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -175.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.53 -67.7 0.94 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.117 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.848 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 1.1 m-20 -49.55 -87.45 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m -177.43 42.48 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.174 0.897 . . . . 0.0 111.751 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.982 ' CD1' HD13 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -82.53 -44.56 15.76 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.664 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.1 mp0 -49.67 -40.39 39.71 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -176.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.735 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.2 OUTLIER -57.09 -54.0 51.77 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.736 0.698 . . . . 0.0 111.995 -179.503 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.881 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -49.54 -48.06 48.6 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.282 0.563 . . . . 0.0 111.387 -178.871 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.664 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.13 -30.41 43.68 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.045 179.274 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -63.78 -27.43 69.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.175 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.097 ' CB ' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.69 -44.77 10.93 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-O 118.765 -0.636 . . . . 0.0 109.399 178.816 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.604 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 157.28 16.46 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 177.028 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.515 ' O ' HD12 ' A' ' 17' ' ' LEU . 70.9 t -156.85 90.37 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 118.265 0.484 . . . . 0.0 111.973 -177.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.578 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 0.1 OUTLIER -56.78 -100.1 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.338 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.013 HG23 ' HE2' ' B' ' 132' ' ' MET . 0.3 OUTLIER -139.97 1.26 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.537 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 88.0 p -41.89 -65.26 0.47 Allowed 'General case' 0 C--O 1.239 0.519 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.866 -178.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.93 -25.88 43.54 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.813 177.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.746 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -62.17 -59.41 5.08 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.945 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -52.77 -66.25 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.713 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.779 ' HB3' ' HB3' ' B' ' 112' ' ' ASP . 18.1 p -48.74 -35.59 14.51 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 52.5 m -72.88 -56.26 5.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 28' ' ' VAL . 3.1 t -58.74 -36.64 74.67 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.126 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 1.092 ' SD ' HD12 ' B' ' 117' ' ' LEU . 0.0 OUTLIER -55.53 -55.37 32.65 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.641 178.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -56.19 -53.49 56.52 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.589 0.233 . . . . 0.0 110.782 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -57.69 -46.91 83.69 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB3' HD11 ' B' ' 117' ' ' LEU . 3.2 tp10 -70.23 -19.89 63.12 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.353 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.738 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -77.38 -44.48 29.17 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -54.74 7.61 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.564 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.33 -36.46 24.39 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.741 -176.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.535 HD21 HG11 ' B' ' 122' ' ' VAL . 0.3 OUTLIER 36.46 46.92 0.46 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.812 0.445 . . . . 0.0 112.178 -178.366 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -177.69 48.86 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.046 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -77.8 153.16 33.09 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.055 0.455 . . . . 0.0 112.018 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -93.37 173.32 7.77 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.686 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.73 122.66 48.41 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.657 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -99.94 164.57 11.95 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.803 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.88 135.58 26.18 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.888 0.375 . . . . 0.0 111.654 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.493 ' H ' ' HG3' ' B' ' 137' ' ' ARG . 12.5 t -153.79 154.35 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.551 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -61.91 151.93 33.38 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.593 0.235 . . . . 0.0 110.658 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -74.62 -80.1 0.08 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.46 -179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.526 ' O ' ' HB3' ' B' ' 141' ' ' ALA . 0.0 OUTLIER 56.3 86.94 0.06 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -100.17 128.76 46.18 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.189 0.518 . . . . 0.0 111.652 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.53 -167.12 24.88 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.859 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.577 ' O ' ' HB ' ' A' ' 53' ' ' VAL . 0.7 OUTLIER -125.66 -72.82 0.65 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.557 0.178 . . . . 0.0 111.156 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.577 ' HB ' ' O ' ' A' ' 52' ' ' MET . 14.6 p 165.3 151.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 120.964 0.411 . . . . 0.0 111.622 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.424 ' HB3' ' CE3' ' B' ' 144' ' ' TRP . 8.7 pt-20 -122.77 139.32 54.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.662 178.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.0 t -135.16 -122.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 121.227 -0.189 . . . . 0.0 111.466 -178.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 67.85 73.57 0.31 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.109 0.48 . . . . 0.0 111.645 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -141.52 139.93 33.36 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.173 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -159.11 97.84 1.41 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.6 0.714 . . . . 0.0 110.818 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 27.8 mm -141.81 82.83 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.106 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -135.52 65.92 1.53 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.833 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 12.4 ptm -159.77 167.63 27.79 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.504 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 76.9 165.96 0.25 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.693 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -148.72 -134.54 2.41 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.819 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.5 t -173.43 -161.73 0.14 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.659 0.229 . . . . 0.0 111.44 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 71.07 -179.49 0.23 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.725 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -132.26 36.7 3.6 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.792 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.39 72.53 10.22 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.085 0.469 . . . . 0.0 110.181 179.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 64.87 -171.05 0.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.348 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.443 ' O ' ' HB3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -175.12 -87.33 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER 176.43 -31.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.196 0.522 . . . . 0.0 109.896 -179.33 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 85.2 -53.9 0.09 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.572 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.6 m0 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.262 179.767 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.483 ' O ' ' C ' ' B' ' 102' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 111.381 0.141 . . . . 0.0 111.381 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.483 ' C ' ' O ' ' B' ' 101' ' ' MET . 0.0 OUTLIER -7.56 100.22 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -179.502 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.67 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 17.1 tt0 -98.41 115.18 27.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.799 178.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.788 ' CZ ' HG21 ' A' ' 6' ' ' THR . 28.7 ttt-85 -77.52 101.93 6.7 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.226 -0.589 . . . . 0.0 110.461 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.982 HD13 ' CD1' ' A' ' 14' ' ' TYR . 1.8 pt -102.62 130.21 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.657 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.77 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.4 OUTLIER -131.26 121.59 25.04 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.056 -0.657 . . . . 0.0 111.823 -176.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.67 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.8 OUTLIER -101.28 91.59 2.13 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.085 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 176.127 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.931 HG22 ' HG3' ' A' ' 4' ' ' ARG . 31.9 p -60.85 90.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.505 0.669 . . . . 0.0 110.385 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.018 HG21 ' CD1' ' B' ' 114' ' ' TYR . 31.6 m -87.5 -148.16 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.885 -177.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 23.7 t70 96.04 -10.33 0.09 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.371 1.069 . . . . 0.0 108.342 -176.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.417 ' HG ' ' HZ2' ' A' ' 2' ' ' LYS . 58.4 m -118.15 -62.9 1.49 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.779 ' HB3' ' HB3' ' A' ' 29' ' ' SER . 0.4 OUTLIER -42.03 -92.69 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.662 0.601 . . . . 0.0 112.34 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.48 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.2 m -180.0 41.18 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.724 -0.61 . . . . 0.0 110.765 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.018 ' CD1' HG21 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -83.04 -45.2 14.32 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.617 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.7 mp0 -49.18 -45.27 43.83 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.738 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -51.8 -28.02 14.22 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.759 0.709 . . . . 0.0 112.356 -179.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 1.092 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.6 OUTLIER -78.33 -57.25 3.88 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 120.113 -0.635 . . . . 0.0 111.329 178.111 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -62.36 -25.43 67.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.337 178.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.39 -27.06 34.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.004 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.62 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.5 m-30 -88.18 -49.56 6.93 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.644 178.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.9 m-20 139.4 46.14 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 O-C-N 124.407 1.067 . . . . 0.0 110.675 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.743 ' O ' HG13 ' B' ' 122' ' ' VAL . 4.0 p -163.14 89.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.725 0.774 . . . . 0.0 110.783 -178.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.725 ' O ' ' HE1' ' A' ' 32' ' ' MET . 74.6 m-80 -58.41 -98.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.722 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.091 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -152.55 9.73 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.546 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 2.1 p -39.59 -64.7 0.45 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.144 -177.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.609 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -89.13 -28.5 20.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.705 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -55.48 -61.43 2.35 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.485 0.314 . . . . 0.0 110.783 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.091 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -53.59 -62.7 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.602 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.808 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.848 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 2.3 p -50.13 -43.69 51.99 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.609 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.5 OUTLIER -70.16 -50.27 42.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 179.457 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.442 ' N ' ' CG2' ' B' ' 130' ' ' THR . 54.8 m -55.9 -43.46 77.29 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.51 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.013 ' HE2' HG23 ' A' ' 24' ' ' ILE . 4.6 mtt -61.08 -57.63 11.74 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.897 178.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -40.39 37.21 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.067 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -56.04 12.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.242 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.566 ' HB2' HD21 ' A' ' 17' ' ' LEU . 14.0 mm-40 -69.41 -13.45 62.37 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.544 0.211 . . . . 0.0 111.293 178.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.735 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -86.49 -38.18 17.52 Favored 'General case' 0 C--O 1.227 -0.1 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.493 ' HG3' ' H ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -72.75 -47.61 45.4 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.506 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.3 ttp85 -55.83 -29.47 59.87 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.075 -1.42 . . . . 0.0 110.613 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.097 HD11 ' CB ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -35.81 96.06 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.8 0.84 . . . . 0.0 111.521 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.2 123.68 24.14 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -178.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 49' ' ' GLN . . . -164.5 -174.14 3.33 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.438 ' HA ' ' NE2' ' A' ' 49' ' ' GLN . 0.4 OUTLIER -135.99 -98.92 0.22 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -179.407 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.409 ' NE ' ' OE1' ' A' ' 49' ' ' GLN . 9.1 mtm180 -162.19 126.28 3.17 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.493 0.187 . . . . 0.0 111.366 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.424 ' CE3' ' HB3' ' A' ' 54' ' ' GLU . 2.5 t90 69.7 132.3 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.704 179.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.503 ' HG3' ' HB2' ' A' ' 52' ' ' MET . 0.2 OUTLIER -161.31 116.58 2.09 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -152.34 154.79 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.804 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.54 173.9 14.14 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.969 0.414 . . . . 0.0 112.041 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -161.5 105.71 1.28 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.689 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.8 pm0 -102.95 138.29 40.02 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.683 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -149.6 164.8 34.15 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.185 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 152.57 126.55 1.2 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 120.838 -0.696 . . . . 0.0 113.104 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.7 ttt -153.28 134.12 13.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.512 0.196 . . . . 0.0 111.096 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 32.7 t -141.94 140.22 30.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.784 0.326 . . . . 0.0 111.505 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -153.91 154.35 33.7 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.971 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.524 ' O ' ' HB2' ' B' ' 156' ' ' ALA . 3.3 t -131.4 -125.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 116.741 -0.209 . . . . 0.0 110.764 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' B' ' 155' ' ' VAL . . . 168.68 105.99 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 122.73 0.412 . . . . 0.0 111.253 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -90.56 153.65 20.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.221 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -164.22 98.42 0.82 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.29 0.567 . . . . 0.0 111.271 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 9.9 mm -120.87 95.31 3.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.428 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -134.71 167.06 21.53 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.072 0.463 . . . . 0.0 111.985 -179.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 20.1 ttp -148.8 -53.63 0.18 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.026 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 70.92 -178.65 0.22 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.915 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 156.74 165.06 14.22 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.574 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.4 t -155.19 148.36 24.79 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.812 0.339 . . . . 0.0 111.684 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -171.85 143.5 1.64 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.876 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -153.07 117.95 5.08 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.347 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -72.6 -53.13 12.72 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.344 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 55.32 36.31 26.79 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.038 0.447 . . . . 0.0 111.565 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -115.12 121.66 43.73 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.483 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.467 ' NZ ' ' O ' ' B' ' 172' ' ' TRP . 10.2 tptt -167.34 -39.12 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 9.1 t70 79.74 -68.69 0.12 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.326 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.467 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.267 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.008 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 C5'-C4'-O4' 108.701 -0.437 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.576 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C3'-C2'-C1' 101.346 -0.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.576 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 C3'-C2'-C1' 104.232 1.094 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.47 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.802 0 C3'-C2'-C1' 104.914 1.582 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.546 ' P ' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O4'--C1' 1.408 -0.93 0 C3'-C2'-C1' 105.11 1.721 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.535 ' C7 ' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.776 0 C4'-C3'-C2' 104.69 1.49 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.721 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 C3'-C2'-C1' 104.221 1.086 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.613 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 C3'-C2'-C1' 100.826 -1.339 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.43 ' C8 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C1'-O4'-C4' 110.903 0.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.54 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 105.488 1.991 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.54 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 O4'-C1'-C2' 107.2 1.0 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.504 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C1'-O4'-C4' 110.388 0.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C4'-C3'-C2' 100.878 -2.322 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.458 H2'' ' OP1' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 O4'-C1'-C2' 107.289 1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.458 ' OP1' H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 OP1-P-O3' 110.545 0.983 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.495 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.755 0 C4'-C3'-C2' 102.119 -1.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.765 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.43 0.79 0 O4'-C4'-C3' 103.99 -1.61 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.929 ' C8 ' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.921 0 C1'-O4'-C4' 107.727 -1.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.929 ' H72' ' C8 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C4'-C3'-C2' 103.989 0.789 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.473 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C3'-C2'-C1' 106.358 2.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.526 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.674 0 C1'-O4'-C4' 110.345 0.461 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.472 ' C5 ' ' C5 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 C4'-C3'-C2' 104.301 1.101 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.472 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.99 0 C1'-O4'-C4' 107.108 -1.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.484 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 104.412 1.212 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.882 0 O4'-C1'-C2' 104.749 -1.229 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.571 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.659 0 C1'-O4'-C4' 110.333 0.452 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.611 ' HG3' ' HG2' ' A' ' 2' ' ' LYS . 9.6 ptm . . . . . 0 N--CA 1.498 1.93 0 CA-C-O 119.685 -0.198 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.611 ' HG2' ' HG3' ' A' ' 1' ' ' MET . 36.3 mmtt 79.88 174.41 0.14 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.485 0.314 . . . . 0.0 110.5 -179.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.621 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.5 OUTLIER -102.72 101.8 11.93 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.711 0.767 . . . . 0.0 112.07 -179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.89 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.2 ttp-105 -79.68 98.85 7.13 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.919 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 1.113 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -107.42 108.77 26.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.727 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 177.264 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.63 HG22 ' HB ' ' B' ' 106' ' ' THR . 0.1 OUTLIER -103.77 123.9 47.91 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.068 -176.33 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.691 HG22 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -100.63 105.83 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.2 p -70.23 90.63 0.69 Allowed 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.013 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.942 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.7 t -83.28 -134.64 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.494 -178.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 26.8 t70 90.56 -5.79 0.3 Allowed 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.23 -58.56 0.59 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.27 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.734 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.4 OUTLIER -43.65 -92.08 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.51 ' O ' ' HB2' ' B' ' 132' ' ' MET . 0.6 OUTLIER -179.02 37.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 119.388 0.995 . . . . 0.0 112.034 -179.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.942 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.76 -43.75 16.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.083 0.953 . . . . 0.0 112.56 179.472 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.626 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 38.6 mt-30 -50.05 -44.12 51.4 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -177.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.924 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.2 mt -48.1 -30.4 4.46 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 118.267 0.485 . . . . 0.0 112.291 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.8 ' HG ' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -78.26 -57.35 3.83 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.408 177.518 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.626 ' CG ' ' HA ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -63.18 -25.49 68.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.842 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.428 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.76 -26.31 33.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.335 178.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.922 ' CD2' HD22 ' B' ' 139' ' ' LEU . 9.6 m-30 -87.85 -40.62 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.557 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 20.3 t0 120.91 59.25 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 122.34 1.067 . . . . 0.0 111.086 177.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.7 ' CG1' HD12 ' A' ' 17' ' ' LEU . 8.1 p -151.49 92.88 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 113.761 -1.563 . . . . 0.0 109.852 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.888 ' O ' HD12 ' A' ' 24' ' ' ILE . 1.7 m120 -65.75 48.8 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.46 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.05 HG21 ' SD ' ' B' ' 132' ' ' MET . 1.3 pp 31.68 9.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.642 ' HA ' HG22 ' B' ' 107' ' ' VAL . 67.2 m -36.47 -63.06 0.42 Allowed 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.036 0.446 . . . . 0.0 111.252 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -17.38 70.27 Favored Glycine 0 C--N 1.335 0.493 0 CA-C-N 115.848 -0.614 . . . . 0.0 112.62 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.788 ' CB ' HG22 ' A' ' 24' ' ' ILE . 2.3 tm? -67.54 -61.21 2.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.749 HG22 HG22 ' B' ' 128' ' ' VAL . 87.2 t -45.02 -67.67 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.361 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.565 ' HA ' ' HG2' ' A' ' 32' ' ' MET . 1.2 p -48.43 -36.92 15.81 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.581 0.752 . . . . 0.0 112.396 178.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.6 m -68.54 -52.75 28.55 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.421 HG21 HG21 ' B' ' 131' ' ' THR . 15.7 m -55.95 -35.71 66.98 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.756 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.864 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 1.3 mmt -56.94 -55.03 39.91 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.983 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.533 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -56.09 -49.91 72.5 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.745 0.307 . . . . 0.0 111.259 179.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -59.6 -51.44 69.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.871 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.815 ' HB3' HD11 ' B' ' 117' ' ' LEU . 5.2 tp10 -74.13 -14.89 61.03 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.392 178.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.959 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -84.26 -32.7 24.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 177.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -52.03 13.31 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.772 0.796 . . . . 0.0 109.475 178.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.427 ' NE ' ' HB3' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -82.96 -40.21 20.36 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.506 -178.147 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.876 HD23 ' CD2' ' B' ' 120' ' ' TYR . 1.2 mp 46.46 61.49 2.74 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.233 0.613 . . . . 0.0 110.933 -178.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.427 ' HB3' ' NE ' ' A' ' 38' ' ' ARG . 0.1 OUTLIER 173.61 76.39 0.0 OUTLIER 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.88 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -142.56 130.39 21.65 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 112.039 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -143.93 132.17 21.91 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.173 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.543 ' O ' HG23 ' B' ' 130' ' ' THR . 1.4 ptm180 -172.08 115.56 0.35 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.554 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -146.63 125.53 12.73 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.883 0.373 . . . . 0.0 111.509 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.22 127.35 0.56 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.31 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.3 t 77.67 150.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 121.248 0.547 . . . . 0.0 111.904 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -142.42 -175.62 4.52 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.73 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.487 ' OD1' ' HG ' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -152.5 140.15 19.83 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 120.789 0.328 . . . . 0.0 111.325 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.542 ' O ' ' CB ' ' A' ' 50' ' ' GLU . 0.3 OUTLIER -95.16 -174.38 3.21 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.41 179.042 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.542 ' CB ' ' O ' ' A' ' 49' ' ' GLN . 1.1 pp20? 113.9 164.29 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.896 1.279 . . . . 0.0 112.008 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 170.9 154.59 9.75 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.951 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.68 -175.89 3.26 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.344 0.257 . . . . 0.0 110.907 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.7 m -134.32 134.02 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 120.795 0.331 . . . . 0.0 111.723 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -120.61 144.39 48.15 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.061 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.481 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 3.8 t -128.13 -123.87 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.017 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 55' ' ' VAL . . . 75.06 103.99 0.07 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.011 0.434 . . . . 0.0 111.449 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -101.6 138.4 38.64 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.88 0.371 . . . . 0.0 111.795 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -178.38 106.86 0.05 OUTLIER 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.763 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 35.1 mm -131.5 102.79 6.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.494 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.499 ' HB3' ' OP1' ' C' ' 182' ' ' ' DC' . 1.5 tt0 -139.66 122.17 16.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.715 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.53 156.66 46.41 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.372 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -102.34 177.04 4.98 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.38 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -94.51 -147.0 21.7 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.968 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 82.9 p -165.12 174.77 9.99 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.719 0.295 . . . . 0.0 111.028 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.34 151.76 35.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.035 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.9 145.74 44.42 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.414 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.79 -72.53 0.71 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 53.19 70.39 0.59 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.011 0.434 . . . . 0.0 111.727 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -104.71 179.4 4.28 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.194 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -162.1 -42.07 0.04 OUTLIER 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 69.73 -65.89 0.29 Allowed 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 113.92 -1.491 . . . . 0.0 112.015 178.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 2.4 m0 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.891 179.883 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.458 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.481 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 1.4 mmpt? 74.18 127.97 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 122.678 0.391 . . . . 0.0 110.868 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.774 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 4.5 tp60 -115.27 116.52 28.45 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.208 0.528 . . . . 0.0 110.648 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.453 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.02 111.08 14.86 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.083 -178.607 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.862 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -115.31 118.84 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 175.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.662 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -123.98 131.19 53.53 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 120.285 -0.566 . . . . 0.0 111.722 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.691 HG12 HG12 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -101.23 86.45 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.89 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 68.2 p -64.88 77.1 0.05 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 -179.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.723 HG11 ' HB2' ' B' ' 114' ' ' TYR . 7.2 p -108.92 -120.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.893 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.621 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 1.1 t70 94.47 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 122.963 1.363 . . . . 0.0 109.506 -176.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.672 ' H ' HG22 ' B' ' 109' ' ' VAL . 45.7 t -154.46 -52.45 0.09 Allowed 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 112.507 -2.133 . . . . 0.0 111.845 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.523 ' O ' ' HB2' ' A' ' 29' ' ' SER . 55.1 m-20 -75.33 54.14 0.7 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -177.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.533 ' OG ' ' HB2' ' A' ' 33' ' ' GLN . 2.4 m 70.48 -3.31 1.92 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.113 ' CE1' HG21 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -55.1 -53.92 49.75 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.482 0.583 . . . . 0.0 111.204 179.491 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.541 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 14.3 mt-30 -49.85 -42.79 48.28 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -177.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.959 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -52.09 -31.38 30.32 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.428 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.815 HD11 ' HB3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -77.75 -53.69 7.23 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.603 179.403 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -66.6 -28.11 68.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -58.57 -29.87 66.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.213 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.876 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -88.5 -43.02 11.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.372 179.051 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.607 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.6 OUTLIER 151.39 31.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 176.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.501 HG23 ' O ' ' B' ' 121' ' ' ASP . 74.5 t -162.37 97.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.407 0.146 . . . . 0.0 111.08 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.801 ' O ' ' HE1' ' A' ' 32' ' ' MET . 0.2 OUTLIER -61.1 -83.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 178.09 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.023 HD11 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -165.2 3.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 178.543 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.712 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 7.0 p -38.24 -63.74 0.47 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.39 0.995 . . . . 0.0 111.19 -177.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -84.81 -29.47 29.0 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.195 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.712 HD22 HD22 ' B' ' 117' ' ' LEU . 14.2 tp -59.72 -59.87 4.75 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.956 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.0 t -50.97 -59.69 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.734 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.1 m -50.03 -40.32 44.53 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.543 HG23 ' O ' ' A' ' 43' ' ' ARG . 17.7 m -71.07 -53.01 16.18 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.536 HG22 ' HA ' ' B' ' 128' ' ' VAL . 4.9 t -59.6 -36.97 77.34 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.857 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.05 ' SD ' HG21 ' A' ' 24' ' ' ILE . 3.5 mmt -60.6 -58.3 9.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.892 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.487 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 1.8 tt0 -55.67 -39.99 71.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.445 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.05 -49.63 55.74 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.311 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.478 ' OE1' ' HA ' ' B' ' 135' ' ' GLU . 3.7 mm-40 -69.87 -26.99 64.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.924 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -63.93 -48.17 77.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 176.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -53.92 49.0 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.276 -0.875 . . . . 0.0 108.833 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -38.5 60.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.289 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.922 HD22 ' CD2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -51.67 -22.32 3.35 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.286 178.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.547 ' HB2' ' O ' ' B' ' 139' ' ' LEU . 24.8 mmt85 86.85 111.92 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.595 0.758 . . . . 0.0 112.118 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -145.15 90.73 2.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.77 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -149.52 -69.09 0.21 Allowed 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.654 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.515 ' HD3' ' C ' ' B' ' 143' ' ' ARG . 0.0 OUTLIER 69.65 -59.85 0.49 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.499 -179.246 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.5 ' HB2' ' HD3' ' B' ' 143' ' ' ARG . 0.3 OUTLIER 173.99 -177.4 0.08 Allowed 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.679 0.276 . . . . 0.0 111.212 -179.48 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 79.98 139.95 0.07 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.132 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -154.83 -56.53 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.335 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 50.03 -152.46 0.16 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.75 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -125.74 145.81 50.03 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.617 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -66.9 169.47 8.1 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 120.923 0.392 . . . . 0.0 111.268 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . 0.435 ' HG2' ' N ' ' B' ' 151' ' ' GLY . 1.7 pm0 -64.98 -39.08 92.94 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.532 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . 0.435 ' N ' ' HG2' ' B' ' 150' ' ' GLU . . . 94.59 -93.66 1.68 Allowed Glycine 0 C--N 1.335 0.483 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.117 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.43 166.31 31.28 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.661 0.267 . . . . 0.0 111.318 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 66.6 t -142.06 120.22 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.486 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -62.18 122.02 14.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.88 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.409 ' O ' ' HB3' ' B' ' 156' ' ' ALA . 2.1 t -76.59 -3.69 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' B' ' 155' ' ' VAL . . . 70.8 29.57 3.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.653 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.86 112.08 13.08 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.08 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -118.5 28.62 8.22 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 111.663 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.478 HG22 ' N ' ' B' ' 160' ' ' GLU . 55.7 mt -145.02 -109.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.606 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . 0.478 ' N ' HG22 ' B' ' 159' ' ' ILE . 0.9 OUTLIER -168.2 159.98 11.29 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.917 0.389 . . . . 0.0 111.197 -179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 3.5 mtm -126.91 -52.56 1.43 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.32 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 174.9 70.73 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.75 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -114.54 70.3 0.25 Allowed Glycine 0 C--N 1.333 0.374 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.936 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 23.3 t -145.12 -164.45 1.94 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.771 0.319 . . . . 0.0 111.32 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -125.53 101.4 6.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.266 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -168.89 -78.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.889 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 62.1 -71.71 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 69.26 169.44 0.29 Allowed 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.185 0.517 . . . . 0.0 111.292 -179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . 0.602 ' O ' ' HB2' ' B' ' 170' ' ' LYS . 44.0 m-80 -131.51 -98.36 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' B' ' 169' ' ' ASN . 0.0 OUTLIER 163.35 -26.88 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.296 0.638 . . . . 0.0 109.424 178.69 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 13.7 t70 85.4 -58.21 0.08 Allowed 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.917 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.107 -0.949 . . . . 0.0 111.183 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.521 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C4'-C3' 106.148 0.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.521 ' C6 ' H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 C3'-C2'-C1' 101.539 -0.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.473 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 O4'-C1'-C2' 107.421 1.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.593 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.969 0 C1'-O4'-C4' 106.448 -2.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.712 ' P ' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O4'--C1' 1.406 -1.045 0 C3'-C2'-C1' 105.108 1.72 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.691 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C4'-C3'-C2' 104.401 1.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.814 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 106.845 2.961 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.814 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 C4'-C3'-C2' 102.471 -0.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.647 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-C2' 107.183 0.984 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.499 ' OP1' ' HB3' ' A' ' 60' ' ' GLU . . . . . . . . 0 O4'--C1' 1.409 -0.878 0 C3'-C2'-C1' 105.372 1.908 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.627 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O4'-C1'-C2' 107.274 1.067 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.627 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 C4'-C3'-C2' 104.073 0.873 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 C4'-C3'-C2' 100.929 -2.271 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.65 ' H72' ' C5 ' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 C1'-O4'-C4' 110.896 0.854 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.65 ' C5 ' ' H72' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 C4'-C3'-C2' 102.689 -0.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.639 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.558 0 O4'-C1'-C2' 107.291 1.083 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.639 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.594 0 C1'-O4'-C4' 110.428 0.52 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.561 ' OP2' ' HA ' ' B' ' 107' ' ' VAL . . . . . . . . 0 O4'--C1' 1.406 -1.056 0 C3'-C2'-C1' 104.868 1.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.551 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-C2' 107.25 1.045 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.472 ' C8 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 107.372 1.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.434 ' C4 ' ' C5 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 O4'-C4'-C3' 106.285 0.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.457 ' C5 ' ' C5 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.802 0 C4'-C3'-C2' 104.715 1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.457 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.995 0 C1'-O4'-C4' 107.463 -1.598 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 C1'-O4'-C4' 110.874 0.839 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.796 0 C4'-C3'-C2' 104.26 1.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.418 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C1'-O4'-C4' 110.339 0.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 120.451 0.167 . . . . 0.0 111.396 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 10.0 mmtt -96.27 -173.7 2.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.857 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.483 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 0.7 OUTLIER -110.41 106.38 15.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.839 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 4.1 ttm105 -78.62 102.32 7.91 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.247 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 1.106 HD13 ' CD2' ' B' ' 114' ' ' TYR . 4.5 pt -104.0 130.12 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.837 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.06 126.07 34.88 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.052 0.453 . . . . 0.0 111.681 -176.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.608 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.5 OUTLIER -99.67 106.7 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 177.62 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' B' ' 102' ' ' LYS . 1.8 p -70.21 73.93 0.49 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.418 0.628 . . . . 0.0 109.388 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.054 HG21 ' HB3' ' A' ' 14' ' ' TYR . 7.3 p -76.85 -135.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.411 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.824 ' H ' HG22 ' A' ' 9' ' ' VAL . 16.0 t70 89.07 -7.31 0.44 Allowed 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 120.064 1.302 . . . . 0.0 108.964 -176.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 67.8 m -132.13 -54.77 0.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.404 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.762 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -46.14 -93.39 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' B' ' 129' ' ' SER . 0.2 OUTLIER -178.32 38.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 118.964 0.802 . . . . 0.0 111.288 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.054 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.2 -41.85 17.95 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.318 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.7 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 2.6 mm100 -48.79 -40.6 29.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -173.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.901 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -57.58 -52.12 66.69 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 119.031 0.832 . . . . 0.0 112.141 -179.794 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.096 HD22 ' HA ' ' B' ' 132' ' ' MET . 1.5 tp -61.66 -36.48 80.95 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 119.805 -0.758 . . . . 0.0 112.971 -177.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.7 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -79.89 -29.3 39.89 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.509 0.671 . . . . 0.0 110.737 177.71 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.495 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -75.19 -32.16 61.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.851 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.015 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -87.63 -41.92 13.06 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.655 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.622 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.6 OUTLIER 165.42 12.36 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 176.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.435 HG23 ' C ' ' A' ' 21' ' ' ASP . 78.6 t -155.79 86.56 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-N 118.377 0.535 . . . . 0.0 111.354 -177.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.455 ' O ' ' CE ' ' B' ' 132' ' ' MET . 4.9 p30 -58.9 -95.1 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.116 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -150.81 -0.31 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 177.825 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.604 ' HB3' ' P ' ' D' ' 190' ' ' ' DG' . 73.7 p -41.38 -64.36 0.57 Allowed 'General case' 0 C--O 1.244 0.796 0 C-N-CA 119.126 -1.029 . . . . 0.0 109.22 -179.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.46 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -87.06 -29.0 24.11 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.121 177.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.644 ' CD1' HD23 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -56.06 -61.86 2.1 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 116.812 0.306 . . . . 0.0 110.81 179.518 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.116 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.5 t -52.33 -61.6 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.163 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.723 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 5.5 p -50.25 -48.62 54.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.46 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 1.2 m -71.11 -51.3 25.85 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.65 ' OG1' HG21 ' B' ' 131' ' ' THR . 2.6 m -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.311 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 1.017 ' HE2' HG23 ' B' ' 124' ' ' ILE . 16.7 mtt -61.65 -49.95 74.47 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.986 179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.476 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.69 -43.58 80.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.334 0.515 . . . . 0.0 109.862 178.731 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.476 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -66.07 -48.06 72.21 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.651 ' HB3' ' CD2' ' B' ' 117' ' ' LEU . 3.9 tp10 -64.37 -30.05 71.1 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.887 177.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.623 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -69.47 -49.52 54.1 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 177.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.39 -51.47 66.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.736 0.779 . . . . 0.0 109.004 176.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.547 ' O ' ' HG3' ' A' ' 40' ' ' ARG . 2.0 mtm-85 -63.01 -58.35 7.6 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 113.918 -1.492 . . . . 0.0 111.406 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.798 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 15.1 64.87 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.555 1.142 . . . . 0.0 113.798 179.918 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.56 ' CZ ' ' HB2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER 158.43 60.88 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.898 0.879 . . . . 0.0 110.699 178.825 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -117.08 135.14 53.96 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.01 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -124.03 134.56 53.4 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.207 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.43 165.41 3.24 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.819 0.342 . . . . 0.0 111.638 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.504 ' CE3' ' HA ' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -104.39 -163.17 0.95 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.98 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.16 137.35 32.43 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.79 0.328 . . . . 0.0 111.472 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.0 p -167.07 142.12 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.517 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.12 162.89 0.18 Allowed 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.685 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -175.53 -68.69 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.478 ' HB3' ' NH1' ' B' ' 137' ' ' ARG . 5.5 mt-30 68.74 168.21 0.28 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.152 0.501 . . . . 0.0 111.575 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.19 177.1 7.93 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.806 -179.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.442 ' O ' ' NH2' ' B' ' 137' ' ' ARG . . . 69.36 -168.74 45.07 Favored Glycine 0 C--N 1.335 0.503 0 CA-C-N 115.83 -0.623 . . . . 0.0 113.646 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.3 ttt -146.8 145.5 29.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.622 0.249 . . . . 0.0 110.793 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.48 ' CG1' ' HB2' ' B' ' 142' ' ' GLU . 48.5 t -123.27 146.77 28.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.335 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.5 -179.27 7.12 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.16 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 1.077 ' HA ' ' HB3' ' B' ' 141' ' ' ALA . 11.5 t -105.25 -120.5 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.876 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.899 ' HB1' ' CD1' ' B' ' 144' ' ' TRP . . . 79.81 -57.53 0.37 Allowed 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.0 0.52 . . . . 0.0 112.203 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.781 ' O ' ' HB1' ' B' ' 141' ' ' ALA . 0.0 OUTLIER -143.82 -152.86 0.44 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.089 -179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.578 ' O ' HD13 ' A' ' 59' ' ' ILE . 2.3 t80 179.45 56.62 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.384 0.611 . . . . 0.0 110.409 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.578 HD13 ' O ' ' A' ' 58' ' ' PHE . 22.7 mm -130.32 52.81 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.628 -179.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 55.28 156.95 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.001 1.111 . . . . 0.0 114.001 178.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 11.3 tpt 71.03 147.09 0.07 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.057 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.564 ' HA ' ' HG3' ' B' ' 142' ' ' GLU . 9.7 m120 -82.49 149.68 27.42 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.418 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -93.28 174.52 35.36 Favored Glycine 0 C--N 1.333 0.387 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.906 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 17.1 t -166.23 130.92 2.22 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.631 0.253 . . . . 0.0 111.157 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.599 ' O ' ' HB3' ' A' ' 66' ' ' ALA . 0.2 OUTLIER 67.36 -179.03 0.21 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.678 179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' A' ' 65' ' ' PHE . . . 98.54 127.86 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.416 0.686 . . . . 0.0 111.982 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -151.29 -59.19 0.17 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.094 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -143.45 -178.75 6.03 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.428 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -150.18 -75.22 0.16 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.936 -0.12 . . . . 0.0 111.27 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -177.37 -33.58 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.321 0.581 . . . . 0.0 109.7 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.436 ' HB3' ' O ' ' A' ' 70' ' ' LYS . 23.8 t70 74.26 -67.64 0.25 Allowed 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.154 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.972 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.723 0 N-CA-C 111.35 0.13 . . . . 0.0 111.35 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.575 ' HE3' ' HA ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -48.06 151.85 0.9 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.87 0.367 . . . . 0.0 111.122 179.52 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.575 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 4.9 tp60 -100.5 110.02 22.17 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.532 0.682 . . . . 0.0 111.111 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.639 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 0.1 OUTLIER -79.4 101.48 8.17 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.362 -178.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.809 HD13 ' CD2' ' A' ' 14' ' ' TYR . 5.5 pt -108.0 122.53 62.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.837 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -131.0 125.0 32.15 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.458 -0.897 . . . . 0.0 112.966 -178.176 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.61 HG13 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -100.75 101.8 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 174.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.839 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.1 p -66.81 86.23 0.12 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.384 0.611 . . . . 0.0 110.83 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.036 HG21 ' CD1' ' B' ' 114' ' ' TYR . 28.6 m -81.71 -141.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.849 -178.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.691 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.8 t70 93.1 -7.24 0.15 Allowed 'General case' 0 C--N 1.356 0.86 0 CA-C-O 121.97 0.89 . . . . 0.0 108.757 -176.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.04 -58.16 1.01 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.283 177.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.723 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -45.07 -89.69 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -179.395 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 29' ' ' SER . 2.8 m 179.91 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 CA-C-N 119.266 0.939 . . . . 0.0 112.03 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.106 ' CD2' HD13 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -82.7 -40.8 20.12 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.742 0.817 . . . . 0.0 113.18 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.662 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 3.8 mt-30 -48.84 -42.03 34.98 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -175.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.623 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -58.42 -45.95 87.43 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.015 1.28 . . . . 0.0 112.091 -179.383 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.924 HD23 ' HA ' ' A' ' 32' ' ' MET . 0.1 OUTLIER -55.39 -45.63 76.61 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.532 0.682 . . . . 0.0 111.132 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.662 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -79.18 -34.37 43.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.429 179.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.52 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -60.3 -28.45 68.12 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.701 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.798 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.32 -45.34 10.1 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.52 179.014 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.5 m-20 147.63 41.82 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 176.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.448 ' HB ' ' CD1' ' B' ' 117' ' ' LEU . 24.6 t -150.87 -37.92 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' B' ' 122' ' ' VAL . 17.0 m-80 64.26 -112.16 0.31 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.05 HG21 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -144.5 -0.99 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 179.169 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.449 ' C ' ' O ' ' B' ' 124' ' ' ILE . 0.1 OUTLIER -40.01 -64.39 0.5 Allowed 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.769 -178.706 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.22 -31.48 16.78 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.01 178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.613 HD12 ' HG ' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.07 -61.18 2.39 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 122.562 0.345 . . . . 0.0 110.143 178.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.991 HG22 HG21 ' A' ' 24' ' ' ILE . 2.4 t -52.58 -61.31 0.82 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.121 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.762 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 28.8 t -48.92 -45.21 41.18 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -71.93 -51.42 22.23 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.65 HG21 ' OG1' ' A' ' 31' ' ' THR . 21.0 m -58.58 -47.81 83.03 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.027 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.096 ' HA ' HD22 ' A' ' 17' ' ' LEU . 5.5 mmt -56.25 -57.75 10.89 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.131 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.447 ' HA ' ' HB3' ' B' ' 136' ' ' ALA . 42.0 tt0 -51.66 -37.52 50.82 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.485 0.183 . . . . 0.0 111.301 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -55.38 14.43 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.639 ' HB3' HD11 ' A' ' 17' ' ' LEU . 3.2 mt-10 -74.92 -9.69 58.78 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.736 0.303 . . . . 0.0 110.72 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.901 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.33 -29.62 21.43 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.478 ' NH1' ' HB3' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -82.13 -48.34 11.45 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 122.153 0.977 . . . . 0.0 109.027 178.127 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -57.11 -28.42 62.66 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 113.476 -1.693 . . . . 0.0 114.103 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.015 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -49.89 -21.0 1.02 Allowed 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.263 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.433 ' N ' HD12 ' B' ' 139' ' ' LEU . 5.8 ppt_? -42.91 119.13 1.41 Allowed 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 1.077 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . . . -135.37 -55.35 0.8 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.139 178.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.605 ' O ' ' HB2' ' B' ' 143' ' ' ARG . 5.7 tp10 63.24 169.74 0.15 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 177.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.605 ' HB2' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER 85.65 120.76 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.666 178.57 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.899 ' CD1' ' HB1' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -168.26 134.24 1.9 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.806 178.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.39 145.99 11.68 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 120.676 0.274 . . . . 0.0 111.399 -179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.8 p -107.18 160.34 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.466 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -99.91 151.3 21.46 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.982 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -169.37 161.37 9.89 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 120.757 0.313 . . . . 0.0 111.613 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -143.65 -72.7 0.28 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.716 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 68.64 -176.54 0.2 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.864 0.364 . . . . 0.0 111.591 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 144.79 46.99 0.04 OUTLIER Glycine 0 CA--C 1.523 0.536 0 C-N-CA 121.264 -0.493 . . . . 0.0 113.262 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 2.2 ttt -84.59 146.67 27.39 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.859 0.33 . . . . 0.0 111.2 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 5.0 p -155.8 160.71 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.61 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.42 -175.01 2.59 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.85 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' B' ' 156' ' ' ALA . 3.3 t -102.65 -124.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.834 -0.166 . . . . 0.0 110.777 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' B' ' 155' ' ' VAL . . . 174.79 104.72 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.894 0.378 . . . . 0.0 111.486 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.52 163.11 23.98 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.031 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -159.0 96.45 1.34 Allowed 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 121.149 0.499 . . . . 0.0 110.707 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 30.9 mm -138.47 104.09 2.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.484 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -93.26 160.36 14.86 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.18 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 7.2 ptt? -163.07 146.73 10.92 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.485 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -130.22 -63.31 0.9 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.317 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 103.58 -137.43 13.48 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.69 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 36.8 p -162.76 139.11 7.42 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.595 0.236 . . . . 0.0 111.069 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -122.05 124.04 43.03 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.2 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -161.45 128.8 4.06 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.397 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -162.7 115.51 1.64 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.167 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -130.61 150.49 51.78 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.029 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -166.6 176.47 7.24 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.898 0.38 . . . . 0.0 111.522 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.426 ' HE2' ' HB2' ' B' ' 170' ' ' LYS . 0.2 OUTLIER -166.94 -39.22 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 172' ' ' TRP . 2.0 t70 89.72 102.23 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.007 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.432 ' HB2' ' O ' ' B' ' 171' ' ' ASP . 64.0 m95 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.655 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.61 " H3'" ' H73' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 C3'-C2'-C1' 105.498 1.999 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.788 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 C4'-C3'-C2' 102.055 -1.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.788 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.528 0.497 0 O4'-C4'-C3' 104.511 -1.089 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.543 ' C6 ' H2'' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 C3'-C2'-C1' 104.906 1.576 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.56 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.923 0 C4'-C3'-C2' 104.753 1.553 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.783 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.408 -0.914 0 C4'-C3'-C2' 104.551 1.351 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.619 " H2'" ' H72' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.511 0 C3'-C2'-C1' 105.089 1.706 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.619 ' H72' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.571 0 C3'-C2'-C1' 100.862 -1.313 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.577 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 O4'-C1'-C2' 107.245 1.041 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.678 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.754 0 C3'-C2'-C1' 105.265 1.832 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.678 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.559 0 O4'-C1'-C2' 107.104 0.912 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.507 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 N19-C1'-C2' 115.316 0.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 100.907 -2.293 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.662 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.406 -1.065 0 O4'-C1'-N19 109.166 1.707 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.662 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 P--O3' 1.616 0.73 0 O4'-C1'-C2' 107.345 1.132 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.742 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.735 0 C3'-C2'-C1' 104.484 1.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.742 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 O4'-C1'-C2' 107.089 0.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.604 ' P ' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O5'--C5' 1.426 -0.901 0 C1'-O4'-C4' 106.327 -2.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.565 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 C2'--C1' 1.531 0.711 0 C3'-C2'-C1' 104.837 1.526 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.499 ' H62' ' H72' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.647 0 C3'-C2'-C1' 106.382 2.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.639 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C1'-O4'-C4' 110.903 0.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.493 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.721 0 C1'-O4'-C4' 110.746 0.747 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.473 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 C1'-O4'-C4' 107.94 -1.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.56 ' C8 ' ' H72' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 O4'-C1'-C2' 106.871 0.701 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.56 ' H72' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C5'-C4'-C3' 115.722 0.682 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 C1'-O4'-C4' 110.341 0.458 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.3 mtt . . . . . 0 N--CA 1.494 1.774 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.6 mtmm -105.0 177.16 4.93 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 123.065 0.228 . . . . 0.0 110.561 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.678 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.9 OUTLIER -126.62 122.74 35.87 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.39 0.614 . . . . 0.0 112.488 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.92 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.72 111.46 14.85 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.697 ' O ' ' HA ' ' B' ' 106' ' ' THR . 0.2 OUTLIER -111.75 122.91 66.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 179.435 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.717 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -131.04 128.8 41.02 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 119.99 -0.684 . . . . 0.0 112.641 -177.385 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.652 HG12 HD13 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -100.86 109.91 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 175.614 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.654 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 1.4 p -70.59 77.47 0.59 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.79 0.805 . . . . 0.0 109.392 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.888 HG11 ' CB ' ' A' ' 14' ' ' TYR . 9.9 p -92.51 -147.45 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-N 114.044 -1.435 . . . . 0.0 111.086 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.729 ' HB2' ' CB ' ' B' ' 103' ' ' GLN . 20.1 t70 106.7 13.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.477 1.132 . . . . 0.0 109.658 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -160.22 -40.3 0.05 Allowed 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.529 -1.668 . . . . 0.0 109.911 179.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.845 ' HB2' HG23 ' A' ' 9' ' ' VAL . 0.6 OUTLIER -69.81 35.11 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.53 ' OG ' ' HB2' ' B' ' 133' ' ' GLN . 28.7 m 72.18 4.08 4.89 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 177.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.001 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 0.8 OUTLIER -58.0 -55.09 39.45 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.167 0.508 . . . . 0.0 111.959 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.551 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 4.6 mt-30 -49.74 -40.38 40.63 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -176.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.823 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -54.86 -32.49 60.8 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.917 HD22 HD22 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -77.35 -51.78 10.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.645 179.586 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.671 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -68.16 -26.09 65.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.398 0.618 . . . . 0.0 109.788 178.478 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -60.63 -30.61 69.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.749 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.954 ' HB3' HD11 ' B' ' 139' ' ' LEU . 0.4 OUTLIER -88.35 -44.32 10.87 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 118.677 -0.677 . . . . 0.0 110.041 178.704 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.597 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.3 OUTLIER 160.4 24.22 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.533 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.662 ' O ' HD23 ' A' ' 17' ' ' LEU . 68.1 t -160.65 101.22 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.671 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 1.5 m120 -58.77 -82.92 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 106.287 -1.745 . . . . 0.0 106.287 177.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.872 HG21 HG22 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -161.04 -1.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.647 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.597 ' HB2' ' P ' ' D' ' 190' ' ' ' DG' . 0.5 OUTLIER -38.81 -62.87 0.57 Allowed 'General case' 0 C--O 1.241 0.617 0 CA-C-N 118.872 0.76 . . . . 0.0 109.686 -178.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.34 -33.44 31.89 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.802 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.917 HD22 HD22 ' A' ' 17' ' ' LEU . 26.5 tp -59.13 -60.93 3.07 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.031 0.416 . . . . 0.0 111.21 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.921 HG13 ' HE2' ' A' ' 32' ' ' MET . 3.2 t -48.91 -68.49 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 O-C-N 123.351 0.407 . . . . 0.0 109.995 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.712 ' HB2' ' HB3' ' B' ' 112' ' ' ASP . 10.1 p -47.16 -41.49 17.93 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.183 0.593 . . . . 0.0 112.561 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -69.94 -50.04 45.92 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.856 0.836 . . . . 0.0 108.981 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.758 HG22 HD11 ' B' ' 127' ' ' LEU . 8.1 m -63.77 -28.83 70.14 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.46 -1.246 . . . . 0.0 111.205 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.921 ' HE2' HG13 ' A' ' 28' ' ' VAL . 4.0 mmt -55.87 -47.42 77.39 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.649 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -56.42 -57.17 13.44 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.521 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 2.8 t-20 -50.65 -51.31 50.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.013 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 1.024 ' HG2' HD13 ' B' ' 127' ' ' LEU . 2.0 tp10 -68.57 -36.94 79.43 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.653 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -57.93 -42.95 85.92 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -52.13 18.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.17 178.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -52.93 -37.81 61.27 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.92 -177.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -25.86 89.85 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.192 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.431 ' HG3' ' N ' ' A' ' 41' ' ' ALA . 0.5 OUTLIER -168.85 179.73 4.04 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.118 -179.477 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.431 ' N ' ' HG3' ' A' ' 40' ' ' ARG . . . -90.88 -128.22 0.09 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.344 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.1 -165.3 0.17 Allowed 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -160.43 -47.33 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 63.83 51.6 2.34 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.184 0.516 . . . . 0.0 111.046 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.46 66.01 1.8 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.346 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.484 HG13 ' O ' ' A' ' 46' ' ' VAL . 7.3 p -140.16 107.23 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 120.99 0.424 . . . . 0.0 111.341 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -145.26 161.44 39.57 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.333 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.75 31.55 3.64 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.227 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -94.73 95.32 8.65 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.087 0.47 . . . . 0.0 111.335 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -135.82 -76.03 0.44 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.12 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -148.45 159.21 27.95 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 121.257 -0.496 . . . . 0.0 112.465 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.0 ttm -157.82 148.99 21.3 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.788 0.327 . . . . 0.0 111.411 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.657 HG13 HG23 ' A' ' 55' ' ' VAL . 6.3 p -69.99 144.89 13.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.871 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.43 93.7 0.35 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.204 0.526 . . . . 0.0 111.774 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.657 HG23 HG13 ' A' ' 53' ' ' VAL . 4.6 t -132.36 -124.53 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.736 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 39.7 79.05 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.3 mmm-85 -45.6 103.2 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.771 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.88 9.35 43.65 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 31.7 mm -81.92 67.17 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.17 0.509 . . . . 0.0 110.546 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -137.06 -151.56 0.4 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.962 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.437 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 1.6 mtp -133.38 147.35 51.78 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.816 0.341 . . . . 0.0 111.639 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 61' ' ' MET . 1.1 m120 74.86 149.91 0.11 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.406 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -150.63 57.37 0.45 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.919 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' B' ' 143' ' ' ARG . 20.9 t -98.49 -163.2 1.02 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.805 0.336 . . . . 0.0 111.456 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -138.9 127.38 23.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.602 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.789 ' HB1' ' HB2' ' B' ' 149' ' ' GLN . . . -166.81 146.95 5.72 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.854 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -85.25 125.68 33.08 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.174 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.436 ' OE1' ' NZ ' ' B' ' 145' ' ' LYS . 1.4 tp10 -74.57 150.28 39.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.954 0.406 . . . . 0.0 111.326 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.419 ' O ' ' HB3' ' A' ' 70' ' ' LYS . 74.0 m-80 -65.76 -66.52 0.54 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.16 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 69' ' ' ASN . 0.1 OUTLIER 172.26 -31.22 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 87.49 139.91 0.05 OUTLIER 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.636 -1.165 . . . . 0.0 111.297 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.146 -0.93 . . . . 0.0 111.38 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.493 ' O ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 110.606 -0.146 . . . . 0.0 110.606 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.495 ' O ' ' NZ ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -111.25 96.42 6.11 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.941 0.401 . . . . 0.0 111.413 179.518 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.729 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 6.0 tp60 -98.3 109.73 22.44 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.468 0.652 . . . . 0.0 109.815 178.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.602 ' HD2' ' O4 ' ' D' ' 193' ' ' ' DT' . 0.1 OUTLIER -78.83 99.82 6.89 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.283 -178.304 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.811 HD13 ' CD1' ' A' ' 14' ' ' TYR . 7.2 pt -102.41 123.41 55.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.717 ' HB ' ' HB ' ' A' ' 6' ' ' THR . 0.6 OUTLIER -131.24 123.35 28.23 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.914 -177.518 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.619 HG13 HG12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.05 96.82 5.18 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 175.464 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.92 HG22 ' HG3' ' A' ' 4' ' ' ARG . 67.3 p -68.79 94.31 0.6 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.939 -0.304 . . . . 0.0 110.291 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.727 HG21 ' HB2' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -116.49 -108.78 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.401 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.678 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . 2.4 t0 81.95 25.51 0.2 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 123.211 1.481 . . . . 0.0 107.844 -174.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 12.8 p -151.21 -57.77 0.16 Allowed 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 112.005 -2.362 . . . . 0.0 111.196 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.712 ' HB3' ' HB2' ' A' ' 29' ' ' SER . 65.3 m-20 -72.87 59.14 0.48 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.56 ' O ' ' HB3' ' A' ' 32' ' ' MET . 64.8 m 60.68 2.65 0.52 Allowed 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.84 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -59.97 -49.91 75.82 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.473 0.654 . . . . 0.0 109.584 178.715 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.716 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -49.46 -39.56 33.79 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.66 -177.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.653 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -54.99 -45.62 75.07 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.134 0.879 . . . . 0.0 110.238 179.578 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.93 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.3 OUTLIER -56.51 -53.89 52.2 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.843 179.208 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.716 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 17.8 pttt -68.92 -25.29 64.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.537 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' B' ' 116' ' ' LEU . . . -55.66 -28.0 53.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.3 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.568 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 87.6 m-85 -87.92 -42.75 12.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 177.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.568 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 20.6 t70 118.27 61.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.648 178.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.918 ' CG1' HD12 ' B' ' 117' ' ' LEU . 3.2 p -151.62 -33.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.46 -178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.433 ' OD1' ' HB3' ' B' ' 118' ' ' LYS . 67.9 m-80 61.83 -123.38 0.78 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -178.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 0.884 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -137.28 9.93 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.598 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.55 ' HB3' ' P ' ' C' ' 177' ' ' ' DG' . 91.9 p -38.84 -63.42 0.52 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.107 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.07 -34.64 14.19 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.681 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 1.024 HD13 ' HG2' ' A' ' 35' ' ' GLU . 34.0 tp -52.85 -61.64 2.16 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 117.33 0.565 . . . . 0.0 110.993 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.884 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.6 t -50.05 -63.86 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.251 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.835 ' HB2' ' CB ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -48.81 -47.0 42.58 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 123.773 0.829 . . . . 0.0 112.916 178.085 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.2 m -65.46 -56.83 10.28 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.547 HG23 HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -55.49 -40.48 71.77 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.835 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.001 ' SD ' ' HA ' ' A' ' 14' ' ' TYR . 31.6 mtt -58.94 -53.76 54.77 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.816 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.53 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -53.32 -45.14 68.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.438 0.563 . . . . 0.0 110.843 178.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -65.41 -56.95 9.69 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.085 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -64.22 -24.14 67.56 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.823 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -71.76 -49.42 39.14 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.045 0.45 . . . . 0.0 109.863 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -52.23 64.09 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.706 0.765 . . . . 0.0 109.83 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.574 ' NE ' ' HA ' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -62.25 -47.1 85.87 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.905 -178.373 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.954 HD11 ' HB3' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 17.29 82.92 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.029 0.831 . . . . 0.0 112.347 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.502 ' O ' ' HD2' ' B' ' 140' ' ' ARG . 0.0 OUTLIER -149.17 159.9 43.84 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.026 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -145.63 46.49 1.28 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.715 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.548 ' HG2' ' N ' ' B' ' 143' ' ' ARG . 0.7 OUTLIER -150.19 152.16 34.22 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.746 -179.384 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.548 ' N ' ' HG2' ' B' ' 142' ' ' GLU . 0.0 OUTLIER -142.17 -165.07 1.94 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.673 0.273 . . . . 0.0 111.326 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.458 ' O ' ' HG2' ' B' ' 145' ' ' LYS . 40.4 t90 -132.22 93.61 3.3 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 120.805 0.336 . . . . 0.0 111.682 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 145' ' ' LYS . 3.5 mmmt -177.5 172.42 1.81 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.461 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.576 HG23 ' H ' ' B' ' 147' ' ' GLU . 0.8 OUTLIER -70.37 -94.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -179.391 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.576 ' H ' HG23 ' B' ' 146' ' ' VAL . 0.0 OUTLIER -104.6 171.06 7.53 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.976 0.417 . . . . 0.0 111.481 -179.7 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -81.24 122.3 27.23 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.188 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . 0.789 ' HB2' ' HB1' ' A' ' 66' ' ' ALA . 13.1 mm100 -135.78 59.27 1.72 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.776 179.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -116.15 110.27 18.6 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.776 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -139.43 57.83 0.61 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.801 -0.714 . . . . 0.0 113.253 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.3 mtt -144.79 117.76 8.82 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 120.759 0.314 . . . . 0.0 111.088 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 12.2 t -112.39 134.03 56.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.423 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -90.03 146.62 24.21 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.073 0.464 . . . . 0.0 111.466 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.507 ' O ' ' HB3' ' B' ' 156' ' ' ALA . 5.1 t -138.35 -122.17 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.155 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' B' ' 155' ' ' VAL . . . 77.49 106.81 0.08 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.291 0.567 . . . . 0.0 112.366 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . 0.568 ' HA ' HD11 ' B' ' 116' ' ' LEU . 0.4 OUTLIER -96.5 160.94 14.13 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.864 179.327 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.498 ' H ' HD21 ' B' ' 116' ' ' LEU . 0.2 OUTLIER -143.75 86.97 1.89 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.379 0.609 . . . . 0.0 111.028 179.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 10.1 mm -132.34 102.43 5.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.398 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.11 137.17 50.02 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.103 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 1.1 mmt -156.57 53.26 0.53 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.132 0.491 . . . . 0.0 111.143 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.62 86.06 1.19 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.435 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -114.13 -178.86 19.1 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.137 -0.554 . . . . 0.0 112.936 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 13.6 t -160.88 -179.53 7.64 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.859 0.361 . . . . 0.0 111.525 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -168.88 142.09 2.87 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.265 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' B' ' 167' ' ' ASP . . . -159.63 -75.71 0.07 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.397 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' B' ' 166' ' ' ALA . 1.0 OUTLIER 70.36 132.17 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.633 0.583 . . . . 0.0 111.66 179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.51 -175.32 4.03 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.548 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -69.85 159.95 32.68 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.314 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.454 ' HB2' ' HE3' ' B' ' 170' ' ' LYS . 0.3 OUTLIER -163.95 -43.07 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.806 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 6.2 t70 83.12 88.15 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 113.962 -1.472 . . . . 0.0 111.181 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.769 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.734 " C3'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.448 1.309 0 C2'-C3'-O3' 115.14 1.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.734 H5'' " C3'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.849 0 C3'-C2'-C1' 106.084 2.417 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.653 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 O4'-C1'-N19 107.238 -0.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.654 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 C1'-O4'-C4' 107.386 -1.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.633 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C3'-C2'-C1' 105.005 1.646 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.633 ' H71' " H2'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.762 0 C4'-C3'-C2' 104.385 1.185 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.52 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.58 0 C3'-C2'-C1' 105.123 1.731 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.52 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 C3'-C2'-C1' 100.924 -1.269 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.449 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.625 0 O4'-C1'-C2' 107.144 0.949 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.409 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.801 0 C4'-C3'-C2' 104.571 1.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.409 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.662 0 C3'-C2'-C1' 101.782 -0.656 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.593 0 C3'-C2'-C1' 102.091 -0.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C4'-C3'-C2' 100.983 -2.217 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.474 " H4'" " C5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C4'-C3'-C2' 101.761 -1.439 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.474 " C5'" " H4'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.687 0 C4'-C3'-C2' 104.16 0.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-C2' 107.037 0.852 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.408 ' C6 ' ' C6 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C3'-C2'-C1' 101.792 -0.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.597 ' P ' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O5'--C5' 1.424 -0.997 0 C1'-O4'-C4' 106.797 -2.073 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.551 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 O5'--C5' 1.429 -0.669 0 C3'-C2'-C1' 104.734 1.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.422 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 C3'-C2'-C1' 106.433 2.666 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.602 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C1'-O4'-C4' 110.294 0.424 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.431 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.734 0 C4'-C3'-C2' 104.39 1.19 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.878 0 C1'-O4'-C4' 106.996 -1.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.505 ' C8 ' ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.656 0 C4'-C3'-C2' 104.315 1.115 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.505 ' H71' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C4'-C3'-C2' 104.086 0.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.4 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 N19-C1'-C2' 114.99 0.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.444 ' O ' ' C ' ' A' ' 2' ' ' LYS . 19.3 tpp . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 119.922 -0.085 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' A' ' 1' ' ' MET . 8.4 mtmm -28.6 119.01 0.12 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.359 0.412 . . . . 0.0 111.216 -179.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.573 ' O ' ' HA ' ' B' ' 108' ' ' THR . 44.4 tt0 -100.19 118.73 37.11 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.218 0.533 . . . . 0.0 111.833 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.982 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.1 OUTLIER -78.12 103.12 7.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.67 0.748 . . . . 0.0 111.594 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.811 HD13 ' CD1' ' B' ' 114' ' ' TYR . 2.6 pt -108.08 122.83 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 177.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.662 ' HB ' ' HB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -132.39 125.97 32.07 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -176.859 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.646 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.69 109.83 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.393 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.683 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 3.3 p -70.34 85.93 0.59 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.37 0.605 . . . . 0.0 110.484 -179.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.204 HG21 ' CD1' ' A' ' 14' ' ' TYR . 26.6 m -77.98 -146.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.088 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.664 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 22.9 t0 91.95 -7.88 0.22 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.777 0.799 . . . . 0.0 109.153 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.5 t -130.91 -59.72 0.99 Allowed 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.053 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.769 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.7 OUTLIER -44.4 -94.26 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -178.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.538 ' HB3' ' HB2' ' B' ' 133' ' ' GLN . 3.1 m -179.8 38.15 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 118.978 0.808 . . . . 0.0 111.526 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.204 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.92 -44.29 15.53 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.655 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 3.4 mt-30 -48.78 -38.78 22.92 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.809 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -53.74 -57.18 11.79 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.673 0.67 . . . . 0.0 112.331 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.923 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.9 OUTLIER -54.25 -42.68 70.18 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 120.211 -0.596 . . . . 0.0 112.437 -178.05 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.655 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -79.7 -28.4 40.65 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.371 179.615 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -56.29 -24.86 45.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.587 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.834 ' CD2' HD23 ' B' ' 139' ' ' LEU . 2.8 m-85 -87.98 -49.15 7.25 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.146 -0.934 . . . . 0.0 108.82 178.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.562 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 3.8 m-20 143.46 37.15 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 O-C-N 124.443 1.089 . . . . 0.0 110.504 178.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 t -147.87 77.74 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.652 -178.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.537 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . 18.9 m-80 -59.0 -105.17 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.053 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -147.62 7.4 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.597 ' HB3' ' OP1' ' D' ' 190' ' ' ' DG' . 31.0 p -41.86 -64.42 0.58 Allowed 'General case' 0 C--O 1.24 0.594 0 C-N-CA 119.603 -0.839 . . . . 0.0 109.335 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.8 -30.85 13.79 Favored Glycine 0 C--N 1.333 0.39 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.991 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.674 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -52.3 -61.5 2.24 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 122.486 0.315 . . . . 0.0 110.226 178.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.053 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.2 t -51.23 -58.7 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.749 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 9.7 p -48.67 -42.4 34.56 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.403 ' CG2' ' N ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -79.59 -45.12 19.76 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.13 0.49 . . . . 0.0 110.256 179.826 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.575 HG22 HD21 ' B' ' 127' ' ' LEU . 3.2 m -59.3 -44.64 92.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.803 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.933 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 0.0 OUTLIER -51.16 -48.52 61.84 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.436 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -61.38 -37.42 83.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.825 -0.17 . . . . 0.0 111.315 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.445 HD22 ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -68.82 -51.31 42.0 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.712 ' HG2' HD13 ' B' ' 127' ' ' LEU . 20.5 tp10 -65.77 -34.45 78.21 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.645 ' O ' HD12 ' A' ' 39' ' ' LEU . . . -62.45 -45.16 94.33 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 177.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -50.42 71.77 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 122.121 0.962 . . . . 0.0 108.785 177.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.555 ' NH1' ' O ' ' A' ' 40' ' ' ARG . 7.2 ttp85 -60.58 -56.36 22.21 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 113.322 -1.763 . . . . 0.0 113.673 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.763 HD11 ' CE2' ' B' ' 120' ' ' TYR . 15.0 mt 8.73 76.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.458 1.103 . . . . 0.0 113.523 -178.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.555 ' O ' ' NH1' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -178.87 154.31 0.71 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB3' ' O ' ' A' ' 40' ' ' ARG . . . 75.06 131.31 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.398 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -129.05 -76.02 0.55 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.219 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -176.16 155.83 1.58 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.814 0.34 . . . . 0.0 111.668 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -151.91 177.29 10.59 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.181 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.497 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -127.18 144.61 51.0 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.402 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 3.7 p -157.82 157.5 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 120.774 0.321 . . . . 0.0 111.394 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 48' ' ' ASN . 1.7 mm-40 -87.71 54.62 3.18 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.189 0.519 . . . . 0.0 111.585 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 42.5 t30 176.51 152.42 0.18 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.274 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.19 107.13 4.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.42 153.15 36.97 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.198 -179.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.28 90.05 0.25 Allowed Glycine 0 C--N 1.337 0.614 0 CA-C-N 115.844 -0.617 . . . . 0.0 113.025 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.604 ' O ' HG22 ' A' ' 53' ' ' VAL . 4.3 tpt -116.2 136.68 52.79 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 52' ' ' MET . 5.5 m 50.64 -162.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.534 179.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -109.74 148.53 31.26 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.862 0.363 . . . . 0.0 111.147 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.87 -123.82 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.671 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -147.45 86.45 1.61 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.145 0.498 . . . . 0.0 111.434 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -111.16 125.44 53.79 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.442 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -158.65 44.29 0.28 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.19 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.562 HG22 ' N ' ' A' ' 60' ' ' GLU . 16.8 mm -125.24 -91.59 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.752 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.562 ' N ' HG22 ' A' ' 59' ' ' ILE . 2.0 mm-40 -112.91 173.09 6.55 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 63.3 ttp -168.95 89.79 0.22 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.821 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.488 ' OD1' ' NH2' ' A' ' 40' ' ' ARG . 78.6 m-20 -124.09 -91.51 0.54 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.576 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -178.74 49.26 0.09 OUTLIER Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.682 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.3 t 59.18 -148.77 0.46 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.596 0.236 . . . . 0.0 111.186 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -134.82 131.46 37.48 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.025 0.441 . . . . 0.0 111.459 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -169.25 102.36 0.36 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.689 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.13 -83.28 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.736 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -93.18 82.87 4.56 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.018 0.437 . . . . 0.0 110.796 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -125.8 -3.91 7.08 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.556 ' HD3' ' O ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER 177.86 -30.22 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.557 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.556 ' O ' ' HD3' ' A' ' 70' ' ' LYS . 2.5 m-20 78.76 155.22 0.15 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.108 0.963 . . . . 0.0 113.015 178.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.445 ' CZ2' ' HE3' ' A' ' 70' ' ' LYS . 19.2 m-90 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.898 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 1.8 mpt? . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 119.674 -0.203 . . . . 0.0 110.763 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.664 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER 78.14 134.5 0.06 Allowed 'General case' 0 C--N 1.343 0.29 0 CA-C-O 121.204 0.526 . . . . 0.0 111.122 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.683 ' HB3' HG23 ' A' ' 9' ' ' VAL . 13.9 tt0 -105.21 107.63 18.72 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.823 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.639 ' NH1' ' H73' ' D' ' 193' ' ' ' DT' . 5.2 ttm105 -78.6 101.48 7.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.393 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 1.092 HD13 ' CD2' ' A' ' 14' ' ' TYR . 20.0 pt -102.94 116.6 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.65 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.752 ' OG1' ' H72' ' D' ' 191' ' ' ' DT' . 0.2 OUTLIER -115.92 119.19 35.12 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.223 -177.844 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.795 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.63 92.21 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 176.03 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.982 HG22 ' HG3' ' A' ' 4' ' ' ARG . 81.7 p -62.08 90.87 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.089 0.471 . . . . 0.0 110.412 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.911 HG21 ' HB2' ' B' ' 114' ' ' TYR . 2.1 t -84.12 -136.43 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.04 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.7 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 6.0 t70 90.14 -12.26 0.32 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -175.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 39.5 t -122.31 -63.11 1.32 Allowed 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.161 177.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.749 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -43.49 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.365 0.416 . . . . 0.0 112.071 -179.018 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER 176.24 44.24 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 118.744 0.702 . . . . 0.0 110.671 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.911 ' HB2' HG21 ' B' ' 109' ' ' VAL . 0.3 OUTLIER -83.1 -41.9 18.03 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -179.471 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.616 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.58 -43.62 36.06 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -176.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.586 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.4 OUTLIER -48.83 -30.61 5.96 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 118.713 0.688 . . . . 0.0 112.163 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.933 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.34 -60.11 2.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.374 178.351 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.616 ' CG ' ' HA ' ' B' ' 115' ' ' GLN . 0.1 OUTLIER -63.38 -25.8 68.46 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.241 179.754 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.407 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.93 -29.17 55.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.518 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.763 ' CE2' HD11 ' A' ' 39' ' ' LEU . 14.4 m-30 -94.23 -42.32 9.0 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.885 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.594 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 27.6 t70 125.15 54.7 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 122.343 1.068 . . . . 0.0 110.177 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.891 ' CG1' HD13 ' B' ' 117' ' ' LEU . 4.8 p -142.84 -38.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 CA-C-N 113.846 -1.525 . . . . 0.0 111.856 -177.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.708 ' O ' HD12 ' B' ' 117' ' ' LEU . 21.9 m-80 54.65 -117.05 1.12 Allowed 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 0.995 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -143.78 5.86 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -179.296 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.529 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.2 OUTLIER -39.18 -63.78 0.51 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.978 -178.471 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.419 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -85.98 -31.24 21.02 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.347 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.739 HD23 HG23 ' B' ' 124' ' ' ILE . 20.3 tp -55.5 -61.67 2.19 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 116.824 0.312 . . . . 0.0 110.664 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.995 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.2 t -52.76 -63.22 0.5 Allowed 'Isoleucine or valine' 0 C--O 1.21 -0.974 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.057 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.769 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 11.3 p -49.52 -46.78 48.91 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -72.74 -47.4 47.21 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.537 HG21 ' OG1' ' A' ' 31' ' ' THR . 16.7 m -57.78 -53.98 52.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.4 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.923 ' SD ' HD12 ' A' ' 17' ' ' LEU . 6.1 mmt -50.06 -52.65 32.78 Favored 'General case' 0 C--O 1.205 -1.246 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.118 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.538 ' HB2' ' HB3' ' A' ' 13' ' ' SER . 3.6 tt0 -53.96 -49.1 69.5 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 117.735 0.243 . . . . 0.0 111.369 179.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -65.04 -43.42 92.43 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.568 ' O ' ' HG ' ' B' ' 139' ' ' LEU . 2.2 tt0 -76.19 -8.65 57.5 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.124 177.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.809 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -87.43 -47.21 8.95 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 123.158 0.583 . . . . 0.0 109.909 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -56.82 6.94 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.486 0.66 . . . . 0.0 109.867 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.617 ' HD2' ' HA ' ' B' ' 142' ' ' GLU . 0.5 OUTLIER -84.37 -37.62 21.32 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.579 -1.191 . . . . 0.0 114.126 -177.601 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.834 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 42.79 41.18 2.39 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.256 0.623 . . . . 0.0 111.776 -177.124 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -168.15 -52.79 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.504 ' O ' ' HD2' ' B' ' 138' ' ' ARG . . . -175.35 92.56 0.06 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.84 0.352 . . . . 0.0 111.939 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.617 ' HA ' ' HD2' ' B' ' 138' ' ' ARG . 5.1 tp10 -102.12 142.66 33.04 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.428 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.7 47.91 1.56 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.817 0.341 . . . . 0.0 110.874 179.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 39.5 p90 39.16 -140.98 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.551 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.45 137.11 53.99 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.836 0.351 . . . . 0.0 110.532 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 2.9 t -79.55 145.34 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-O 120.891 0.377 . . . . 0.0 111.708 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -117.07 -90.85 0.55 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.913 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -159.89 177.33 10.9 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 120.945 0.402 . . . . 0.0 111.427 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -160.49 152.35 19.97 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.873 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.31 165.84 13.23 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.726 0.298 . . . . 0.0 111.21 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -138.7 61.7 0.57 Allowed Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.637 -0.792 . . . . 0.0 113.466 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.15 161.74 15.27 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.848 0.356 . . . . 0.0 111.023 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.521 ' O ' HG23 ' B' ' 155' ' ' VAL . 3.8 m -63.55 131.82 29.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 120.814 0.34 . . . . 0.0 111.458 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -67.17 85.08 0.14 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.31 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.521 HG23 ' O ' ' B' ' 153' ' ' VAL . 11.6 t -94.99 -2.58 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' B' ' 155' ' ' VAL . . . 73.35 104.79 0.07 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.468 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . 0.452 ' O ' ' CB ' ' B' ' 158' ' ' PHE . 0.2 OUTLIER -119.48 -179.06 3.76 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.395 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.452 ' CB ' ' O ' ' B' ' 157' ' ' ARG . 1.2 t80 88.8 110.18 0.04 OUTLIER 'General case' 0 C--N 1.34 0.173 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.423 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 1.2 mp -98.56 -69.96 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.51 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -144.86 147.73 33.14 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.866 0.365 . . . . 0.0 111.269 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 10.8 ttp -158.33 55.32 0.45 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.065 0.46 . . . . 0.0 111.131 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -141.72 156.1 45.62 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.166 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -80.18 151.46 33.26 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 121.022 -0.609 . . . . 0.0 113.041 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 21.3 t -104.93 152.64 22.42 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.796 0.331 . . . . 0.0 111.301 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -169.68 -65.36 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.219 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -162.41 153.46 17.61 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.29 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -107.52 -67.6 0.95 Allowed 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.088 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 60.72 65.22 1.06 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.023 0.44 . . . . 0.0 111.842 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -95.07 164.28 12.95 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.051 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -175.58 -33.56 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.953 0.406 . . . . 0.0 110.044 -179.804 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 32.7 m-20 80.47 102.13 0.06 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.707 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.6 t90 . . . . . 0 C--O 1.251 1.182 0 CA-C-O 118.165 -0.922 . . . . 0.0 111.297 179.932 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.682 " H1'" ' H73' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.271 0 C3'-C2'-C1' 106.188 2.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.822 H2'' " O5'" ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.838 0 C3'-C2'-C1' 104.859 1.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.822 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 P--O3' 1.613 0.533 0 O4'-C1'-C2' 107.064 0.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.683 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.768 0 C4'-C3'-C2' 104.604 1.404 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.681 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.405 -1.159 0 C3'-C2'-C1' 105.426 1.947 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.681 ' H71' " H2'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 C4'-C3'-C2' 104.192 0.992 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.47 ' H8 ' H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.555 0 C3'-C2'-C1' 105.714 2.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.434 ' C6 ' " C2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.711 0 C3'-C2'-C1' 100.242 -1.756 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.642 ' C2 ' ' C2 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 C3'-C2'-C1' 104.119 1.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.576 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.753 0 C3'-C2'-C1' 105.258 1.827 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.576 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 O4'-C1'-C2' 107.018 0.834 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.8 0 C3'-C2'-C1' 104.992 1.637 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.622 0 C4'-C3'-C2' 100.946 -2.254 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.5 ' OP3' " H3'" ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.563 0 N19-C1'-C2' 115.529 0.831 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.45 " O5'" ' H6 ' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.601 0 O4'-C1'-C2' 107.187 0.988 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.638 H2'' ' N7 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 O4'-C4'-C3' 106.209 0.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.638 ' N7 ' H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 O4'-C1'-C2' 107.003 0.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.597 ' OP1' ' HB3' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.407 -1.023 0 C4'-C3'-C2' 104.669 1.469 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.752 ' H72' ' OG1' ' B' ' 106' ' ' THR . . . . . . . . 0 O4'--C1' 1.41 -0.788 0 C1'-O4'-C4' 106.95 -1.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.642 ' C2 ' ' C2 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C3'-C2'-C1' 105.097 1.712 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.639 ' H73' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 N19-C1'-C2' 115.844 1.028 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.517 H2'' " O5'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.845 0 C3'-C2'-C1' 105.243 1.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.517 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C1'-O4'-C4' 108.176 -1.089 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C1'-C2' 106.937 0.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 C4'-C3'-C2' 104.113 0.913 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 N19-C1'-C2' 115.343 0.715 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.425 ' O ' ' NZ ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.851 0 CA-C-O 120.204 0.049 . . . . 0.0 111.016 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 15.2 mmtm -141.85 103.49 4.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.114 0.483 . . . . 0.0 110.149 178.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.508 ' HG2' ' CG2' ' A' ' 5' ' ' ILE . 1.0 OUTLIER -88.88 114.62 25.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.489 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.975 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -78.94 98.57 6.46 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.936 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 1.115 HG21 ' CZ ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -114.67 109.8 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.526 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.799 HG23 ' H72' ' C' ' 178' ' ' ' DT' . 0.3 OUTLIER -108.87 133.81 52.39 Favored 'General case' 0 N--CA 1.426 -1.633 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.582 -177.252 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.725 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -99.44 101.18 11.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.0 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.438 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 25.9 p -62.39 88.46 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.632 0.73 . . . . 0.0 110.189 -178.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.236 HG21 ' CD2' ' A' ' 14' ' ' TYR . 28.7 m -80.05 -137.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 114.258 -1.337 . . . . 0.0 112.032 -178.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.548 ' N ' HG23 ' A' ' 9' ' ' VAL . 24.6 t0 81.82 -10.54 1.13 Allowed 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -177.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.0 m -120.49 -69.68 0.83 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.674 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.7 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 0.2 OUTLIER -51.32 -89.41 0.0 OUTLIER 'General case' 0 C--N 1.353 0.747 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.146 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.514 ' HB3' ' O ' ' B' ' 129' ' ' SER . 29.2 t -177.14 47.55 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.249 0.931 . . . . 0.0 111.529 -178.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.236 ' CD2' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -80.35 -46.8 15.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -179.796 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.64 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 2.3 mm100 -49.18 -39.78 30.65 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -176.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.529 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.7 OUTLIER -56.01 -56.15 24.26 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.704 HD13 ' CE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -45.5 -52.91 9.66 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.804 0.812 . . . . 0.0 111.508 -177.695 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.729 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 5.8 pttt -78.99 -26.58 43.35 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.772 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 15' ' ' GLN . . . -62.2 -22.84 66.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.251 177.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.982 ' CB ' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.83 -43.37 11.88 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 118.666 -0.683 . . . . 0.0 109.441 178.322 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.608 ' N ' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 164.34 21.79 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 177.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.519 ' H ' ' HA ' ' A' ' 18' ' ' LYS . 59.0 t -153.54 101.82 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.824 ' O ' HD12 ' A' ' 24' ' ' ILE . 46.8 m-80 -66.25 52.37 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.083 HG21 ' HE3' ' B' ' 132' ' ' MET . 1.9 pp 35.61 -2.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 120.068 3.359 . . . . 0.0 120.068 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.566 ' HB2' ' OP2' ' D' ' 190' ' ' ' DG' . 0.0 OUTLIER -38.05 -57.66 1.03 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 118.917 0.78 . . . . 0.0 110.204 -179.537 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.61 -29.55 43.25 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.868 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.754 HD12 ' CG2' ' A' ' 24' ' ' ILE . 1.1 tm? -60.83 -56.13 24.82 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.943 HG12 ' SD ' ' A' ' 32' ' ' MET . 90.7 t -45.52 -67.95 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 109.987 178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.628 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 8.1 p -50.57 -42.24 55.28 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.577 0.751 . . . . 0.0 112.71 178.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.2 m -66.46 -57.44 7.36 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.456 ' HA ' HD22 ' A' ' 34' ' ' ASN . 0.8 OUTLIER -52.85 -41.64 64.46 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.038 178.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.943 ' SD ' HG12 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -48.68 -49.59 37.0 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.389 178.713 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.42 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -57.68 -45.49 85.55 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.361 179.556 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.456 HD22 ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -65.6 -51.79 57.02 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.185 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.881 ' HG3' HD21 ' B' ' 127' ' ' LEU . 1.4 mm-40 -64.5 -28.31 69.57 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.576 178.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.569 ' N ' ' O ' ' A' ' 32' ' ' MET . . . -71.61 -45.57 61.73 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.002 0.43 . . . . 0.0 110.491 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.562 ' NH2' HG21 ' A' ' 55' ' ' VAL . 1.3 mtp180 -73.23 -56.54 4.94 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.088 0.471 . . . . 0.0 111.233 179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.409 ' HG3' ' CZ2' ' B' ' 144' ' ' TRP . 0.0 OUTLIER -83.42 -32.97 25.81 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -176.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.54 ' CD1' ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 36.86 36.85 0.06 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -178.238 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.2 93.65 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.799 0.333 . . . . 0.0 111.458 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -134.16 147.0 50.72 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.154 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -94.17 -114.89 0.1 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -165.51 -169.35 1.55 Allowed 'General case' 0 CA--C 1.537 0.464 0 O-C-N 122.226 -0.296 . . . . 0.0 111.315 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.481 ' O ' ' HE2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER 68.02 95.78 0.06 Allowed 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 179.44 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' A' ' 44' ' ' TRP . 11.9 mmtt -150.43 145.93 26.36 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.444 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.63 HG13 ' N ' ' A' ' 47' ' ' GLU . 1.3 p -87.39 -158.79 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.145 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.686 ' HA ' ' NH1' ' B' ' 140' ' ' ARG . 0.3 OUTLIER -73.52 144.82 45.98 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.302 0.573 . . . . 0.0 112.38 -179.157 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -179.78 169.87 1.28 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.568 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.436 ' O ' ' HD2' ' B' ' 143' ' ' ARG . 18.2 pt20 -114.0 171.27 7.7 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.778 0.323 . . . . 0.0 111.513 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.433 ' HA ' ' HB2' ' B' ' 143' ' ' ARG . 1.3 pm0 -77.18 169.51 18.2 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.639 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 147.81 97.21 0.19 Allowed Glycine 0 C--N 1.336 0.54 0 C-N-CA 121.102 -0.57 . . . . 0.0 112.798 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.87 169.02 8.85 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.866 0.365 . . . . 0.0 111.44 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 42.3 t -129.64 138.7 53.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.991 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -70.49 129.24 38.73 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.938 0.399 . . . . 0.0 111.659 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.562 HG21 ' NH2' ' A' ' 37' ' ' ARG . 17.3 t -146.06 -120.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.517 179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.48 ' N ' HG12 ' A' ' 55' ' ' VAL . . . -171.24 -100.45 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.23 0.212 . . . . 0.0 110.947 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 70.89 141.22 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -173.51 78.37 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.421 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 22.7 mm -146.6 109.25 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.386 -179.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -134.63 -67.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.83 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 68.09 -176.6 0.2 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.197 0.523 . . . . 0.0 112.071 179.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -149.46 166.0 30.43 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.878 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -151.1 150.84 22.86 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 120.525 -0.845 . . . . 0.0 113.749 -179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.2 m 179.16 -89.02 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.809 0.444 . . . . 0.0 110.581 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 11.8 t80 68.31 164.09 0.22 Allowed 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.28 0.562 . . . . 0.0 112.402 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -146.3 84.86 1.64 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.038 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.47 115.92 23.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.027 -178.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' A' ' 70' ' ' LYS . 6.6 tp10 -129.85 119.68 23.72 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.961 178.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -178.73 163.42 1.45 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.962 0.41 . . . . 0.0 111.26 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.411 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 1.1 pttt 179.13 -32.4 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.437 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 81.67 -52.76 0.26 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.082 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 . . . . . 0 C--O 1.253 1.251 0 CA-C-O 118.492 -0.766 . . . . 0.0 110.992 179.559 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.454 ' N ' ' OD2' ' A' ' 10' ' ' ASP . 2.9 mmt . . . . . 0 N--CA 1.496 1.853 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.525 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.6 OUTLIER -167.58 139.24 3.09 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.654 179.577 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.807 ' HB3' HG23 ' A' ' 9' ' ' VAL . 12.5 tp60 -114.62 116.98 29.61 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.324 0.583 . . . . 0.0 111.472 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.676 ' HG2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -79.38 106.49 11.45 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.29 -0.868 . . . . 0.0 112.042 -179.124 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.883 HD13 ' CD1' ' A' ' 14' ' ' TYR . 2.8 pt -115.03 115.65 50.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.788 ' HB ' ' CB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -124.46 132.12 53.5 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.612 -177.521 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 1.055 HG13 HD11 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -100.37 99.28 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 174.676 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.975 HG22 ' HG3' ' A' ' 4' ' ' ARG . 71.8 p -69.15 71.92 0.27 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.773 HG21 ' HB3' ' B' ' 112' ' ' ASP . 14.4 p -101.81 -131.56 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 114.33 -1.304 . . . . 0.0 112.919 -176.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.754 ' H ' HG22 ' B' ' 109' ' ' VAL . 1.0 OUTLIER 155.38 -93.27 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -178.335 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 8.3 t -80.43 -1.23 40.58 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.773 ' HB3' HG21 ' B' ' 109' ' ' VAL . 4.9 t0 -74.91 52.75 0.56 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 120.303 1.41 . . . . 0.0 109.534 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 32' ' ' MET . 2.8 m 65.17 -11.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.115 ' CZ ' HG21 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -53.53 -60.04 3.82 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 118.207 0.458 . . . . 0.0 110.326 179.719 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 85.8 mt-30 -49.56 -41.04 40.5 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.979 -177.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.508 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -52.93 -28.08 21.85 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.833 HD12 ' CG1' ' B' ' 122' ' ' VAL . 0.5 OUTLIER -77.52 -55.4 5.4 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.44 0.638 . . . . 0.0 110.885 178.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.702 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 2.1 pttt -64.01 -25.87 68.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.26 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.87 -27.8 45.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.379 178.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.584 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 13.0 m-30 -88.5 -42.53 12.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.078 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 18.7 t70 124.95 63.67 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 O-C-N 124.548 1.155 . . . . 0.0 110.469 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.833 ' CG1' HD12 ' B' ' 117' ' ' LEU . 3.7 p -159.7 -32.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.507 -178.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.472 ' H ' ' HA ' ' B' ' 118' ' ' LYS . 6.7 p30 54.64 -102.91 0.16 Allowed 'General case' 0 C--N 1.343 0.29 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.166 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.3 OUTLIER -158.4 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 179.3 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.515 ' HB3' " O3'" ' C' ' 176' ' ' ' DT' . 8.8 p -39.61 -64.63 0.46 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.436 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.747 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.04 -32.78 16.56 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.724 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.881 HD21 ' HG3' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -56.57 -62.92 1.4 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.852 0.326 . . . . 0.0 111.12 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.166 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.1 t -55.22 -69.16 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.748 ' HA ' ' SD ' ' B' ' 132' ' ' MET . 1.1 t -51.38 -41.21 60.53 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.747 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.3 OUTLIER -76.05 -50.08 15.75 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 118.754 0.706 . . . . 0.0 109.282 179.12 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.613 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 1.3 m -51.47 -35.96 42.23 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.083 ' HE3' HG21 ' A' ' 24' ' ' ILE . 2.4 mtt -55.4 -48.76 73.87 Favored 'General case' 0 C--O 1.201 -1.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.439 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -53.98 -36.44 62.92 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 119.216 0.916 . . . . 0.0 110.561 179.42 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . 0.471 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 1.3 m-20 -75.19 -48.49 23.27 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.704 ' CG ' HD21 ' A' ' 17' ' ' LEU . 2.7 tp10 -68.92 -21.94 64.19 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.834 177.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.64 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -76.71 -47.37 22.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.672 179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -56.41 13.43 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.659 0.742 . . . . 0.0 109.549 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.46 -34.24 75.6 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.445 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.982 HD11 ' CB ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 32.76 56.02 0.41 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.76 0.791 . . . . 0.0 111.737 -179.422 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.686 ' NH1' ' HA ' ' A' ' 47' ' ' GLU . 8.2 ttp180 -177.24 141.43 0.32 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.067 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -59.16 121.26 10.89 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.957 0.408 . . . . 0.0 111.317 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.415 ' HA ' ' NH2' ' B' ' 140' ' ' ARG . 0.9 OUTLIER -78.12 -77.97 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.277 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.436 ' HD2' ' O ' ' A' ' 49' ' ' GLN . 2.9 ttt180 68.76 131.98 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.623 0.725 . . . . 0.0 112.799 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.409 ' CZ2' ' HG3' ' A' ' 38' ' ' ARG . 31.6 p90 -111.36 155.98 22.27 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.902 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -115.41 163.64 15.43 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.198 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 14.6 p -121.53 143.04 35.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.943 0.402 . . . . 0.0 111.096 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -107.44 161.29 14.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.115 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -125.13 169.28 12.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.782 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.56 109.04 8.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.969 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.24 113.12 1.79 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.772 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -104.33 69.38 0.27 Allowed Glycine 0 C--N 1.334 0.423 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.267 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 19.5 mmm -87.37 105.87 17.56 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.971 0.415 . . . . 0.0 111.199 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.542 HG13 ' O ' ' B' ' 153' ' ' VAL . 10.5 p -84.81 54.67 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.314 0.578 . . . . 0.0 111.792 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.413 ' C ' ' H ' ' B' ' 156' ' ' ALA . 33.1 tt0 -168.35 164.5 12.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.291 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 70.25 -23.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 178.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.413 ' H ' ' C ' ' B' ' 154' ' ' GLU . . . -74.14 -86.04 0.04 OUTLIER 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.859 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 3.2 ttt180 63.88 128.1 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.225 0.535 . . . . 0.0 111.807 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.523 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -175.06 98.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.976 -179.386 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.436 ' O ' ' C ' ' B' ' 160' ' ' GLU . 16.8 mm -97.05 -121.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.677 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . 0.436 ' C ' ' O ' ' B' ' 159' ' ' ILE . 0.5 OUTLIER 17.8 76.21 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 179.392 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 17.1 mtp -118.48 133.67 55.69 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.418 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -78.39 159.66 28.21 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.986 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -70.96 54.26 1.0 Allowed Glycine 0 CA--C 1.522 0.495 0 C-N-CA 121.273 -0.489 . . . . 0.0 113.217 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.99 -69.49 0.08 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 122.658 0.383 . . . . 0.0 111.947 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 39.1 t80 69.51 152.94 0.1 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.012 0.434 . . . . 0.0 111.546 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -170.29 109.99 0.38 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.717 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -72.77 68.73 0.88 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.309 0.576 . . . . 0.0 110.619 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -66.53 66.45 0.05 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.065 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -88.08 147.25 25.04 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.885 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.452 ' O ' ' CB ' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -162.28 -33.94 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.188 179.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.452 ' CB ' ' O ' ' B' ' 170' ' ' LYS . 10.7 t0 96.09 161.39 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.516 1.127 . . . . 0.0 110.671 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 30.7 m0 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.679 -0.677 . . . . 0.0 111.618 179.969 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.884 H2'' " O5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.708 0 O4'-C1'-C2' 107.425 1.205 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.884 " O5'" H2'' ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.789 0 C3'-C2'-C1' 104.562 1.33 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.686 ' C8 ' " C2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 O4'-C1'-C2' 107.045 0.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.542 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 C1'-O4'-C4' 106.737 -2.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.562 ' N2 ' ' C4 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C4'-C3'-C2' 104.17 0.97 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.799 ' H72' HG23 ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.88 0 C4'-C3'-C2' 104.701 1.501 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.704 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 C3'-C2'-C1' 105.007 1.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.794 ' H73' ' HD2' ' A' ' 4' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.671 0 C3'-C2'-C1' 100.801 -1.357 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.663 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.656 0 O4'-C1'-C2' 107.245 1.041 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.721 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.881 0 C3'-C2'-C1' 105.27 1.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.721 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-C2' 106.992 0.811 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.557 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 N19-C1'-C2' 115.25 0.657 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C4'-C3'-C2' 100.861 -2.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.519 ' H71' " C2'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 O4'-C1'-C2' 106.918 0.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.519 " C2'" ' H71' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.774 0 N19-C1'-C2' 112.86 -0.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 C3'-C2'-C1' 101.651 -0.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.431 H2'' " O5'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 O4'-C1'-C2' 105.074 -0.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.566 ' OP2' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O5'--C5' 1.426 -0.861 0 C1'-O4'-C4' 107.19 -1.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.571 ' OP2' ' HA ' ' B' ' 105' ' ' ILE . . . . . . . . 0 C2'--C1' 1.53 0.677 0 C3'-C2'-C1' 104.631 1.379 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.456 H2'' ' C6 ' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C3'-C2'-C1' 106.694 2.853 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.602 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.584 0 N19-C1'-C2' 115.292 0.682 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.602 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C4'-C3'-C2' 104.546 1.346 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.49 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.909 0 C1'-O4'-C4' 107.295 -1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.562 ' C4 ' ' N2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.602 0 C3'-C2'-C1' 104.345 1.175 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.646 H2'' ' C8 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.862 0 C3'-C2'-C1' 105.115 1.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.646 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C1'-O4'-C4' 110.308 0.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 111.557 0.206 . . . . 0.0 111.557 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt 72.42 160.92 0.23 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.011 0.434 . . . . 0.0 111.67 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.563 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 0.0 OUTLIER -98.76 106.78 19.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.454 0.645 . . . . 0.0 110.397 179.516 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 1.014 ' HG2' HG22 ' B' ' 106' ' ' THR . 0.0 OUTLIER -79.48 103.91 9.72 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.187 -179.221 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.909 HG21 ' CE1' ' B' ' 114' ' ' TYR . 9.0 pt -100.05 128.88 51.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.846 ' CG2' HG23 ' B' ' 106' ' ' THR . 0.3 OUTLIER -132.52 124.37 28.36 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 117.992 -1.483 . . . . 0.0 113.997 -177.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.677 HG22 HG22 ' A' ' 9' ' ' VAL . 1.2 p -100.33 101.72 12.47 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 176.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.677 HG21 ' H72' ' C' ' 176' ' ' ' DT' . 37.7 p -69.98 80.71 0.48 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.447 0.641 . . . . 0.0 110.471 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.963 HG11 ' HB3' ' A' ' 14' ' ' TYR . 4.0 t -72.93 -124.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.912 -178.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.712 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 0.4 OUTLIER 99.95 6.02 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.179 0.992 . . . . 0.0 109.88 -176.294 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.722 ' H ' HG12 ' A' ' 9' ' ' VAL . 38.7 t -167.44 -42.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.876 -1.056 . . . . 0.0 112.161 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.65 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 0.5 OUTLIER -62.24 47.92 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -177.274 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.565 ' O ' ' HB3' ' B' ' 132' ' ' MET . 1.0 OUTLIER 53.66 7.51 0.11 Allowed 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 177.181 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.972 ' CE1' HD11 ' B' ' 105' ' ' ILE . 0.0 OUTLIER -66.59 -52.57 43.95 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.278 0.49 . . . . 0.0 111.141 179.181 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.77 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -49.54 -36.88 24.92 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -176.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.72 HD13 ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -55.5 -56.47 19.82 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.477 0.58 . . . . 0.0 111.224 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.806 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.5 OUTLIER -48.5 -54.09 15.62 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.288 0.566 . . . . 0.0 111.355 -178.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 7.5 pttt -71.9 -25.74 62.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.153 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -58.5 -20.12 42.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.469 178.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.649 ' CD2' HD12 ' B' ' 139' ' ' LEU . 23.5 m-85 -87.69 -53.58 4.7 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 152.65 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 O-C-N 124.303 1.002 . . . . 0.0 111.821 178.57 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.805 ' CG1' HD12 ' A' ' 17' ' ' LEU . 9.7 p -147.03 80.61 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.522 0.677 . . . . 0.0 112.439 -178.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.054 ' O ' HD12 ' A' ' 24' ' ' ILE . 48.8 m-80 -65.42 63.44 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.883 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.095 HD11 HD12 ' B' ' 105' ' ' ILE . 0.5 OUTLIER 39.53 -7.94 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 118.336 2.717 . . . . 0.0 118.336 179.176 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -37.71 -60.07 0.75 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 120.432 1.469 . . . . 0.0 110.318 -178.28 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.53 -28.27 40.05 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.143 -0.551 . . . . 0.0 112.279 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.737 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -65.09 -61.35 2.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 122.677 0.391 . . . . 0.0 111.202 179.961 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.846 HG22 ' CG2' ' B' ' 128' ' ' VAL . 15.4 t -47.89 -61.25 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.478 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.812 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 7.7 p -49.2 -44.8 43.46 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 124.814 1.246 . . . . 0.0 113.417 178.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 97.4 m -67.07 -51.09 58.77 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.679 HG22 HD21 ' B' ' 127' ' ' LEU . 1.2 m -60.37 -34.07 73.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.288 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.925 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 3.3 mmt -57.73 -57.28 13.45 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.933 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.432 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -57.98 -45.42 86.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.606 0.241 . . . . 0.0 110.866 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.432 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 2.4 t-20 -64.06 -55.49 21.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.615 179.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.914 ' HB3' HD21 ' B' ' 117' ' ' LEU . 1.7 tp10 -67.57 -22.1 65.4 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.745 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -72.1 -42.94 65.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.71 -56.63 5.0 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.783 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.479 ' HA ' ' HD3' ' A' ' 38' ' ' ARG . 22.3 mmt180 -84.22 -32.1 24.69 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -176.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.562 ' CD1' ' CD2' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 34.11 73.45 0.08 Allowed 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.691 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.546 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -174.49 -14.38 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 40' ' ' ARG . . . 78.87 104.94 0.07 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.48 0.582 . . . . 0.0 110.775 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -134.72 173.03 12.13 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.804 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 79.8 145.6 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.589 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -101.83 -78.83 0.53 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -179.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' NZ ' ' OE2' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -169.37 178.52 4.25 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -178.674 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.679 HG23 ' HB3' ' B' ' 141' ' ' ALA . 0.2 OUTLIER -124.22 174.39 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.954 179.407 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' OE2' ' NZ ' ' A' ' 45' ' ' LYS . 1.2 mp0 -94.63 -90.99 0.21 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.43 -68.08 0.3 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.595 ' HG3' HG13 ' B' ' 146' ' ' VAL . 14.0 mm100 -145.02 170.48 16.1 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.885 0.374 . . . . 0.0 111.563 -179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.68 134.36 40.03 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.754 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -152.66 144.33 11.35 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.972 -0.633 . . . . 0.0 113.004 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.439 ' O ' ' NZ ' ' B' ' 145' ' ' LYS . 59.5 mtp -104.38 -177.78 3.47 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.715 0.293 . . . . 0.0 111.49 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.1 p -159.04 124.62 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.027 0.441 . . . . 0.0 111.262 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.13 -165.53 1.11 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.085 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.3 t -119.08 -125.38 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.42 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 179.47 -72.08 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.527 0.203 . . . . 0.0 111.518 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.22 121.21 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.113 0.482 . . . . 0.0 112.035 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.5 t80 179.53 106.24 0.03 OUTLIER 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.63 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -125.93 -134.09 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.677 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.78 167.24 22.42 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.744 0.307 . . . . 0.0 111.106 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.1 ttt -157.41 52.39 0.47 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.981 0.419 . . . . 0.0 111.219 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -109.74 -177.42 3.27 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.427 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 133.12 72.26 0.09 OUTLIER Glycine 0 C--N 1.333 0.38 0 C-N-CA 121.076 -0.583 . . . . 0.0 112.617 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.3 t -123.35 124.69 43.51 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.696 0.284 . . . . 0.0 111.361 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -164.21 150.1 10.82 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.301 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -145.92 155.18 42.69 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.077 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.83 -86.95 0.45 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.429 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 52.64 74.12 0.3 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.096 0.474 . . . . 0.0 111.199 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -140.9 -162.06 1.3 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.416 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.49 -35.63 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.157 0.503 . . . . 0.0 109.718 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.428 ' HB3' ' HD1' ' A' ' 72' ' ' TRP . 6.2 t70 78.7 -58.44 0.43 Allowed 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.411 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.428 ' HD1' ' HB3' ' A' ' 71' ' ' ASP . 34.1 m95 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.606 -0.712 . . . . 0.0 110.905 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.458 ' O ' ' HD2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 120.712 0.291 . . . . 0.0 111.507 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.712 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -137.38 144.19 42.33 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.389 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.543 ' O ' ' HA ' ' A' ' 8' ' ' THR . 3.7 tt0 -122.79 125.65 45.88 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.808 ' NH2' HG21 ' B' ' 106' ' ' THR . 4.3 ttt-85 -78.32 112.51 15.4 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.958 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 1.095 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -95.45 122.47 46.95 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.542 0 N-CA-C 105.561 -2.014 . . . . 0.0 105.561 175.069 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 1.014 HG22 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -131.89 109.83 10.36 Favored 'General case' 0 C--N 1.299 -1.589 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.889 -177.03 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.817 HG13 ' CG1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -102.92 107.71 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.364 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.822 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 6.1 p -70.97 98.19 1.57 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.464 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.758 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.94 -148.07 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-O 118.874 -0.584 . . . . 0.0 111.888 -178.449 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.598 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 15.6 t70 106.55 6.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 122.197 0.998 . . . . 0.0 108.591 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.68 -41.68 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.6 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.812 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.4 OUTLIER -78.57 42.32 0.43 Allowed 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -176.875 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.497 ' O ' ' HB3' ' A' ' 32' ' ' MET . 41.0 m 67.97 -2.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 177.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.909 ' CE1' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -54.23 -51.02 65.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.878 0.763 . . . . 0.0 110.604 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.586 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 6.2 mm-40 -50.0 -43.99 50.88 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.411 -0.813 . . . . 0.0 112.94 -176.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.745 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -53.55 -27.9 28.65 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.764 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.925 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -77.58 -55.46 5.34 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.622 0.725 . . . . 0.0 110.906 178.184 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.6 OUTLIER -65.87 -25.44 67.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.832 179.848 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -54.82 -28.35 48.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.007 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.563 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 16.0 m-30 -88.57 -42.56 11.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.897 178.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 25.3 t70 121.29 62.4 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 O-C-N 124.58 1.175 . . . . 0.0 109.775 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . . . . . . . . . 51.3 t -144.21 -48.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.975 -178.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 64.54 -113.95 0.34 Allowed 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -178.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 0.981 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -146.93 4.28 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 114.66 1.355 . . . . 0.0 114.66 179.245 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.506 ' HB2' ' P ' ' C' ' 177' ' ' ' DG' . 27.6 t -40.58 -64.6 0.5 Allowed 'General case' 0 C--O 1.241 0.643 0 C-N-CA 120.139 -0.625 . . . . 0.0 109.905 -178.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.451 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.71 -25.41 35.36 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.787 177.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.766 HD11 ' HG2' ' A' ' 35' ' ' GLU . 4.3 tp -60.84 -61.41 2.61 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.547 -0.168 . . . . 0.0 110.547 179.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.981 HG23 ' CG2' ' B' ' 124' ' ' ILE . 3.1 t -52.48 -65.57 0.29 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.884 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.65 ' HB3' ' CB ' ' A' ' 12' ' ' ASP . 8.8 p -46.94 -44.23 19.75 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.451 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -75.24 -43.81 49.57 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 119.097 0.862 . . . . 0.0 109.392 178.605 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.602 ' OG1' HG21 ' A' ' 31' ' ' THR . 18.9 m -59.58 -39.9 85.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.479 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.806 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 6.4 mmt -61.05 -57.5 12.34 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.341 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.36 -34.24 56.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 118.152 0.433 . . . . 0.0 111.745 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -79.23 -47.86 15.2 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.182 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.685 ' HB3' HD21 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -72.87 -22.2 60.81 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.988 0.423 . . . . 0.0 109.925 177.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.72 ' HB1' HD13 ' A' ' 16' ' ' LEU . . . -71.71 -45.2 62.56 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.6 mmt85 -67.5 -56.05 11.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.104 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.449 ' HD2' ' N ' ' B' ' 139' ' ' LEU . 0.0 OUTLIER -69.59 -43.0 73.71 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.052 -1.431 . . . . 0.0 114.287 -177.099 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.649 HD12 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 15.91 -88.72 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -177.067 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.04 113.68 27.35 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.949 0.404 . . . . 0.0 111.902 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.679 ' HB3' HG23 ' A' ' 46' ' ' VAL . . . 177.3 161.89 0.48 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.682 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.38 -89.54 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -124.81 -168.16 1.78 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.443 ' O ' ' CB ' ' B' ' 145' ' ' LYS . 0.0 OUTLIER -84.36 145.36 28.27 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 179.409 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.443 ' CB ' ' O ' ' B' ' 144' ' ' TRP . 1.8 tttt 84.95 158.1 0.1 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.333 -0.394 . . . . 0.0 109.989 -179.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.595 HG13 ' HG3' ' A' ' 49' ' ' GLN . 6.5 t -125.08 -117.67 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.236 -179.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.402 ' OE2' ' HE3' ' B' ' 145' ' ' LYS . 1.1 mp0 53.69 -110.72 0.56 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 117.582 0.174 . . . . 0.0 110.975 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 58.16 -172.13 0.1 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.61 0.243 . . . . 0.0 111.132 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.39 158.67 2.34 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.942 0.401 . . . . 0.0 111.778 -179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.61 156.28 41.18 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.842 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -167.07 172.66 42.21 Favored Glycine 0 C--N 1.334 0.426 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.595 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 29.5 tpp -153.69 156.53 38.02 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.836 0.351 . . . . 0.0 111.283 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.519 HG13 ' O ' ' B' ' 153' ' ' VAL . 7.2 p -159.41 103.53 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-O 121.141 0.496 . . . . 0.0 110.996 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -118.54 152.24 36.35 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.841 -178.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.467 ' O ' ' HB3' ' B' ' 156' ' ' ALA . 4.1 t -132.1 -123.84 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.492 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' B' ' 155' ' ' VAL . . . 75.17 105.81 0.07 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.116 0.484 . . . . 0.0 111.586 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -116.51 118.87 33.86 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.981 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 4.8 t80 177.64 106.48 0.02 OUTLIER 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.248 0.547 . . . . 0.0 110.826 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.91 19.87 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.392 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -97.61 107.15 19.59 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.831 0.348 . . . . 0.0 111.505 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 12.4 tpt -120.83 146.52 46.46 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -153.49 -176.22 5.71 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.349 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -104.58 -147.14 16.3 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 121.033 -0.603 . . . . 0.0 113.004 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 16.0 p -139.87 171.26 14.46 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.827 0.346 . . . . 0.0 111.298 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -162.93 92.94 0.79 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.141 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -156.53 138.01 13.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.369 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.54 70.56 3.93 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.084 0.469 . . . . 0.0 110.901 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -71.06 85.78 0.73 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.281 0.563 . . . . 0.0 111.496 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -65.7 143.96 57.22 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.965 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.556 ' HD3' ' N ' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -162.74 -38.46 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.512 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.556 ' N ' ' HD3' ' B' ' 170' ' ' LYS . 34.9 m-20 71.82 152.74 0.12 Allowed 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.287 179.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.555 ' HB2' ' O ' ' B' ' 171' ' ' ASP . 71.7 m95 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 123.183 0.593 . . . . 0.0 111.405 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.644 " C3'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.272 0 C4'-C3'-C2' 101.396 -1.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.644 H5'' " C3'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.513 -0.607 0 C3'-C2'-C1' 106.409 2.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.609 ' C8 ' " C2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.554 0 O4'-C1'-C2' 107.138 0.944 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.677 ' H72' HG21 ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.872 0 C4'-C3'-C2' 104.734 1.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.506 ' P ' ' HB2' ' B' ' 125' ' ' SER . . . . . . . . 0 O4'--C1' 1.409 -0.843 0 C4'-C3'-C2' 104.495 1.295 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.75 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.87 0 C1'-O4'-C4' 107.309 -1.708 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.625 " H2'" ' H72' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 C3'-C2'-C1' 104.916 1.583 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.765 ' H71' ' HD2' ' A' ' 4' ' ' ARG . . . . . . . . 0 O4'--C4' 1.453 0.601 0 C3'-C2'-C1' 101.104 -1.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.589 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 O4'-C1'-C2' 107.341 1.128 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.595 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.743 0 C3'-C2'-C1' 105.311 1.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.661 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.572 0 O4'-C1'-C2' 107.032 0.848 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.661 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.79 0 N19-C1'-C2' 115.19 0.619 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.664 0 C4'-C3'-C2' 100.978 -2.222 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.215 1.014 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.767 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.54 0 O4'-C1'-C2' 106.95 0.773 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.767 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 C1'-O4'-C4' 110.268 0.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.463 ' C8 ' ' N7 ' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.49 0 O4'-C1'-C2' 107.078 0.889 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.732 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.935 0 C1'-O4'-C4' 106.885 -2.011 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.732 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.531 0.72 0 O4'-C4'-C3' 103.876 -1.724 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.627 ' H62' ' CZ ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 C3'-C2'-C1' 105.434 1.953 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.5 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 N19-C1'-C2' 115.61 0.881 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.5 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.805 0 C4'-C3'-C2' 104.766 1.566 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.412 ' C2 ' ' N7 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.071 0 C1'-O4'-C4' 107.416 -1.631 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.412 ' N7 ' ' C2 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 C4'-C3'-C2' 104.425 1.225 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 O4'-C1'-C2' 105.296 -0.731 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.645 0 C3'-C2'-C1' 101.991 -0.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 120.514 0.197 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.6 ' HA ' ' CB ' ' B' ' 110' ' ' ASP . 0.0 OUTLIER 68.82 150.09 0.08 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.193 0.52 . . . . 0.0 111.746 -179.663 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.612 ' O ' ' HA ' ' B' ' 108' ' ' THR . 15.8 tt0 -129.6 113.12 14.42 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 121.491 0.662 . . . . 0.0 110.997 179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.863 ' HG3' HG22 ' B' ' 108' ' ' THR . 4.3 ttm180 -78.77 109.8 13.35 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.598 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.909 HD12 HD11 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -102.54 109.82 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.059 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 176.153 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.858 ' CG2' ' HG2' ' B' ' 104' ' ' ARG . 1.5 m -117.25 118.55 32.59 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 120.264 -0.574 . . . . 0.0 111.463 -175.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.916 HG13 HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -101.75 106.22 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.24 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.552 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 0.6 OUTLIER -70.83 79.91 0.62 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.209 0.528 . . . . 0.0 110.375 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.162 HG21 ' CD1' ' A' ' 14' ' ' TYR . 6.2 m -72.84 -158.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.37 -178.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.596 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 10.9 t70 93.55 -22.66 0.06 Allowed 'General case' 0 C--N 1.351 0.643 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -176.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.47 ' OG ' ' HE3' ' B' ' 102' ' ' LYS . 0.4 OUTLIER -116.37 -1.58 12.27 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.896 177.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.758 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 0.9 OUTLIER -110.7 -95.58 0.42 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.774 177.596 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.78 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.3 OUTLIER -173.85 30.34 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 118.481 0.582 . . . . 0.0 111.96 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.162 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -70.34 -39.11 74.89 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.533 0.733 . . . . 0.0 112.243 179.091 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.571 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.8 OUTLIER -49.79 -47.94 50.9 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -176.442 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.73 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.6 OUTLIER -49.53 -28.96 6.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -179.468 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.845 HD12 HG23 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -78.26 -60.16 2.49 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.391 0.615 . . . . 0.0 111.057 178.101 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -62.67 -25.5 68.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.648 179.496 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.4 -27.11 34.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.647 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.753 ' CE2' HD13 ' B' ' 139' ' ' LEU . 14.8 m-30 -88.58 -52.32 5.22 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.862 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.679 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 16.6 p-10 147.02 40.86 0.0 OUTLIER 'General case' 0 C--N 1.357 0.924 0 O-C-N 124.638 1.211 . . . . 0.0 111.395 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.799 HG11 HD22 ' A' ' 17' ' ' LEU . 14.4 p -138.08 89.33 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.162 0.506 . . . . 0.0 112.317 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.975 ' O ' HD12 ' A' ' 24' ' ' ILE . 5.4 m-20 -76.78 50.89 0.73 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.161 0.505 . . . . 0.0 110.636 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.993 ' HB ' HG23 ' A' ' 28' ' ' VAL . 1.4 pp 33.76 5.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.888 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.4 p -37.49 -63.55 0.44 Allowed 'General case' 0 C--O 1.247 0.961 0 CA-C-N 119.092 0.86 . . . . 0.0 110.743 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.445 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -76.44 -25.64 65.21 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.003 177.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.827 HD12 ' CG2' ' A' ' 24' ' ' ILE . 3.2 tm? -65.84 -60.21 3.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.51 -0.281 . . . . 0.0 110.791 179.369 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.993 HG23 ' HB ' ' A' ' 24' ' ' ILE . 61.8 t -42.14 -71.6 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 CA-C-N 117.586 0.175 . . . . 0.0 110.642 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.673 ' O ' ' HB2' ' B' ' 113' ' ' SER . 88.2 p -49.57 -34.17 16.95 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.1 m -75.2 -52.14 11.65 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 121.043 -1.036 . . . . 0.0 110.308 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.624 ' CG2' HD11 ' B' ' 127' ' ' LEU . 0.8 OUTLIER -56.8 -28.45 61.41 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.403 -179.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.912 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.3 OUTLIER -54.2 -54.44 39.88 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.698 178.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.461 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -56.55 -33.14 65.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.684 0.278 . . . . 0.0 111.633 -179.416 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.461 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 1.8 t-20 -76.33 -47.68 22.7 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.733 ' HB3' HD21 ' B' ' 117' ' ' LEU . 5.1 tp10 -67.41 -31.47 71.7 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.327 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.745 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -72.41 -39.47 67.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.74 179.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -70.14 -56.2 7.45 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.57 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -79.01 -37.12 39.97 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.823 -177.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.031 HD11 ' CE2' ' B' ' 120' ' ' TYR . 19.3 mt 37.5 66.17 0.47 Allowed 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 121.266 0.555 . . . . 0.0 111.595 -178.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -164.37 125.32 2.15 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.086 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.77 52.82 0.08 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.032 0.444 . . . . 0.0 112.112 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -112.9 127.14 56.12 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.134 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.1 mtm180 179.23 172.02 0.88 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.145 0.498 . . . . 0.0 111.493 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 1.6 p90 -165.68 162.71 18.95 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.53 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.51 139.23 19.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.804 0.335 . . . . 0.0 111.653 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.762 HG23 ' HG2' ' B' ' 142' ' ' GLU . 0.7 OUTLIER -141.26 125.23 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.691 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.617 ' HG3' ' HA ' ' B' ' 147' ' ' GLU . 5.2 pm0 -122.16 136.95 54.98 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.256 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.568 ' HB2' ' HB3' ' B' ' 144' ' ' TRP . 57.0 t30 -151.28 144.86 24.95 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.64 ' HB3' ' HB3' ' B' ' 148' ' ' ASN . 3.9 pt20 -155.95 142.14 18.33 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.584 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.77 -43.46 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.042 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -166.43 141.27 6.84 Favored Glycine 0 C--N 1.338 0.691 0 C-N-CA 120.908 -0.663 . . . . 0.0 113.077 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.02 136.46 1.09 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.662 0.268 . . . . 0.0 111.305 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -155.42 -62.26 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.541 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -80.52 156.04 26.71 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 111.333 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.7 t -87.53 -4.84 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 65.75 -49.81 0.39 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 179.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 3.5 mtt85 -65.35 97.16 0.26 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.852 0.358 . . . . 0.0 111.885 -179.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 1.6 t80 177.84 105.11 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.066 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.3 mm -118.71 -116.55 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.871 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -109.85 172.6 6.76 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.923 0.392 . . . . 0.0 111.249 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.97 151.91 31.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.05 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -61.48 -48.83 79.32 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.588 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 129.03 -122.72 3.99 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.962 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.9 t -164.56 -160.74 0.54 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.716 0.293 . . . . 0.0 111.232 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -130.99 154.66 47.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.948 0.404 . . . . 0.0 111.495 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.48 154.72 38.73 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.175 179.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.17 -67.55 0.47 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.478 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.99 101.15 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 70.22 -178.31 0.22 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.079 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.43 -33.92 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.02 0.438 . . . . 0.0 109.915 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 87.02 103.56 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.793 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.5 t90 . . . . . 0 C--O 1.253 1.281 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.643 -179.008 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.535 ' O ' ' NZ ' ' B' ' 102' ' ' LYS . 1.4 mpt? . . . . . 0 N--CA 1.493 1.681 0 N-CA-C 111.237 0.088 . . . . 0.0 111.237 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.596 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 5.7 mmtm -138.67 148.1 43.6 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 179.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.581 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -100.72 111.76 24.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.823 0.821 . . . . 0.0 112.627 -178.567 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.858 ' HG2' ' CG2' ' A' ' 6' ' ' THR . 0.1 OUTLIER -79.59 101.31 8.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.755 -1.111 . . . . 0.0 113.7 -178.602 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.916 HG12 HG13 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -107.3 128.52 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 176.101 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.681 HG22 HG23 ' A' ' 6' ' ' THR . 0.5 OUTLIER -132.09 129.12 39.54 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.659 -178.494 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.888 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.1 t -100.23 88.08 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 175.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.863 HG22 ' HG3' ' A' ' 4' ' ' ARG . 57.9 p -70.82 67.27 0.38 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.467 0.651 . . . . 0.0 109.691 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.137 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -63.77 -101.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 114.716 -1.129 . . . . 0.0 112.341 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.632 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 5.2 t70 75.75 -1.89 2.89 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 106.992 -1.485 . . . . 0.0 106.992 -173.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.447 ' H ' ' C ' ' B' ' 109' ' ' VAL . 54.9 p -94.26 -73.8 0.56 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.034 -1.439 . . . . 0.0 109.758 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' B' ' 114' ' ' TYR . 1.1 p-10 -144.83 156.1 43.84 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -175.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.673 ' HB2' ' O ' ' A' ' 29' ' ' SER . 1.0 OUTLIER 48.19 -27.3 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 175.539 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.137 ' CB ' HG21 ' B' ' 109' ' ' VAL . 1.7 t80 -54.6 -60.04 3.89 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.321 0.964 . . . . 0.0 109.393 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.655 ' HA ' ' HE2' ' B' ' 118' ' ' LYS . 48.0 mt-30 -49.75 -42.22 45.79 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.669 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.745 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.2 OUTLIER -50.71 -55.7 15.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.468 0.651 . . . . 0.0 109.375 178.169 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.733 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -46.72 -53.89 10.82 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.318 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.655 ' HE2' ' HA ' ' B' ' 115' ' ' GLN . 0.0 OUTLIER -74.5 -25.47 59.38 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.085 179.666 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.501 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -55.82 -29.83 60.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.647 178.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.031 ' CE2' HD11 ' A' ' 39' ' ' LEU . 15.0 m-30 -87.94 -40.63 13.77 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.673 ' HB3' ' O ' ' B' ' 120' ' ' TYR . 4.5 p-10 132.92 17.33 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 O-C-N 124.988 1.43 . . . . 0.0 111.751 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.558 ' HB ' ' CD1' ' B' ' 117' ' ' LEU . 26.1 t -105.34 73.12 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.177 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.87 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -67.43 45.71 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.092 0.472 . . . . 0.0 111.199 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.014 HG22 HD12 ' B' ' 127' ' ' LEU . 1.8 pp 32.74 6.56 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 119.457 3.132 . . . . 0.0 119.457 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.59 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 3.7 p -37.93 -62.93 0.51 Allowed 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 117.973 0.351 . . . . 0.0 111.347 -178.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.452 ' N ' ' OG ' ' B' ' 125' ' ' SER . . . -82.85 -24.36 53.15 Favored Glycine 0 C--O 1.226 -0.376 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.058 178.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 1.014 HD12 HG22 ' B' ' 124' ' ' ILE . 2.3 tm? -66.81 -61.51 1.92 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.807 HG23 ' HB ' ' B' ' 124' ' ' ILE . 2.6 t -52.43 -60.64 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-O 121.007 0.432 . . . . 0.0 109.889 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.758 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 63.3 p -54.82 -33.25 61.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.075 -0.966 . . . . 0.0 113.397 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 3.4 m -79.57 -54.22 6.11 Favored 'General case' 0 CA--C 1.509 -0.624 0 O-C-N 121.728 -0.607 . . . . 0.0 111.073 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.04 -36.64 40.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.915 -178.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.83 ' HE3' HG21 ' A' ' 24' ' ' ILE . 3.9 mtt -56.77 -53.23 60.18 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.36 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.78 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -56.26 -40.48 74.27 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.742 -179.777 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . 0.55 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 73.9 m-80 -67.98 -55.08 14.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.299 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -34.58 77.5 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.925 0.393 . . . . 0.0 110.248 178.369 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.73 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -66.38 -45.69 79.21 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.057 178.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.44 ' HD3' ' OE2' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -61.8 -52.17 65.27 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.814 0.816 . . . . 0.0 109.378 177.655 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.452 ' O ' ' N ' ' B' ' 140' ' ' ARG . 1.0 OUTLIER -63.59 -58.06 8.13 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.003 -1.453 . . . . 0.0 112.145 -178.546 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.753 HD13 ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER 8.66 59.96 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.323 1.049 . . . . 0.0 113.404 -178.842 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.476 ' HD2' ' O ' ' B' ' 139' ' ' LEU . 0.1 OUTLIER 174.71 -72.72 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.869 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.608 ' HB3' ' CB ' ' B' ' 149' ' ' GLN . . . -175.61 -177.78 1.02 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.762 ' HG2' HG23 ' A' ' 46' ' ' VAL . 3.1 tt0 -120.07 142.68 48.65 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.558 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 0.0 OUTLIER -150.06 -79.55 0.13 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.568 ' HB3' ' HB2' ' A' ' 48' ' ' ASN . 17.6 t90 -151.15 -106.62 0.06 Allowed 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -179.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.564 ' O ' ' HB ' ' B' ' 146' ' ' VAL . 7.2 tmtt? -130.85 140.45 50.25 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.935 -0.478 . . . . 0.0 111.984 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.605 HG12 ' N ' ' B' ' 147' ' ' GLU . 37.1 t 118.05 -88.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.674 1.19 . . . . 0.0 111.513 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.617 ' HA ' ' HG3' ' A' ' 47' ' ' GLU . 2.7 tt0 -170.49 162.82 8.32 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -179.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . 0.64 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER 69.3 -161.27 0.18 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.255 179.237 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . 0.608 ' CB ' ' HB3' ' B' ' 141' ' ' ALA . 1.6 pm0 -146.01 59.54 1.24 Allowed 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 49' ' ' GLN . 5.8 mm-40 -83.6 -78.64 0.22 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.989 -0.445 . . . . 0.0 110.866 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 116.8 61.84 0.32 Allowed Glycine 0 C--N 1.335 0.474 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.099 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -170.24 175.22 5.0 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 122.38 0.272 . . . . 0.0 110.77 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 6.0 p -171.3 116.37 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.199 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -100.9 154.17 18.89 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.953 0.406 . . . . 0.0 111.406 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 5.5 t -127.59 -122.03 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.512 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . 67.16 93.26 0.07 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.119 0.485 . . . . 0.0 111.738 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.48 140.82 22.33 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.38 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -174.32 102.92 0.1 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.268 0.556 . . . . 0.0 110.86 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 1.1 mp -132.96 29.55 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.325 179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -100.12 126.1 46.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.432 -179.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 12.6 mtm -144.22 135.54 25.59 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.125 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -143.62 137.32 28.23 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.24 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 177.95 143.13 4.94 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.879 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 19.1 t -170.5 161.0 7.67 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.685 0.279 . . . . 0.0 111.239 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -175.3 154.31 1.69 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.545 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -144.55 67.54 1.26 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.08 0.466 . . . . 0.0 111.334 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.32 81.18 4.94 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.176 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.85 59.32 0.48 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-O 121.308 0.575 . . . . 0.0 110.916 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -110.73 139.13 46.29 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.013 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.555 ' HE2' ' HB2' ' B' ' 172' ' ' TRP . 8.2 ttpt -168.73 30.67 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.355 0.598 . . . . 0.0 109.733 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.7 t70 27.65 71.48 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 114.645 -1.162 . . . . 0.0 112.826 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.555 ' HB2' ' HE2' ' B' ' 170' ' ' LYS . 1.2 m95 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.078 -0.963 . . . . 0.0 111.243 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.644 " C3'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.504 -1.229 0 C3'-C2'-C1' 100.316 -1.703 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.696 " C2'" ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.77 0 C3'-C2'-C1' 105.712 2.151 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.696 ' C8 ' " C2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.131 0.937 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.745 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.811 0 C1'-O4'-C4' 107.343 -1.684 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.745 " O5'" H2'' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 C3'-C2'-C1' 104.961 1.615 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.75 ' H73' ' HB ' ' A' ' 6' ' ' THR . . . . . . . . 0 C2'--C1' 1.51 -0.764 0 O4'-C1'-C2' 104.979 -1.019 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.531 ' C2 ' ' C2 ' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 C3'-C2'-C1' 104.87 1.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.531 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.841 0 C3'-C2'-C1' 100.779 -1.372 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.485 ' C2 ' ' C2 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C1'-O4'-C4' 110.552 0.609 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.435 ' C2 ' ' C2 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 C4'-C3'-C2' 104.428 1.228 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.757 0 C4'-C3'-C2' 104.575 1.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 O4'-C4'-C3' 106.176 0.576 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.646 0 C4'-C3'-C2' 100.873 -2.327 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.523 " H4'" ' OP3' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 O4'-C1'-C2' 107.044 0.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.42 ' OP1' H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 O4'-C1'-C2' 107.389 1.172 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.418 ' OP1' ' HD3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.43 -0.618 0 O4'-C1'-C2' 107.575 1.341 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.425 ' OP2' ' HE3' ' A' ' 2' ' ' LYS . . . . . . . . 0 O5'--C5' 1.428 -0.781 0 C3'-C2'-C1' 101.081 -1.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.561 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 C1'-O4'-C4' 106.372 -2.377 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.561 " O5'" H2'' ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 O4'-C4'-C3' 104.499 -1.101 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.485 ' C2 ' ' C2 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.793 0 C1'-O4'-C4' 110.728 0.734 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.542 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 C4'-C3'-C2' 104.444 1.244 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.488 ' C4 ' ' C6 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.768 0 C3'-C2'-C1' 105.02 1.657 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.488 ' C6 ' ' C4 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.025 0 O4'-C1'-N19 108.819 1.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.429 ' C8 ' ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C4'-C3'-C2' 104.359 1.159 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.429 ' H71' ' C8 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.976 0 C4'-C3'-C2' 104.57 1.37 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C5'-C4'-O4' 108.672 -0.455 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.434 ' O ' ' C ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.797 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.54 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.0 OUTLIER -23.6 116.93 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -179.053 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.61 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 33.6 tp60 -112.59 110.34 20.45 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.276 178.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 1.145 ' HG2' HG22 ' B' ' 106' ' ' THR . 5.4 ttm105 -80.0 117.03 20.47 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-O 121.641 0.734 . . . . 0.0 112.662 -178.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.82 HG21 ' CD1' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -106.96 131.95 55.59 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 177.036 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.918 ' CB ' HG23 ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.48 121.93 32.08 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.415 -0.914 . . . . 0.0 112.557 -177.422 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.689 ' CG1' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -102.72 96.94 5.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 174.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.617 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 69.7 p -70.92 87.35 0.72 Allowed 'General case' 0 C--N 1.317 -0.84 0 O-C-N 121.102 -0.999 . . . . 0.0 109.921 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.041 HG23 ' HB3' ' A' ' 14' ' ' TYR . 14.0 m -144.86 55.47 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 N-CA-C 117.217 2.302 . . . . 0.0 117.217 -177.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.818 ' HB2' ' HB3' ' B' ' 103' ' ' GLN . 0.8 OUTLIER -73.98 54.33 0.51 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 123.761 1.743 . . . . 0.0 108.277 173.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.44 ' H ' ' C ' ' A' ' 9' ' ' VAL . 28.6 t -164.65 -47.78 0.03 OUTLIER 'General case' 0 C--N 1.27 -2.85 0 CA-C-N 111.463 -2.608 . . . . 0.0 110.905 -178.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.628 ' HB3' ' HB2' ' B' ' 129' ' ' SER . 20.4 m-20 -73.4 47.25 0.22 Allowed 'General case' 0 C--N 1.348 0.502 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.717 -178.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.549 ' O ' ' HB3' ' B' ' 132' ' ' MET . 51.0 m 69.5 -3.07 1.71 Allowed 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.041 ' HB3' HG23 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -61.64 -45.23 94.96 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.556 0.693 . . . . 0.0 110.213 179.26 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.752 ' HG3' ' HA ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -48.17 -44.68 32.75 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.886 -1.052 . . . . 0.0 113.092 -176.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.603 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.1 OUTLIER -60.36 -49.01 79.3 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -178.63 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.953 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.1 -44.78 52.22 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 121.393 0.616 . . . . 0.0 111.372 -179.66 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.751 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 21.2 pttt -79.63 -33.85 41.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.32 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.503 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -62.07 -28.99 70.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.362 178.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.99 ' CB ' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -88.15 -45.29 10.24 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 117.772 -1.109 . . . . 0.0 110.864 179.218 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.714 ' HA ' ' HG3' ' A' ' 52' ' ' MET . 0.4 OUTLIER 152.35 31.46 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 177.453 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.533 HG23 ' HE1' ' A' ' 20' ' ' TYR . 27.1 t -145.52 -33.67 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.502 -0.879 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.603 ' HB3' ' HB3' ' A' ' 18' ' ' LYS . 9.9 p30 53.89 -104.42 0.21 Allowed 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -176.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.053 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -153.66 -0.47 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 178.456 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.528 ' HB3' " O3'" ' D' ' 189' ' ' ' DG' . 51.8 p -39.01 -64.31 0.46 Allowed 'General case' 0 C--O 1.241 0.648 0 CA-C-N 119.265 0.938 . . . . 0.0 109.505 -178.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.45 -28.64 24.13 Favored Glycine 0 CA--C 1.522 0.475 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.208 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.746 HD13 HD11 ' A' ' 17' ' ' LEU . 2.9 tp -56.45 -58.29 8.67 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.815 0.308 . . . . 0.0 110.357 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.053 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.6 t -53.99 -62.6 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.7 ' CB ' ' HB3' ' B' ' 112' ' ' ASP . 59.9 p -49.43 -45.16 46.11 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.72 -46.07 26.89 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.861 0.362 . . . . 0.0 110.221 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.635 ' CG2' HD21 ' B' ' 127' ' ' LEU . 36.3 m -61.2 -38.52 86.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.399 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 1.021 ' HE2' HG23 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -51.3 -43.34 61.63 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.135 179.258 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.507 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -63.49 -46.2 87.21 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.558 0.218 . . . . 0.0 110.731 179.02 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.507 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.27 -48.17 79.29 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.581 ' HG3' ' HG ' ' B' ' 127' ' ' LEU . 2.5 mm-40 -66.26 -36.14 82.24 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 177.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.501 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -59.38 -42.78 92.45 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.719 -0.613 . . . . 0.0 109.466 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -78.36 -56.46 4.43 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.922 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.66 -29.74 29.79 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -176.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.578 ' N ' ' O ' ' A' ' 35' ' ' GLU . 0.3 OUTLIER 26.69 79.54 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.589 0.756 . . . . 0.0 112.374 -178.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.417 ' NH1' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -169.62 88.3 0.16 Allowed 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.552 ' CB ' HG21 ' B' ' 130' ' ' THR . . . -174.92 141.92 0.63 Allowed 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -169.28 94.67 0.3 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.336 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -154.49 162.7 41.01 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -146.42 -179.37 6.71 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.431 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.827 ' HG3' HG22 ' A' ' 46' ' ' VAL . 0.9 OUTLIER -152.18 -61.84 0.16 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.827 HG22 ' HG3' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -172.82 172.74 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 O-C-N 123.233 0.333 . . . . 0.0 110.775 -179.1 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 7.9 pt-20 -89.79 -167.29 1.81 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -172.2 -159.71 0.14 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -110.25 -141.64 0.38 Allowed 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.294 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.46 -159.47 0.96 Allowed 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.979 -0.451 . . . . 0.0 111.554 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.63 75.33 1.15 Allowed Glycine 0 C--N 1.339 0.732 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.402 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.714 ' HG3' ' HA ' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -158.31 146.81 18.77 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.981 0.419 . . . . 0.0 111.878 -179.208 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 14.3 p -172.63 124.65 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.913 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.51 -160.46 1.06 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 56' ' ' ALA . 4.4 t -114.28 -124.68 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 122.25 0.22 . . . . 0.0 110.64 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.472 ' HB1' ' CZ ' ' A' ' 58' ' ' PHE . . . -144.74 85.99 1.78 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.257 0.551 . . . . 0.0 111.374 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.44 106.01 16.34 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.501 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.501 ' N ' ' CD1' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -163.57 89.57 0.6 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.187 0.518 . . . . 0.0 111.734 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -113.74 -133.4 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.803 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.49 171.03 15.67 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.639 0.257 . . . . 0.0 111.073 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.1 ttt -142.86 124.1 14.6 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.909 0.385 . . . . 0.0 111.639 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -144.67 171.22 14.7 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.157 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 171.78 152.85 8.67 Favored Glycine 0 CA--C 1.522 0.471 0 C-N-CA 120.888 -0.672 . . . . 0.0 113.089 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.7 t -157.66 166.22 33.4 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 111.363 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -170.91 148.09 2.79 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.419 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -133.83 105.58 6.86 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.45 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -120.32 116.93 26.52 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.981 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -149.04 91.59 1.87 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.732 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -158.65 143.63 16.17 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.625 -179.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.461 ' NZ ' ' O ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -173.73 -34.63 0.01 OUTLIER 'General case' 0 C--O 1.237 0.442 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.286 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.461 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 2.3 t0 78.21 175.39 0.17 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.023 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.007 0 CA-C-O 117.879 -1.058 . . . . 0.0 111.818 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.499 ' SD ' ' HE2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 N-CA-C 111.216 0.08 . . . . 0.0 111.216 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' B' ' 102' ' ' LYS . 0.0 OUTLIER -125.51 104.5 8.45 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.173 0.511 . . . . 0.0 111.927 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.818 ' HB3' ' HB2' ' A' ' 10' ' ' ASP . 1.4 tp60 -97.0 121.59 39.05 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.864 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.597 ' HG3' ' OG1' ' A' ' 6' ' ' THR . 2.7 ttm105 -77.8 105.99 9.34 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.734 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.727 ' O ' ' HA ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -99.8 108.69 23.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.022 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 178.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 1.145 HG22 ' HG2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -119.35 112.74 19.81 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.416 -173.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.512 HG22 ' CG1' ' B' ' 109' ' ' VAL . 1.2 p -100.59 112.13 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.45 177.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.784 HG23 ' HG3' ' A' ' 4' ' ' ARG . 3.3 p -70.93 87.51 0.73 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.994 HG21 ' CD2' ' B' ' 114' ' ' TYR . 13.2 m -89.37 -143.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.653 ' N ' HG23 ' B' ' 109' ' ' VAL . 6.4 t70 87.95 -7.49 0.56 Allowed 'General case' 0 C--N 1.351 0.633 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -176.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.34 -65.52 1.1 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.244 -1.344 . . . . 0.0 107.839 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.7 ' HB3' ' CB ' ' A' ' 29' ' ' SER . 0.8 OUTLIER -43.53 -86.42 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.172 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 2.2 m 175.97 41.31 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 118.428 0.558 . . . . 0.0 111.454 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.994 ' CD2' HG21 ' B' ' 109' ' ' VAL . 0.2 OUTLIER -83.6 -45.46 13.47 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.631 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.5 OUTLIER -48.58 -40.68 28.19 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.048 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.501 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -53.81 -56.28 18.97 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.115 0.87 . . . . 0.0 111.705 179.387 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.832 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 0.2 OUTLIER -55.67 -45.74 77.68 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.925 -178.534 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.631 ' HG3' ' O ' ' B' ' 115' ' ' GLN . 0.2 OUTLIER -73.41 -26.85 61.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.948 179.037 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.404 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -70.21 -14.36 62.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.34 177.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.683 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.8 m-85 -87.72 -44.54 11.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.683 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 1.2 m-20 128.1 9.17 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 O-C-N 125.166 1.541 . . . . 0.0 111.278 179.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.777 ' HB ' HD13 ' B' ' 117' ' ' LEU . 98.3 t -101.91 -36.29 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.171 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.701 ' O ' HD12 ' B' ' 117' ' ' LEU . 1.3 m-20 54.31 -119.86 1.54 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.021 HG23 ' HE2' ' A' ' 32' ' ' MET . 0.3 OUTLIER -137.52 0.56 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 179.399 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.48 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 10.8 p -43.0 -64.63 0.59 Allowed 'General case' 0 C--O 1.243 0.734 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.414 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -83.31 -29.19 34.14 Favored Glycine 0 C--N 1.334 0.444 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.893 178.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.73 HD12 ' HG ' ' B' ' 117' ' ' LEU . 4.8 tt -59.57 -61.99 2.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 117.418 0.609 . . . . 0.0 110.944 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.944 HG22 HG21 ' A' ' 24' ' ' ILE . 3.2 t -50.97 -66.44 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 C-N-CA 120.526 -0.47 . . . . 0.0 109.902 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.628 ' HB2' ' HB3' ' A' ' 12' ' ' ASP . 22.0 p -48.34 -47.32 37.12 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.552 HG21 ' CB ' ' A' ' 41' ' ' ALA . 0.9 OUTLIER -71.3 -46.39 60.87 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 118.799 0.727 . . . . 0.0 110.457 -179.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.591 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.8 OUTLIER -66.37 -34.91 79.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.654 -179.82 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.953 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -60.77 -57.05 14.33 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.287 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.494 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -52.75 -42.0 64.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.651 0.262 . . . . 0.0 111.656 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . 0.513 ' O ' ' HD3' ' B' ' 138' ' ' ARG . 1.7 m-20 -62.29 -55.31 29.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.679 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.63 ' HB3' HD21 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -74.64 -8.96 58.01 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.634 178.473 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.603 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -82.32 -42.55 18.62 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -74.56 -51.99 13.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.398 177.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.528 ' N ' ' HD2' ' B' ' 138' ' ' ARG . 0.2 OUTLIER -63.97 -47.47 80.26 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.568 -178.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.99 HD11 ' CB ' ' A' ' 20' ' ' TYR . 0.7 OUTLIER 16.8 81.73 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.849 0.86 . . . . 0.0 112.664 179.159 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.673 ' NH1' ' HB3' ' B' ' 141' ' ' ALA . 0.0 OUTLIER -172.32 -34.4 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.92 -179.814 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.673 ' HB3' ' NH1' ' B' ' 140' ' ' ARG . . . -144.86 -171.13 3.57 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.706 0.289 . . . . 0.0 111.302 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -124.34 -167.82 1.71 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.735 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 65.7 179.83 0.2 Allowed 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.184 0.516 . . . . 0.0 112.34 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -73.62 164.26 26.9 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.191 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.8 148.73 44.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.025 0.441 . . . . 0.0 112.106 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.5 p -126.61 -40.2 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.76 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -62.1 -29.63 70.45 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.805 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 8.4 p30 42.53 35.8 0.71 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -44.31 134.95 4.78 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -142.64 131.02 22.24 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.019 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 167.83 103.55 0.17 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.945 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.9 164.52 24.38 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.941 0.4 . . . . 0.0 111.246 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.496 HG13 ' O ' ' B' ' 153' ' ' VAL . 10.0 p -70.86 64.92 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 121.523 0.678 . . . . 0.0 111.241 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.27 172.13 7.01 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.546 -179.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.4 t -120.05 -124.11 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.494 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -170.45 -67.44 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.721 0.296 . . . . 0.0 111.469 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . 0.45 ' NH1' ' O ' ' B' ' 160' ' ' GLU . 3.6 tmt_? -162.71 140.96 8.49 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.008 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -162.1 96.34 0.99 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.068 0.461 . . . . 0.0 111.185 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 10.8 mt -137.97 -67.5 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.969 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . 0.45 ' O ' ' NH1' ' B' ' 157' ' ' ARG . 0.6 OUTLIER -143.71 153.96 42.99 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 179.63 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.38 -64.73 1.25 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 173.87 -171.21 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.032 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -92.56 -92.83 1.45 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 120.938 -0.649 . . . . 0.0 113.062 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 33.6 t -170.36 -164.39 0.39 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.677 0.275 . . . . 0.0 111.327 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -147.4 139.58 24.43 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 111.605 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -171.62 152.08 3.08 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.293 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -114.45 -86.95 0.59 Allowed 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.679 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.05 137.97 54.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.818 0.342 . . . . 0.0 111.056 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -129.81 -55.59 1.13 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.454 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.96 -32.54 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.2 t0 79.1 -72.05 0.08 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.481 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.116 -0.945 . . . . 0.0 111.038 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.753 " C2'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 105.043 1.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.753 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.806 0 C3'-C2'-C1' 104.605 1.361 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.681 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 C1'-O4'-C4' 110.742 0.744 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.541 ' C4 ' ' C5 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.927 0 C4'-C3'-C2' 104.339 1.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.544 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.968 0 C4'-C3'-C2' 104.405 1.205 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.732 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.967 0 C1'-O4'-C4' 107.571 -1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.56 ' H8 ' H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.425 0.401 0 O4'-C4'-C3' 104.438 -1.162 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.496 ' H72' ' C8 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C3'-C2'-C1' 100.899 -1.286 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 C3'-C2'-C1' 104.36 1.186 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.698 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.525 0.707 0 C3'-C2'-C1' 105.505 2.004 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.698 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.537 0 N19-C1'-C2' 112.502 -1.061 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.543 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C4'-C3'-C2' 104.159 0.959 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 C4'-C3'-C2' 100.938 -2.262 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 N19-C1'-C2' 115.39 0.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.526 0.838 0 C3'-C2'-C1' 105.308 1.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.822 H2'' " O4'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 105.131 1.737 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.822 " O4'" H2'' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C4'-C3' 104.022 -1.578 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.468 H2'' " O5'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.903 0 C3'-C2'-C1' 105.681 2.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.525 ' C7 ' ' HB ' ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 104.464 1.26 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.525 H2'' " O5'" ' D' ' 193' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.525 0.676 0 C3'-C2'-C1' 106.034 2.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.525 " O5'" H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.569 0 C4'-C3'-C2' 102.403 -0.797 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 C4'-C3'-C2' 104.031 0.831 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.076 0 C1'-O4'-C4' 106.421 -2.342 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.604 0 C4'-C3'-C2' 104.523 1.323 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.807 0 C4'-C3'-C2' 104.362 1.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.41 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 101.994 -0.504 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.5 ttm . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.676 ' HA ' ' HB3' ' B' ' 110' ' ' ASP . 0.0 OUTLIER 70.44 134.63 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 122.861 0.464 . . . . 0.0 110.473 -179.222 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.478 ' O ' HG22 ' B' ' 109' ' ' VAL . 33.1 tp60 -120.35 111.52 17.86 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.283 0.564 . . . . 0.0 111.294 -179.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.976 ' HG2' HG22 ' B' ' 106' ' ' THR . 0.0 OUTLIER -79.4 112.61 16.81 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.049 -179.557 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.787 HG12 HG13 ' B' ' 107' ' ' VAL . 0.6 OUTLIER -114.0 129.3 70.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.486 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.81 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.0 OUTLIER -133.01 135.59 45.54 Favored 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 117.886 -1.526 . . . . 0.0 113.768 -179.029 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.777 HG22 ' HA ' ' B' ' 125' ' ' SER . 0.9 OUTLIER -99.75 95.61 4.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.351 177.052 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 14.5 p -70.62 69.24 0.41 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.801 HG11 ' HB2' ' A' ' 14' ' ' TYR . 10.3 p -92.28 -133.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.835 -177.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.782 ' H ' HG22 ' A' ' 9' ' ' VAL . 25.6 t70 97.81 13.34 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.309 1.052 . . . . 0.0 109.348 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.405 ' H ' HG22 ' A' ' 9' ' ' VAL . 28.0 t -145.25 -51.75 0.26 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 113.875 -1.511 . . . . 0.0 111.473 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.798 ' HB2' ' HB2' ' B' ' 129' ' ' SER . 4.2 m-20 -72.82 41.41 0.1 Allowed 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 115.003 1.482 . . . . 0.0 115.003 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.497 ' O ' ' HB3' ' B' ' 132' ' ' MET . 0.2 OUTLIER 80.89 4.95 1.54 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 176.464 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.877 ' HA ' ' HG3' ' B' ' 132' ' ' MET . 3.5 t80 -58.16 -59.58 5.07 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.545 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 11.7 mt-30 -49.73 -40.05 39.37 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.874 HD22 ' HB1' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -48.65 -33.33 9.76 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.426 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.082 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.7 OUTLIER -78.25 -57.24 3.88 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.187 -0.605 . . . . 0.0 111.921 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.546 ' HD3' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -63.29 -25.18 68.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.718 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.415 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -55.94 -30.63 61.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.987 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.024 ' CE2' HD11 ' B' ' 139' ' ' LEU . 11.3 m-30 -88.34 -38.64 14.98 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.211 179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.614 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 37.6 t70 133.19 43.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 O-C-N 124.336 1.022 . . . . 0.0 109.578 178.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.795 ' CG1' HD22 ' A' ' 17' ' ' LEU . 6.1 p -160.89 78.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.932 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.703 -177.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.636 ' O ' ' HE3' ' B' ' 132' ' ' MET . 0.0 OUTLIER -64.1 -86.9 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 178.487 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.153 ' CG2' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -166.9 9.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 115.791 1.775 . . . . 0.0 115.791 178.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.575 ' HB2' ' OP1' ' D' ' 190' ' ' ' DG' . 29.0 t -38.36 -65.2 0.36 Allowed 'General case' 0 C--O 1.242 0.704 0 C-N-CA 120.211 -0.596 . . . . 0.0 110.551 -177.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.562 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -90.25 -24.91 27.8 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.584 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.824 HD11 ' HG2' ' B' ' 135' ' ' GLU . 0.7 OUTLIER -60.6 -56.94 15.26 Favored 'General case' 0 C--O 1.217 -0.625 0 O-C-N 123.105 -0.056 . . . . 0.0 111.008 179.317 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.153 HG23 ' CG2' ' A' ' 24' ' ' ILE . 2.0 t -57.21 -61.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.737 ' HB2' ' CB ' ' B' ' 112' ' ' ASP . 57.5 p -50.63 -41.92 55.65 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.562 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.6 OUTLIER -75.21 -50.19 16.99 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.685 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.462 ' N ' ' CG2' ' A' ' 30' ' ' THR . 17.2 m -53.15 -43.76 67.25 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.947 ' HE3' HG12 ' B' ' 124' ' ' ILE . 11.7 mtt -52.59 -52.7 54.0 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.499 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -55.53 -37.38 67.86 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.828 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.435 HD22 ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -72.52 -48.46 40.23 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.761 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -68.41 -27.35 66.13 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.259 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.565 ' CB ' ' HB3' ' B' ' 116' ' ' LEU . . . -83.1 -46.27 12.98 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.746 0.818 . . . . 0.0 110.73 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -51.98 -51.64 55.84 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 121.819 0.819 . . . . 0.0 109.482 178.423 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -37.91 49.12 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.14 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.945 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.3 OUTLIER 42.99 44.81 4.19 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.323 -179.853 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 4.0 tpt180 174.4 76.09 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.057 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -165.94 163.89 18.45 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.565 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 3.3 mt-10 -161.48 -92.62 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.051 179.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.565 ' HD3' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 63.25 131.64 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.88 0.848 . . . . 0.0 112.667 178.724 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -97.47 -165.33 1.24 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.242 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' A' ' 46' ' ' VAL . 7.6 tmtt? -129.79 130.37 45.26 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.801 0.334 . . . . 0.0 111.826 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.408 ' O ' ' HE2' ' A' ' 45' ' ' LYS . 8.4 p -92.57 132.02 38.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.451 179.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE1' ' HA ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -77.21 76.99 3.75 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.365 0.602 . . . . 0.0 111.931 -178.942 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -116.84 145.84 43.29 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.114 179.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 pm0 -60.1 133.91 56.55 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 120.804 0.335 . . . . 0.0 111.394 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -134.82 -59.87 0.79 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.036 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 130.4 -122.43 3.62 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.418 -0.42 . . . . 0.0 112.333 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -149.96 139.23 21.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.621 0.248 . . . . 0.0 110.744 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 11.1 t -138.0 76.77 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-O 121.049 0.452 . . . . 0.0 111.866 -179.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -81.91 101.83 10.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.729 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.9 t -118.08 -126.27 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.392 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.44 -58.48 0.23 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.552 0.215 . . . . 0.0 111.44 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -53.5 162.5 0.79 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.885 0.374 . . . . 0.0 110.987 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -147.33 92.53 2.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.402 0.62 . . . . 0.0 110.556 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 14.2 mm -138.51 105.75 3.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.154 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.554 ' HB2' ' CB ' ' B' ' 141' ' ' ALA . 5.1 tp10 -116.16 153.59 31.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.983 178.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.618 ' HB2' ' HG3' ' B' ' 145' ' ' LYS . 2.7 mtm -143.92 -70.57 0.3 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.602 0.239 . . . . 0.0 111.628 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -146.68 -87.05 0.1 Allowed 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 103.25 75.59 1.08 Allowed Glycine 0 C--N 1.335 0.473 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.617 ' HB3' ' HB2' ' B' ' 148' ' ' ASN . 0.5 OUTLIER -168.92 -162.92 0.4 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.332 0.123 . . . . 0.0 111.332 -178.995 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.408 ' O ' ' HB3' ' A' ' 66' ' ' ALA . 4.7 m-85 -106.98 -58.36 1.95 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.422 0.526 . . . . 0.0 112.422 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.65 ' HB2' ' O ' ' B' ' 147' ' ' GLU . . . 70.33 -59.95 0.5 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.442 0.297 . . . . 0.0 111.463 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 55.06 29.11 11.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.262 0.553 . . . . 0.0 111.444 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.55 86.01 1.17 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.822 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.415 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 14.5 p30 -54.02 153.7 4.75 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.77 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.416 ' O ' ' CB ' ' A' ' 71' ' ' ASP . 0.9 OUTLIER -170.95 -37.42 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.99 0.424 . . . . 0.0 110.036 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.416 ' CB ' ' O ' ' A' ' 70' ' ' LYS . 0.4 OUTLIER 88.4 124.89 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.818 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 27.8 m95 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.151 -0.928 . . . . 0.0 111.09 -179.591 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.442 ' O ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.763 0 N-CA-C 110.696 -0.112 . . . . 0.0 110.696 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -120.37 105.45 10.91 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 111.051 179.455 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.673 ' HB2' ' HB2' ' A' ' 10' ' ' ASP . 3.8 tm0? -95.62 123.2 39.06 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.541 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.58 ' HD2' ' N7 ' ' D' ' 192' ' ' ' DA' . 14.3 ttm-85 -77.14 101.81 6.3 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.713 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 1.031 HD12 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -93.34 107.64 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.392 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 177.354 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.976 HG22 ' HG2' ' A' ' 4' ' ' ARG . 1.2 m -118.18 110.91 18.16 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.317 0.579 . . . . 0.0 112.328 -175.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.787 HG13 HG12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -102.13 106.3 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.987 177.138 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.848 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 4.7 p -70.92 88.36 0.75 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.844 0.354 . . . . 0.0 110.1 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 1.121 HG21 ' CD2' ' B' ' 114' ' ' TYR . 10.9 m -80.34 -142.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.488 -178.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.681 ' HB3' ' O ' ' B' ' 109' ' ' VAL . 0.4 OUTLIER 86.28 -15.75 0.46 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -176.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 4.4 m -112.23 -68.93 0.9 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.944 -1.026 . . . . 0.0 108.691 176.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.737 ' CB ' ' HB2' ' A' ' 29' ' ' SER . 2.2 m-20 -43.71 -93.24 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 -178.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 29' ' ' SER . 1.8 t -177.98 47.71 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 121.567 0.699 . . . . 0.0 111.257 -178.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 1.121 ' CD2' HG21 ' B' ' 109' ' ' VAL . 0.1 OUTLIER -82.79 -45.51 14.24 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.082 -179.493 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.543 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.1 OUTLIER -48.59 -42.48 34.02 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.568 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.565 ' HB3' ' CB ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -51.81 -47.37 64.33 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 119.305 0.957 . . . . 0.0 112.073 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.821 HD11 HD12 ' B' ' 127' ' ' LEU . 0.2 OUTLIER -59.72 -51.8 68.22 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.313 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.595 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -74.13 -28.6 61.41 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.618 179.773 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -60.31 -28.2 67.93 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.33 178.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.945 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -88.44 -44.64 10.58 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.235 -0.888 . . . . 0.0 109.602 178.18 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 154.58 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 176.631 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.635 ' O ' HD12 ' B' ' 117' ' ' LEU . 38.8 t -146.64 94.71 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 1.067 ' O ' HD12 ' B' ' 124' ' ' ILE . 28.9 m-20 -71.43 57.12 0.25 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.86 178.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.067 HD12 ' O ' ' B' ' 123' ' ' ASN . 0.6 OUTLIER 43.06 0.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 -179.483 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.777 ' HA ' HG22 ' A' ' 7' ' ' VAL . 14.9 p -38.66 -64.52 0.43 Allowed 'General case' 0 C--O 1.246 0.902 0 CA-C-N 119.144 0.884 . . . . 0.0 110.516 -178.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.676 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -84.9 -15.12 68.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.229 177.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.935 ' HB3' HG22 ' B' ' 124' ' ' ILE . 4.8 tt -72.63 -62.04 1.59 Allowed 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 117.318 0.559 . . . . 0.0 110.348 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.116 HG22 ' CG2' ' A' ' 28' ' ' VAL . 75.1 t -44.78 -63.86 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.379 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.798 ' HB2' ' HB2' ' A' ' 12' ' ' ASP . 53.6 p -53.09 -51.45 61.82 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.676 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.6 OUTLIER -67.55 -47.06 70.93 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 118.746 0.703 . . . . 0.0 110.103 -178.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.547 ' HB ' ' O ' ' B' ' 127' ' ' LEU . 0.9 OUTLIER -53.22 -37.61 62.2 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.812 179.597 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.082 ' SD ' HD12 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -49.83 -49.17 50.0 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.774 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -43.66 98.35 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -67.06 -51.51 53.73 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.824 ' HG2' HD11 ' A' ' 27' ' ' LEU . 4.7 tp10 -58.73 -36.18 73.9 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.888 178.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.874 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -71.25 -42.42 68.86 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 121.026 0.441 . . . . 0.0 110.077 178.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -61.42 -52.6 63.89 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.617 0.723 . . . . 0.0 110.139 178.244 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.41 -47.66 11.18 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.228 -1.351 . . . . 0.0 113.865 -176.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.024 HD11 ' CE2' ' A' ' 20' ' ' TYR . 29.8 mt 40.05 34.1 0.18 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 121.03 0.443 . . . . 0.0 111.054 -177.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.408 ' HD2' ' HA ' ' B' ' 140' ' ' ARG . 0.0 OUTLIER 166.37 123.62 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.36 -179.032 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . 0.554 ' CB ' ' HB2' ' A' ' 60' ' ' GLU . . . -138.44 150.27 46.31 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.67 174.2 6.41 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.588 179.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' B' ' 144' ' ' TRP . 0.2 OUTLIER -79.8 177.94 8.54 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.521 ' HB2' ' O ' ' B' ' 143' ' ' ARG . 6.2 m-90 82.19 103.49 0.06 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.477 0.711 . . . . 0.0 112.387 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.618 ' HG3' ' HB2' ' A' ' 61' ' ' MET . 7.6 ptpt 167.67 162.65 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.969 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.424 HG12 ' N ' ' B' ' 147' ' ' GLU . 48.9 t -131.02 -101.7 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.65 ' O ' ' HB2' ' A' ' 66' ' ' ALA . 3.8 mt-10 -146.06 -177.37 5.57 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . 0.617 ' HB2' ' HB3' ' A' ' 64' ' ' SER . 1.9 t30 179.12 149.76 0.27 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.485 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.03 173.21 6.94 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.359 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -175.44 3.05 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.932 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -174.13 132.63 2.31 Favored Glycine 0 C--N 1.336 0.582 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.311 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 20.8 ttm -164.13 139.16 5.9 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 122.322 0.249 . . . . 0.0 110.718 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 9.6 p -166.5 147.5 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 120.93 0.395 . . . . 0.0 111.993 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.35 166.62 32.91 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.651 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.47 ' O ' ' HB2' ' B' ' 156' ' ' ALA . 4.0 t -128.5 -124.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.975 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.47 ' HB2' ' O ' ' B' ' 155' ' ' VAL . . . 172.53 106.05 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.844 0.458 . . . . 0.0 110.812 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -103.73 130.29 51.22 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.57 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -164.9 87.55 0.45 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.105 0.478 . . . . 0.0 112.155 -179.917 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 44.8 mm -114.94 91.61 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.275 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -115.08 145.01 42.76 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 28.1 ttm -161.55 141.43 10.41 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.359 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -143.92 152.64 41.37 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.017 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -87.38 -145.26 9.62 Favored Glycine 0 C--N 1.333 0.411 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.537 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 4.4 m -173.63 169.01 4.36 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 122.709 -0.289 . . . . 0.0 111.192 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -118.15 158.77 24.45 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.782 0.325 . . . . 0.0 111.691 -179.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -146.51 148.51 32.27 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.305 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.99 -13.62 11.9 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.978 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -56.97 88.95 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.131 0.491 . . . . 0.0 111.644 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -96.8 -1.55 46.0 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.066 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.434 ' NZ ' ' O ' ' B' ' 171' ' ' ASP . 1.2 tmtt? -171.6 -38.12 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.434 ' O ' ' NZ ' ' B' ' 170' ' ' LYS . 0.3 OUTLIER 86.36 127.37 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.315 179.044 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . 0.41 ' HA ' ' CE3' ' B' ' 172' ' ' TRP . 3.4 m95 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.403 -0.808 . . . . 0.0 111.163 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.753 " C3'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.446 1.149 0 C2'-C3'-O3' 114.611 1.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.753 H5'' " C3'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.854 0 C3'-C2'-C1' 104.693 1.423 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.637 " O5'" H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 104.29 1.136 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.46 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.77 0 C1'-O4'-C4' 107.264 -1.74 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.706 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.824 0 C4'-C3'-C2' 104.721 1.521 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.706 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.536 0.804 0 C4'-C3'-C2' 104.529 1.329 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.649 " O5'" H2'' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.583 0 C3'-C2'-C1' 105.096 1.712 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.548 ' C2 ' ' C2 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.827 0 C3'-C2'-C1' 101.049 -1.179 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.514 ' C2 ' ' C2 ' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 104.29 1.136 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.517 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.707 0 C3'-C2'-C1' 105.657 2.112 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.517 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 C3'-C2'-C1' 104.195 1.068 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.675 H2'' " H5'" ' C' ' 185' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 105.518 2.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . 0.675 " H5'" H2'' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.513 -0.451 0 C4'-C3'-C2' 101.055 -2.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.896 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.44 0.686 0 O4'-C1'-C2' 107.53 1.3 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.896 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C4'-C3'-C2' 103.993 0.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 C3'-C2'-C1' 101.685 -0.725 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.818 H2'' " O5'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -1.006 0 C1'-O4'-C4' 106.672 -2.163 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.818 " O5'" H2'' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.405 -1.124 0 C3'-C2'-C1' 105.077 1.698 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.609 ' H72' HG21 ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.43 -0.627 0 C3'-C2'-C1' 105.157 1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.58 ' N7 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 C3'-C2'-C1' 106.317 2.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.577 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 N19-C1'-C2' 116.01 1.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.577 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 C4'-C3'-C2' 104.361 1.161 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.527 0.937 0 C1'-O4'-C4' 107.287 -1.724 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.412 ' C2 ' ' C2 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C3'-C2'-C1' 104.338 1.17 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.595 H2'' ' C8 ' ' D' ' 198' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C4'-C3'-C2' 104.34 1.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.595 ' C8 ' H2'' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C3'-C2'-C1' 101.756 -0.674 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' B' ' 109' ' ' VAL . 0.1 OUTLIER -30.16 126.89 0.14 Allowed 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.604 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.457 ' O ' ' N ' ' B' ' 109' ' ' VAL . 10.1 tp60 -105.63 111.57 24.32 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.465 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.829 ' HG3' ' CG2' ' B' ' 108' ' ' THR . 1.3 ttm105 -79.3 105.93 10.97 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.954 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -112.59 122.32 66.56 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.767 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.5 OUTLIER -125.41 129.67 50.34 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.921 -177.098 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -100.36 107.07 20.32 Favored 'Isoleucine or valine' 0 C--N 1.343 0.295 0 N-CA-C 106.973 -1.492 . . . . 0.0 106.973 176.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' B' ' 103' ' ' GLN . 16.6 p -70.57 95.64 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.189 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.01 HG21 ' CB ' ' A' ' 14' ' ' TYR . 1.5 t -89.51 -143.55 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.143 -0.48 . . . . 0.0 112.21 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.529 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 33.7 t70 95.94 -10.14 0.09 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.5 t -126.0 -58.78 1.37 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 114.77 -1.105 . . . . 0.0 109.378 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.67 ' HB2' HG13 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -47.6 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.51 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 m -177.54 38.48 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.248 -0.908 . . . . 0.0 110.933 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.01 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -80.56 -39.17 28.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.346 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.575 ' O ' ' HG3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -49.78 -43.25 48.21 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.364 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.713 HD22 ' HB1' ' B' ' 136' ' ' ALA . 1.6 mt -48.33 -32.24 7.17 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.891 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -78.16 -60.09 2.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.092 179.028 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -61.79 -25.79 67.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.982 178.707 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -62.81 -30.85 71.79 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.75 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.915 ' CE2' HD21 ' B' ' 139' ' ' LEU . 0.2 OUTLIER -88.6 -35.47 16.84 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.772 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.659 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 27.7 t70 142.99 31.2 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 123.724 0.64 . . . . 0.0 112.211 176.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.598 ' HB ' ' CE1' ' A' ' 20' ' ' TYR . 53.0 t -160.95 100.85 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.412 ' OD1' ' HB3' ' A' ' 18' ' ' LYS . 70.1 m-20 -55.78 -89.75 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 178.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.014 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -157.01 6.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.888 ' HA ' HG22 ' B' ' 107' ' ' VAL . 1.7 t -38.92 -64.44 0.45 Allowed 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.201 -177.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.35 -23.36 51.5 Favored Glycine 0 C--N 1.335 0.496 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.02 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 1.014 ' HB3' HG22 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -65.65 -57.9 7.01 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 122.621 0.369 . . . . 0.0 111.2 179.797 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.955 HG23 ' HB ' ' A' ' 24' ' ' ILE . 3.8 t -51.55 -63.29 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.547 0.689 . . . . 0.0 109.21 178.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.754 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 12.8 p -50.16 -46.91 54.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.836 -1.075 . . . . 0.0 113.382 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 51.6 m -69.61 -50.27 46.03 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 121.311 0.577 . . . . 0.0 109.502 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.609 ' OG1' HG21 ' B' ' 131' ' ' THR . 1.8 m -55.16 -39.27 69.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.408 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.95 ' HE1' HG12 ' B' ' 124' ' ' ILE . 0.0 OUTLIER -60.58 -57.28 13.38 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.429 179.006 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -40.43 66.0 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.25 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.69 -48.91 52.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.34 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.85 ' CB ' HD21 ' B' ' 117' ' ' LEU . 3.5 mm-40 -68.67 -24.92 64.57 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.27 178.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.594 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -71.26 -47.23 58.33 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -65.56 -54.79 22.97 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 121.49 0.662 . . . . 0.0 109.929 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.432 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -58.22 -50.89 71.96 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.438 -1.256 . . . . 0.0 110.928 -178.924 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.784 HD11 ' CB ' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 9.61 69.93 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 178.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 167.04 74.61 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 120.713 0.292 . . . . 0.0 111.482 179.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -165.8 156.4 13.22 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -102.94 143.75 32.12 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.828 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -96.57 169.21 10.05 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.985 0.422 . . . . 0.0 111.927 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 2.7 p-90 -125.61 -152.53 0.52 Allowed 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.235 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.75 127.88 56.26 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.084 -0.385 . . . . 0.0 111.675 -179.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.22 133.97 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.391 179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -147.73 126.3 12.49 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.366 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -178.84 147.61 0.37 Allowed 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.039 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -100.47 127.63 46.76 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.399 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -144.69 144.68 31.34 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.916 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -175.8 87.22 0.08 OUTLIER Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.571 -0.824 . . . . 0.0 113.582 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.2 ptt? -116.45 -174.31 2.54 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.604 0.202 . . . . 0.0 111.004 179.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 12.2 p -155.46 135.81 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.791 0.329 . . . . 0.0 111.374 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -130.89 -179.36 5.27 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.703 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 3.4 t -108.98 -125.35 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.885 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 55' ' ' VAL . . . 178.31 -85.02 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.537 0.208 . . . . 0.0 111.375 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.1 131.05 19.21 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.802 0.334 . . . . 0.0 111.143 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -154.02 50.53 0.66 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.286 0.565 . . . . 0.0 111.025 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.414 ' O ' ' C ' ' A' ' 60' ' ' GLU . 3.1 mp -133.09 -45.86 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.001 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.414 ' C ' ' O ' ' A' ' 59' ' ' ILE . 1.5 mp0 15.71 65.75 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.597 1.159 . . . . 0.0 113.621 178.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.76 133.9 18.27 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.992 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -160.35 158.53 29.81 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.334 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 111.79 138.97 7.64 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.829 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.6 t -160.76 145.89 14.36 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.637 0.256 . . . . 0.0 111.183 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -163.88 129.96 3.09 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.049 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -162.29 73.35 0.38 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.026 0.441 . . . . 0.0 111.54 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.92 63.2 0.63 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.154 0.502 . . . . 0.0 111.078 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.07 167.0 22.76 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.715 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.58 -61.46 0.19 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.058 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.22 -30.66 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 t0 82.13 -70.17 0.06 Allowed 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.779 -1.1 . . . . 0.0 111.685 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.4 p-90 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.707 -0.664 . . . . 0.0 111.198 179.692 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.423 ' N ' ' OD2' ' A' ' 10' ' ' ASP . 10.0 ttt . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.415 ' C ' ' O ' ' B' ' 101' ' ' MET . 0.1 OUTLIER -29.05 116.72 0.11 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.801 0.441 . . . . 0.0 111.866 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.602 ' HG2' ' CE1' ' A' ' 14' ' ' TYR . 1.3 tt0 -96.43 111.92 23.85 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.099 0.475 . . . . 0.0 111.747 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.46 ' HB2' HH11 ' B' ' 104' ' ' ARG . 0.1 OUTLIER -77.93 102.39 7.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.697 0.76 . . . . 0.0 112.198 -178.625 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.75 HD11 HG11 ' B' ' 128' ' ' VAL . 0.4 OUTLIER -104.92 117.44 50.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 177.114 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.767 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -120.81 123.25 42.14 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -175.364 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.985 HG12 HG22 ' B' ' 109' ' ' VAL . 0.9 OUTLIER -100.26 103.32 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.111 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.829 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 29.6 p -71.65 91.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.994 HG21 ' CG ' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -93.33 -139.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 118.028 -0.987 . . . . 0.0 111.332 -178.143 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.629 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 28.4 t70 119.86 5.1 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.003 0.921 . . . . 0.0 109.49 -177.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 1.2 t -175.15 -26.87 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.754 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.2 OUTLIER -70.77 41.57 0.06 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.758 1.021 . . . . 0.0 113.758 -176.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.622 ' O ' ' HB3' ' A' ' 32' ' ' MET . 1.8 m 62.57 -0.32 0.55 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.994 ' CG ' HG21 ' B' ' 109' ' ' VAL . 0.0 OUTLIER -57.55 -52.04 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 179.856 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.559 ' O ' ' HB2' ' B' ' 119' ' ' ALA . 0.0 OUTLIER -48.98 -36.83 18.48 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.505 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.594 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.05 -56.49 21.32 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -179.661 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.85 HD21 ' CB ' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -48.26 -51.64 24.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.334 0.588 . . . . 0.0 111.603 -178.583 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.555 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.9 pttt -76.73 -26.68 54.88 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.891 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' B' ' 115' ' ' GLN . . . -63.55 -25.63 68.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.856 178.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.796 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -87.96 -42.38 12.51 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 118.524 -0.751 . . . . 0.0 109.8 178.698 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.541 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 158.41 37.04 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 177.264 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.706 ' O ' HG13 ' B' ' 122' ' ' VAL . 0.8 OUTLIER -163.21 92.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.109 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 1.015 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.5 OUTLIER -70.71 61.89 0.25 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.176 0.512 . . . . 0.0 110.531 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.141 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.6 OUTLIER 39.37 -8.16 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 N-CA-C 119.162 3.023 . . . . 0.0 119.162 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.522 ' N ' ' O ' ' B' ' 123' ' ' ASN . 0.0 OUTLIER -38.61 -62.59 0.59 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.675 1.125 . . . . 0.0 110.944 -178.233 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -85.37 -30.15 25.62 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.44 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.57 ' HB3' ' HA ' ' B' ' 124' ' ' ILE . 0.2 OUTLIER -60.87 -61.44 2.58 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 122.631 0.372 . . . . 0.0 111.447 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.141 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.2 t -55.18 -58.02 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-O 120.636 0.255 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.64 ' CB ' ' CB ' ' A' ' 12' ' ' ASP . 12.0 p -50.29 -41.56 50.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.187 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 1.8 m -74.38 -52.87 10.87 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.609 HG21 ' OG1' ' A' ' 31' ' ' THR . 0.6 OUTLIER -51.93 -44.18 63.76 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.174 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.0 ' HE2' HG23 ' A' ' 24' ' ' ILE . 25.9 mtt -49.29 -40.77 35.99 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.872 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -59.95 -43.92 94.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.757 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -49.76 67.56 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.719 ' CG ' HD21 ' A' ' 17' ' ' LEU . 2.6 tp10 -60.71 -37.49 81.86 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.713 ' HB1' HD22 ' A' ' 16' ' ' LEU . . . -67.41 -49.94 61.62 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.904 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.65 -48.22 63.46 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 121.965 0.888 . . . . 0.0 109.187 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -51.92 -26.65 10.78 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 113.634 -1.621 . . . . 0.0 111.753 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.915 HD21 ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -96.34 71.91 2.78 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.075 0.464 . . . . 0.0 109.944 177.758 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 3.4 ttp180 -92.7 -12.72 30.71 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -179.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . 63.67 -164.89 0.25 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.621 0.248 . . . . 0.0 111.465 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -159.51 111.27 2.07 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.735 0.302 . . . . 0.0 111.308 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 21.7 mtt85 65.82 -175.39 0.18 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.752 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 80.0 m95 70.59 -178.12 0.21 Allowed 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.739 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 3.2 ptpp? -173.47 -55.57 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.582 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 5.8 m 37.06 43.91 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 122.864 0.466 . . . . 0.0 112.201 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -61.28 98.42 0.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.253 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -158.8 163.06 37.05 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.067 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -160.78 165.14 30.83 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.472 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.38 178.01 5.64 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.126 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -130.78 -178.64 15.55 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.919 -0.658 . . . . 0.0 113.465 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 6.7 mtt -145.32 156.66 43.93 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.542 0.21 . . . . 0.0 110.882 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . 0.442 HG13 ' N ' ' B' ' 154' ' ' GLU . 8.2 p -104.06 -46.64 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . 0.442 ' N ' HG13 ' B' ' 153' ' ' VAL . 4.1 mt-10 -140.03 -71.74 0.38 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.523 0.201 . . . . 0.0 111.51 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 3.2 t -123.18 -125.12 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.864 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.476 ' O ' ' HD2' ' B' ' 157' ' ' ARG . . . -136.99 -45.43 0.57 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . 0.505 ' O ' ' CB ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER 69.27 124.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 122.82 0.448 . . . . 0.0 111.758 179.789 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.505 ' CB ' ' O ' ' B' ' 157' ' ' ARG . 0.3 OUTLIER 98.53 107.23 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.792 0.837 . . . . 0.0 110.079 -179.251 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 50.8 mt -122.09 -80.35 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.27 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' B' ' 161' ' ' MET . 0.1 OUTLIER -137.61 161.99 34.98 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.283 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . 0.424 ' N ' ' HG3' ' B' ' 160' ' ' GLU . 2.2 ttm -82.92 -50.82 8.19 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.281 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -147.56 -59.26 0.26 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.406 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 135.17 -168.2 23.82 Favored Glycine 0 C--N 1.334 0.459 0 C-N-CA 121.205 -0.522 . . . . 0.0 112.699 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 48.8 p -129.62 163.54 25.83 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -152.58 130.27 11.58 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.529 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -167.82 170.07 11.07 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.065 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' B' ' 168' ' ' GLU . 4.6 p-10 -84.96 -114.16 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.084 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.436 ' HB3' ' O ' ' B' ' 167' ' ' ASP . 0.7 OUTLIER 177.29 154.65 0.27 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.925 0.393 . . . . 0.0 111.108 179.583 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' B' ' 170' ' ' LYS . 2.7 p30 -122.88 -88.15 0.62 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.728 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.486 ' HA ' ' HE3' ' B' ' 170' ' ' LYS . 1.3 tpmp? 170.87 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 35.05 58.78 0.75 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.674 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.115 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.702 " C2'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 105.54 2.029 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.734 " H2'" ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.715 0 C3'-C2'-C1' 105.583 2.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.734 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.541 0 C3'-C2'-C1' 104.546 1.318 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.485 ' H72' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.896 0 C4'-C3'-C2' 104.463 1.263 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.5 ' OP1' ' HB3' ' B' ' 125' ' ' SER . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C4'-C3'-C2' 104.68 1.48 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.639 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.991 0 C1'-O4'-C4' 107.256 -1.746 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.618 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.5 0 C3'-C2'-C1' 104.676 1.412 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.84 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.581 0 C3'-C2'-C1' 100.7 -1.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.84 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 O4'-C1'-C2' 107.124 0.931 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.663 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.406 -1.064 0 C3'-C2'-C1' 104.941 1.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.663 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 O4'-C1'-N19 108.147 0.434 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.474 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.673 0 N19-C1'-C2' 115.274 0.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 C4'-C3'-C2' 100.916 -2.284 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 O4'-C1'-C2' 107.133 0.939 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.578 H2'' " O5'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 C3'-C2'-C1' 106.618 2.798 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.578 " O5'" H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.654 0 C4'-C3'-C2' 104.025 0.825 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.724 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 O4'-C4'-C3' 106.173 0.573 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.537 ' OP1' ' HB2' ' A' ' 25' ' ' SER . . . . . . . . 0 O4'--C1' 1.409 -0.847 0 C3'-C2'-C1' 105.616 2.083 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.558 ' H72' HG21 ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C3'-C2'-C1' 105.015 1.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.538 ' N7 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.586 0 C3'-C2'-C1' 104.852 1.537 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.508 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.772 0 N19-C1'-C2' 115.528 0.83 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.436 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.411 -0.719 0 C3'-C2'-C1' 105.559 2.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.41 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.951 0 C1'-O4'-C4' 107.691 -1.435 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.413 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.611 0 O4'-C1'-C2' 107.241 1.037 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.413 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.712 0 C4'-C3'-C2' 104.337 1.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.401 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 C3'-C2'-C1' 101.91 -0.564 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 120.906 0.384 . . . . 0.0 111.445 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 168.82 97.76 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.207 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.641 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 2.0 tt0 -101.39 109.02 20.79 Favored 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 1.063 ' HG3' HG23 ' B' ' 108' ' ' THR . 4.2 ttm105 -78.5 103.84 8.71 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.748 HD11 HG11 ' A' ' 28' ' ' VAL . 1.7 pt -97.41 126.98 50.13 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.775 HG21 ' NH1' ' B' ' 104' ' ' ARG . 0.6 OUTLIER -131.73 123.95 28.76 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.08 -1.048 . . . . 0.0 113.561 -177.139 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.827 HG13 HG12 ' B' ' 105' ' ' ILE . 0.1 OUTLIER -101.28 106.22 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 175.772 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.74 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 37.5 p -70.86 98.18 1.53 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.014 HG21 ' CB ' ' A' ' 14' ' ' TYR . 2.4 t -87.9 -137.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -178.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.78 ' HB3' ' HA ' ' B' ' 102' ' ' LYS . 24.6 t70 99.27 -9.82 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.901 0.881 . . . . 0.0 108.836 -176.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.2 m -136.98 -55.71 0.72 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.515 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.733 ' HB3' ' CB ' ' B' ' 129' ' ' SER . 0.6 OUTLIER -41.68 -92.33 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -178.462 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' B' ' 129' ' ' SER . 2.7 m 176.44 36.76 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 118.866 0.757 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.014 ' CB ' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -83.77 -43.99 14.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.174 -0.921 . . . . 0.0 113.162 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.573 ' HA ' ' HE2' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -49.1 -44.06 41.9 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -176.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.5 OUTLIER -54.04 -56.26 19.64 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.501 0.591 . . . . 0.0 112.265 179.821 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.692 HD13 ' CE2' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -46.17 -51.22 14.55 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.567 0.699 . . . . 0.0 111.302 -178.207 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.573 ' HE2' ' HA ' ' A' ' 15' ' ' GLN . 17.6 pttt -79.05 -29.27 43.42 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.802 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.483 ' HB3' ' HA ' ' A' ' 16' ' ' LEU . . . -61.45 -23.52 65.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.491 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.001 ' CB ' HD11 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.97 -44.4 11.04 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 118.255 -0.879 . . . . 0.0 109.746 178.302 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.658 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 163.13 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 177.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.557 ' CG1' ' O ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -169.59 106.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -178.816 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.955 ' O ' HD12 ' A' ' 24' ' ' ILE . 9.2 m-20 -66.68 55.85 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.672 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.97 HG21 ' HE3' ' B' ' 132' ' ' MET . 1.6 pp 36.24 1.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.605 ' HA ' ' OP1' ' D' ' 190' ' ' ' DG' . 7.0 p -37.74 -63.59 0.45 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 118.913 0.779 . . . . 0.0 112.372 -178.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.446 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -75.34 -20.3 78.93 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.259 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.762 HD12 ' CG2' ' A' ' 24' ' ' ILE . 2.2 tm? -72.93 -58.55 3.24 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 122.597 0.359 . . . . 0.0 110.934 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.969 HG12 ' SD ' ' A' ' 32' ' ' MET . 59.7 t -45.43 -69.99 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.728 0.299 . . . . 0.0 110.973 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.554 ' HB2' ' O ' ' B' ' 112' ' ' ASP . 45.6 p -49.43 -34.11 15.73 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.026 0.53 . . . . 0.0 112.099 178.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.5 m -69.74 -53.93 16.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 m -52.0 -43.39 63.61 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.182 178.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.969 ' SD ' HG12 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -55.75 -48.59 74.99 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.906 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.525 ' HG3' ' N ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -60.06 -42.78 95.28 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.355 0.525 . . . . 0.0 110.608 179.638 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 83.0 m-20 -67.33 -49.58 63.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.749 ' HB3' HD21 ' B' ' 117' ' ' LEU . 17.3 tp10 -65.04 -29.15 70.03 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.341 177.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.708 ' HB1' HD13 ' B' ' 116' ' ' LEU . . . -68.16 -45.48 73.41 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.18 -54.27 36.27 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.248 177.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.449 ' O ' ' C ' ' A' ' 39' ' ' LEU . 0.8 OUTLIER -75.01 -17.97 60.43 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.503 -1.226 . . . . 0.0 113.284 -177.41 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.636 HD11 ' CB ' ' B' ' 120' ' ' TYR . 1.0 OUTLIER -9.49 105.67 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 -178.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER 85.77 -8.06 0.8 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 178.405 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.34 66.15 0.69 Allowed 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.6 141.35 35.11 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 120.751 0.31 . . . . 0.0 111.595 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 178.87 97.59 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.84 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -80.05 155.47 27.56 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.055 0.455 . . . . 0.0 111.8 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -153.34 162.44 41.29 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.972 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 3.6 t -125.05 60.54 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 120.954 0.407 . . . . 0.0 111.723 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.09 147.18 50.84 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.024 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -153.98 -178.12 6.87 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.24 124.66 11.63 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.231 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -82.5 179.97 7.62 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.708 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.9 116.57 1.88 Allowed Glycine 0 C--N 1.338 0.676 0 C-N-CA 121.144 -0.55 . . . . 0.0 113.034 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.0 mtm -148.76 -92.65 0.07 Allowed 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.619 0.209 . . . . 0.0 111.343 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.7 t 58.82 67.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-O 121.221 0.534 . . . . 0.0 111.34 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -113.07 101.63 9.63 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.177 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 96.3 t -142.64 -83.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 121.424 0.631 . . . . 0.0 111.819 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 70.26 85.39 0.13 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.64 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 58' ' ' PHE . 0.0 OUTLIER -158.04 126.67 5.54 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.682 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.527 ' O ' HD13 ' A' ' 59' ' ' ILE . 5.8 t80 165.19 105.44 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.053 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.527 HD13 ' O ' ' A' ' 58' ' ' PHE . 29.4 mm -144.44 63.68 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.614 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -140.96 175.34 9.69 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.401 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 6.5 mmm -153.31 177.17 11.15 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.43 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -114.72 161.72 17.77 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.415 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 161.72 136.88 2.08 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.245 -0.502 . . . . 0.0 112.638 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.9 t -148.95 153.48 38.02 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.076 0.465 . . . . 0.0 111.639 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -84.45 91.49 7.84 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.131 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -131.14 62.8 1.61 Allowed 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 121.135 0.493 . . . . 0.0 111.027 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -75.34 99.24 4.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.41 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -122.08 112.27 18.02 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.82 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -135.13 -74.84 0.46 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.11 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.45 ' HE2' ' O ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER 175.36 -32.15 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.45 ' O ' ' HE2' ' A' ' 70' ' ' LYS . 1.8 t0 91.45 139.08 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.227 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.256 1.395 0 CA-C-O 118.668 -0.682 . . . . 0.0 111.521 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.78 ' HA ' ' HB3' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -40.5 135.73 1.47 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.69 0.281 . . . . 0.0 111.09 179.868 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.672 ' HG2' ' CE2' ' A' ' 14' ' ' TYR . 1.1 tt0 -109.84 116.73 32.19 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 121.072 0.463 . . . . 0.0 111.671 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.775 ' NH1' HG21 ' A' ' 6' ' ' THR . 2.6 ttp85 -78.08 106.5 10.0 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.827 HG12 HG13 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -103.88 130.08 55.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.81 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.736 HG21 ' NH2' ' B' ' 104' ' ' ARG . 0.1 OUTLIER -131.06 126.12 35.0 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.795 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.882 HG22 HG22 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -101.86 102.94 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.319 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 1.063 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -70.76 67.24 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 122.131 -0.356 . . . . 0.0 111.398 -179.472 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.882 HG22 HG22 ' B' ' 107' ' ' VAL . 3.7 m -99.31 -124.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.661 ' HB2' ' O ' ' B' ' 109' ' ' VAL . 10.4 t0 157.02 -83.13 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.543 ' HA ' ' CD ' ' B' ' 115' ' ' GLN . 3.8 t -102.63 12.56 36.18 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.638 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 29' ' ' SER . 1.8 t0 -75.56 59.28 1.11 Allowed 'General case' 0 C--N 1.36 1.059 0 CA-C-N 120.191 1.359 . . . . 0.0 108.304 178.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 29' ' ' SER . 13.3 m 64.11 -20.55 0.07 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.177 -177.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.787 ' HA ' ' SD ' ' A' ' 32' ' ' MET . 0.7 OUTLIER -46.61 -60.33 2.45 Favored 'General case' 0 C--N 1.351 0.674 0 CA-C-O 121.383 0.611 . . . . 0.0 110.326 179.305 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.654 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 1.8 pt20 -49.53 -40.39 37.77 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.766 -1.107 . . . . 0.0 112.643 -177.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.708 HD13 ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -55.55 -42.09 74.16 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.111 0.481 . . . . 0.0 111.62 179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.751 HD11 ' HG ' ' B' ' 127' ' ' LEU . 0.5 OUTLIER -59.03 -52.4 65.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.633 179.753 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.704 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.5 pttt -73.38 -30.45 63.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.209 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.478 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -59.48 -29.21 67.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.198 178.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.703 ' CE2' HD13 ' B' ' 117' ' ' LEU . 0.1 OUTLIER -87.7 -41.64 13.21 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.475 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.519 ' N ' ' CD1' ' B' ' 120' ' ' TYR . 0.7 OUTLIER 155.1 24.01 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 176.786 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 121' ' ' ASP . 71.0 t -162.38 101.58 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.629 ' HA ' ' HB3' ' B' ' 118' ' ' LYS . 33.4 m-80 -53.14 -84.62 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.11 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -161.89 3.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 178.308 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.483 ' HB2' ' OP1' ' C' ' 177' ' ' ' DG' . 0.2 OUTLIER -38.54 -63.5 0.5 Allowed 'General case' 0 C--O 1.241 0.658 0 CA-C-N 118.249 0.477 . . . . 0.0 110.691 -177.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -88.14 -29.91 18.61 Favored Glycine 0 C--N 1.335 0.517 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.234 178.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.751 ' HG ' HD11 ' B' ' 117' ' ' LEU . 0.2 OUTLIER -58.6 -60.4 3.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.854 0.462 . . . . 0.0 111.127 179.518 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.11 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.3 t -55.16 -61.54 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.963 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.733 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 10.6 p -50.71 -42.17 56.8 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 178.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 16.5 m -67.82 -55.17 14.0 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.698 HG22 ' O ' ' B' ' 128' ' ' VAL . 1.8 t -53.55 -42.63 67.68 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.242 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.97 ' HE3' HG21 ' A' ' 24' ' ' ILE . 4.3 mtt -58.18 -54.93 41.38 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.587 178.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.17 -37.46 22.48 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.944 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -52.62 13.15 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.407 ' CB ' HD21 ' A' ' 17' ' ' LEU . 3.0 mp0 -69.45 -15.3 63.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.928 0.394 . . . . 0.0 110.343 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.625 ' N ' ' O ' ' B' ' 132' ' ' MET . . . -81.96 -50.18 9.43 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 123.263 0.625 . . . . 0.0 109.512 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -54.33 29.59 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.718 0.77 . . . . 0.0 109.595 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -67.18 -42.42 84.26 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.916 -178.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.001 HD11 ' CB ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 29.1 62.73 0.13 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.489 0.661 . . . . 0.0 111.775 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.06 176.68 10.92 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.012 -179.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -149.05 159.6 44.08 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.22 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -137.67 -122.38 0.14 Allowed 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.373 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.43 ' O ' ' HB3' ' B' ' 144' ' ' TRP . 1.0 OUTLIER 77.42 157.92 0.19 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 122.537 0.335 . . . . 0.0 111.48 -179.749 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . 0.435 ' O ' ' HB3' ' B' ' 145' ' ' LYS . 63.9 t-105 87.82 129.03 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.087 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.435 ' HB3' ' O ' ' B' ' 144' ' ' TRP . 0.2 OUTLIER 169.52 121.84 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.386 179.423 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 8.1 p -147.4 150.22 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.678 0.275 . . . . 0.0 111.453 -179.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' B' ' 147' ' ' GLU . 3.6 pm0 -73.5 120.36 19.0 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.014 0.435 . . . . 0.0 111.183 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -138.01 152.01 48.45 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.49 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -134.26 142.16 47.24 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.292 179.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 72.84 147.77 0.09 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.772 0.32 . . . . 0.0 110.969 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -175.55 79.46 0.07 OUTLIER Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.672 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 64.9 mtm -111.21 164.62 12.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 3.2 t -141.75 46.72 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-O 121.045 0.45 . . . . 0.0 110.775 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -96.65 115.57 27.65 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.869 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 6.0 t -141.71 -123.56 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.826 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.668 ' HB1' ' CE1' ' B' ' 158' ' ' PHE . . . 56.93 76.75 0.29 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.195 0.521 . . . . 0.0 111.848 179.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.22 98.55 11.35 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.071 0.462 . . . . 0.0 111.155 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.668 ' CE1' ' HB1' ' B' ' 156' ' ' ALA . 0.0 OUTLIER -175.88 74.64 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.484 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 2.4 mp -116.69 -78.15 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.994 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -159.87 -62.97 0.07 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -152.6 178.38 9.66 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.908 0.385 . . . . 0.0 111.607 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -153.97 116.94 4.48 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.934 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . 143.17 101.42 0.38 Allowed Glycine 0 C--N 1.335 0.477 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.099 -179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . 0.512 ' O ' ' HB2' ' B' ' 165' ' ' PHE . 1.4 m -145.69 -153.43 0.48 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 122.731 -0.276 . . . . 0.0 111.34 -179.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . 0.512 ' HB2' ' O ' ' B' ' 164' ' ' SER . 1.0 OUTLIER 78.67 150.51 0.11 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.948 0.499 . . . . 0.0 111.519 -179.717 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -162.27 -69.65 0.05 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.127 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 60.41 27.34 16.94 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.46 72.97 1.39 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.129 0.49 . . . . 0.0 110.731 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -113.18 -165.07 0.96 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.577 -179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 1.1 ptmm? -161.67 -33.18 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.656 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 4.0 m-20 77.02 157.91 0.19 Allowed 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.85 178.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 63.1 p-90 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.524 -0.751 . . . . 0.0 111.425 -179.771 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.493 H2'' " H5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.803 0 C3'-C2'-C1' 105.591 2.065 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.895 H2'' ' N7 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 P--O3' 1.615 0.672 0 C3'-C2'-C1' 101.321 -0.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.895 ' N7 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.562 0 O4'-C1'-C2' 107.246 1.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.74 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.862 0 C1'-O4'-C4' 107.822 -1.342 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.485 " H2'" ' H71' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C4'-C3'-C2' 104.232 1.032 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.629 ' H72' ' OG1' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.827 0 C4'-C3'-C2' 104.744 1.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.621 " H2'" ' H72' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.53 0 C3'-C2'-C1' 105.327 1.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.814 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 C3'-C2'-C1' 100.62 -1.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.814 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 O4'-C1'-C2' 107.145 0.95 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.564 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.526 0.794 0 C3'-C2'-C1' 105.494 1.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.564 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O4'-C1'-C2' 106.995 0.814 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.435 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 N19-C1'-C2' 115.23 0.644 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C4'-C3'-C2' 100.902 -2.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.504 ' H72' " H2'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.606 0 N19-C1'-C2' 115.45 0.781 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.504 " H2'" ' H72' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.777 0 C4'-C3'-C2' 104.884 1.684 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.498 " H2'" ' C8 ' ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O4'-C1'-C2' 106.798 0.634 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.777 " H2'" " O4'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 O4'-C4'-C3' 103.96 -1.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.777 " O4'" " H2'" ' D' ' 189' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.405 -1.14 0 C4'-C3'-C2' 104.722 1.522 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.605 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C3'-C2'-C1' 105.022 1.658 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.461 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.65 0 C3'-C2'-C1' 104.515 1.296 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.41 ' N3 ' ' N1 ' ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 N19-C1'-C2' 115.315 0.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.515 H2'' " O5'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 C3'-C2'-C1' 105.232 1.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.515 " O5'" H2'' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.409 -0.828 0 C1'-O4'-C4' 107.956 -1.246 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.633 0 C1'-O4'-C4' 111.171 1.05 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.795 0 C4'-C3'-C2' 104.113 0.913 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 C1'-O4'-C4' 110.386 0.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.425 ' O ' ' HG2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.425 ' HG2' ' O ' ' A' ' 1' ' ' MET . 0.4 OUTLIER -146.48 127.0 14.12 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 179.251 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.685 ' CB ' ' HB2' ' B' ' 110' ' ' ASP . 46.1 tt0 -116.22 118.76 33.68 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.301 0.572 . . . . 0.0 110.601 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.945 ' HG3' HG22 ' B' ' 108' ' ' THR . 0.0 OUTLIER -79.18 105.9 10.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.206 -178.503 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.821 HD12 HD11 ' B' ' 124' ' ' ILE . 0.2 OUTLIER -104.06 109.86 28.56 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.093 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.126 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -115.14 121.91 44.46 Favored 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.146 -176.587 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.872 HG13 HG12 ' B' ' 105' ' ' ILE . 0.2 OUTLIER -100.23 106.45 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 176.723 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.558 ' HB ' ' HB3' ' B' ' 102' ' ' LYS . 18.1 p -70.06 81.01 0.49 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.022 0.439 . . . . 0.0 110.601 -178.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 1.162 HG21 ' CD1' ' A' ' 14' ' ' TYR . 14.8 m -73.69 -141.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.627 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.644 ' HB3' ' O ' ' A' ' 9' ' ' VAL . 27.4 t70 88.88 -12.45 0.41 Allowed 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -124.53 -58.93 1.49 Allowed 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.664 ' HB2' ' OG ' ' B' ' 129' ' ' SER . 1.2 m-20 -46.96 -98.59 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.546 ' HB3' ' HB3' ' B' ' 133' ' ' GLN . 0.5 OUTLIER -176.12 41.32 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 O-C-N 121.212 -0.93 . . . . 0.0 111.82 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 1.162 ' CD1' HG21 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -81.97 -41.49 20.71 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.94 0.896 . . . . 0.0 113.169 -179.474 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.536 ' HA ' ' CG ' ' A' ' 18' ' ' LYS . 1.8 mp0 -49.47 -46.59 48.25 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -176.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.522 ' HB3' ' CB ' ' B' ' 136' ' ' ALA . 0.4 OUTLIER -50.02 -30.77 11.36 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.419 0.554 . . . . 0.0 111.917 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.045 HD12 ' SD ' ' B' ' 132' ' ' MET . 0.2 OUTLIER -78.14 -55.14 5.51 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.54 178.614 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.673 ' HD3' ' CE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -69.06 -25.54 64.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.335 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 15' ' ' GLN . . . -54.54 -33.17 59.59 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.064 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.629 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 20.0 m-85 -88.87 -45.99 9.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.905 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.629 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 143.1 46.37 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 O-C-N 124.413 1.071 . . . . 0.0 110.824 178.85 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.618 HG21 HD21 ' B' ' 139' ' ' LEU . 7.5 t -128.24 73.45 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.333 -178.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.963 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -76.14 45.35 0.36 Allowed 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.983 ' HB ' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER 39.91 0.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 118.316 2.71 . . . . 0.0 118.316 177.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 1.039 ' HA ' HG22 ' B' ' 107' ' ' VAL . 3.1 p -39.35 -64.9 0.43 Allowed 'General case' 0 C--O 1.253 1.256 0 CA-C-N 119.272 0.942 . . . . 0.0 110.667 -177.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.416 ' N ' ' OG ' ' A' ' 25' ' ' SER . . . -80.53 -26.63 53.88 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.929 -0.653 . . . . 0.0 111.984 177.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.898 HD22 HD11 ' A' ' 17' ' ' LEU . 6.6 tp -66.2 -61.34 2.08 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.01 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.983 HG23 ' HB ' ' A' ' 24' ' ' ILE . 6.5 t -44.23 -66.7 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.486 ' HB3' ' O ' ' B' ' 112' ' ' ASP . 0.7 OUTLIER -50.03 -37.44 33.06 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 178.424 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.5 m -71.92 -58.5 3.4 Favored 'General case' 0 CA--C 1.507 -0.691 0 O-C-N 121.81 -0.556 . . . . 0.0 109.916 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.572 ' CG2' HD11 ' B' ' 127' ' ' LEU . 1.0 OUTLIER -54.47 -31.61 56.07 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.586 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.991 ' SD ' ' HB2' ' B' ' 117' ' ' LEU . 5.7 mmt -56.32 -57.26 13.02 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.083 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.581 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 2.6 tt0 -50.12 -34.16 21.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -72.33 -48.99 37.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.79 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.541 ' HB3' HD21 ' B' ' 117' ' ' LEU . 3.5 mm-40 -79.63 -15.25 57.97 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.754 0.312 . . . . 0.0 110.311 177.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.605 ' HB1' ' HB3' ' B' ' 116' ' ' LEU . . . -88.06 -29.96 20.27 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.159 0.584 . . . . 0.0 110.418 178.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -75.73 -55.41 5.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.582 0.706 . . . . 0.0 110.299 179.625 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -83.39 -35.66 24.9 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.04 -178.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.107 HD23 ' CD2' ' B' ' 120' ' ' TYR . 1.0 OUTLIER 46.11 28.34 0.64 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.986 0.514 . . . . 0.0 112.12 -178.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER 170.55 111.35 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.556 0.342 . . . . 0.0 110.782 179.611 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.72 -56.31 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.428 ' C ' ' HG3' ' A' ' 43' ' ' ARG . 0.6 OUTLIER 62.18 174.38 0.13 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.345 -179.726 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.428 ' HG3' ' C ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -144.2 -60.89 0.39 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.229 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER 43.53 63.45 1.55 Allowed 'General case' 0 C--O 1.238 0.467 0 CA-C-O 121.277 0.56 . . . . 0.0 111.036 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -154.66 149.84 27.02 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.219 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 12.8 p -79.57 143.98 11.64 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.24 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.18 150.18 39.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.351 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -116.92 -178.98 3.56 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.394 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -159.74 -153.61 0.36 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.397 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.421 ' O ' ' NH1' ' B' ' 143' ' ' ARG . 0.0 OUTLIER 71.2 175.66 0.29 Allowed 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 179.357 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 120.23 -116.42 3.24 Favored Glycine 0 C--N 1.338 0.692 0 CA-C-N 115.938 -0.573 . . . . 0.0 112.822 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.1 ttp 56.53 78.56 0.21 Allowed 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 11.3 m -83.78 176.97 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.961 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.672 ' CD ' HG23 ' A' ' 55' ' ' VAL . 4.8 tm-20 -75.04 -81.69 0.07 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.78 -0.191 . . . . 0.0 110.812 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.672 HG23 ' CD ' ' A' ' 54' ' ' GLU . 15.5 t -132.81 -122.36 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 110.459 -0.2 . . . . 0.0 110.459 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 55' ' ' VAL . . . 77.47 106.96 0.08 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.047 0.451 . . . . 0.0 111.108 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -103.92 138.66 40.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.52 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -173.7 102.88 0.11 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.238 0.542 . . . . 0.0 110.802 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 16.9 mm -90.49 77.47 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.346 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.92 167.48 26.51 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.178 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 69.93 -179.2 0.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.808 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -162.16 179.9 7.57 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.381 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 125.13 168.86 12.84 Favored Glycine 0 C--N 1.335 0.501 0 C-N-CA 121.13 -0.557 . . . . 0.0 112.959 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.1 m -129.96 76.99 1.76 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.901 0.381 . . . . 0.0 111.386 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.411 ' O ' ' HA ' ' B' ' 145' ' ' LYS . 0.6 OUTLIER -157.92 120.45 3.8 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.26 179.83 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.81 173.28 8.63 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.618 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.48 ' CG ' ' HB3' ' B' ' 147' ' ' GLU . 14.0 t70 -166.86 -55.25 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.008 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.604 ' H ' HG11 ' B' ' 146' ' ' VAL . 0.4 OUTLIER 79.19 -139.06 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.77 -179.34 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' A' ' 68' ' ' GLU . 0.6 OUTLIER 81.27 97.75 0.05 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.127 0.571 . . . . 0.0 110.947 -179.402 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.453 ' O ' ' CB ' ' A' ' 71' ' ' ASP . 14.4 mmtm -151.89 -41.21 0.11 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.453 ' CB ' ' O ' ' A' ' 70' ' ' LYS . 1.5 t70 93.88 -49.25 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.858 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 118.524 -0.751 . . . . 0.0 110.523 178.925 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.52 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 111.25 0.093 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.558 ' HB3' ' HB ' ' A' ' 8' ' ' THR . 0.0 OUTLIER 81.34 114.12 0.06 Allowed 'General case' 0 N--CA 1.469 0.523 0 O-C-N 123.785 0.678 . . . . 0.0 111.088 -179.475 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.566 ' HB3' HG23 ' A' ' 9' ' ' VAL . 28.8 tp60 -98.72 116.52 31.14 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.242 0.544 . . . . 0.0 111.048 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.447 ' HB2' HH11 ' B' ' 104' ' ' ARG . 0.0 OUTLIER -78.55 99.9 6.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.483 -178.399 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.872 HG12 HG13 ' A' ' 7' ' ' VAL . 0.4 OUTLIER -103.05 118.51 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.736 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.067 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.682 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -122.33 129.4 52.11 Favored 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.871 -176.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 1.039 HG22 ' HA ' ' A' ' 25' ' ' SER . 0.9 OUTLIER -99.04 96.06 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.868 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.945 HG22 ' HG3' ' A' ' 4' ' ' ARG . 46.6 p -70.01 67.65 0.29 Allowed 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.957 HG11 ' CB ' ' B' ' 114' ' ' TYR . 6.7 p -80.56 -117.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.264 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.685 ' HB2' ' CB ' ' A' ' 3' ' ' GLN . 35.6 t70 85.47 1.29 0.7 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -174.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.54 ' H ' HG22 ' B' ' 109' ' ' VAL . 0.4 OUTLIER -101.45 -67.02 0.88 Allowed 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.269 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 29' ' ' SER . 0.5 OUTLIER -133.78 142.3 47.85 Favored 'General case' 0 C--N 1.351 0.643 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -176.512 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.64 ' HB2' ' HB2' ' A' ' 32' ' ' MET . 0.8 OUTLIER 46.48 -23.79 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 118.824 2.898 . . . . 0.0 118.824 174.89 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.957 ' CB ' HG11 ' B' ' 109' ' ' VAL . 0.6 OUTLIER -52.13 -61.99 1.92 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 120.079 1.309 . . . . 0.0 111.6 -178.314 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.635 ' HA ' ' HE3' ' B' ' 118' ' ' LYS . 77.6 mt-30 -49.56 -37.62 28.02 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.113 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -58.49 -57.16 14.17 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.991 ' HB2' ' SD ' ' A' ' 32' ' ' MET . 1.0 OUTLIER -49.5 -45.67 47.37 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.187 0.518 . . . . 0.0 111.674 -178.176 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.685 ' HB3' ' HA ' ' B' ' 123' ' ' ASN . 3.4 pttp -80.26 -36.83 34.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.249 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.558 ' N ' ' HG3' ' B' ' 118' ' ' LYS . . . -68.29 -23.88 64.8 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.914 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 1.107 ' CD2' HD23 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -87.76 -42.71 12.41 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.04 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.45 ' CB ' ' O ' ' B' ' 120' ' ' TYR . 0.4 OUTLIER 163.34 17.91 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.535 ' C ' ' H ' ' B' ' 124' ' ' ILE . 72.4 t -146.98 85.28 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.349 0 O-C-N 121.581 -0.699 . . . . 0.0 112.709 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.883 ' O ' HD12 ' B' ' 124' ' ' ILE . 0.4 OUTLIER -69.11 50.21 0.08 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.557 0.694 . . . . 0.0 109.977 178.515 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.034 HG22 HD12 ' B' ' 127' ' ' LEU . 1.6 pp 33.28 0.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 N-CA-C 120.103 3.372 . . . . 0.0 120.103 179.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.547 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 0.4 OUTLIER -38.27 -62.47 0.58 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 118.525 0.602 . . . . 0.0 110.791 -178.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.403 ' N ' ' OG ' ' B' ' 125' ' ' SER . . . -80.66 -27.08 52.34 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.695 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 1.034 HD12 HG22 ' B' ' 124' ' ' ILE . 1.9 tm? -67.04 -61.49 1.91 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.929 0.365 . . . . 0.0 110.978 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.022 HG23 ' HB ' ' B' ' 124' ' ' ILE . 12.3 t -48.63 -68.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.249 0 C-N-CA 121.139 -0.224 . . . . 0.0 111.386 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.664 ' OG ' ' HB2' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -49.86 -31.27 11.65 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.917 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 13.0 m -71.65 -54.67 9.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.46 ' HA ' HD22 ' B' ' 134' ' ' ASN . 7.2 m -53.9 -36.47 62.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.183 178.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 1.045 ' SD ' HD12 ' A' ' 17' ' ' LEU . 5.3 mmm -53.15 -57.05 11.77 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.12 178.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.546 ' HB3' ' HB3' ' A' ' 13' ' ' SER . 0.0 OUTLIER -58.53 -36.01 73.2 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.109 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . 0.499 ' N ' ' HG3' ' B' ' 133' ' ' GLN . 0.0 OUTLIER -75.67 -48.42 22.12 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.087 -179.249 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.48 -19.25 60.45 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.692 177.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.522 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . . . -72.37 -47.72 47.29 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 177.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.524 ' HA ' ' NE ' ' B' ' 137' ' ' ARG . 0.0 OUTLIER -65.84 -56.4 12.07 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-O 121.444 0.64 . . . . 0.0 109.912 178.22 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 -62.64 -51.63 66.51 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.32 -179.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.618 HD21 HG21 ' A' ' 22' ' ' VAL . 0.3 OUTLIER 33.17 43.37 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.542 0.737 . . . . 0.0 112.545 -179.309 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.57 97.77 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.614 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -81.86 125.79 31.11 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.684 -0.235 . . . . 0.0 111.429 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -165.53 101.2 0.7 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.814 -179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.421 ' NH1' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -166.27 179.52 5.61 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.756 0.312 . . . . 0.0 111.748 179.82 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -160.0 160.07 32.88 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.094 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . 0.442 ' HD2' ' N ' ' B' ' 146' ' ' VAL . 0.0 OUTLIER -86.7 118.28 26.0 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.9 0.381 . . . . 0.0 111.618 -179.69 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.604 HG11 ' H ' ' A' ' 68' ' ' GLU . 5.4 t -117.89 -82.54 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.089 178.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . 0.48 ' HB3' ' CG ' ' A' ' 67' ' ' ASP . 0.5 OUTLIER -143.61 -100.09 0.12 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 119.654 -0.213 . . . . 0.0 110.956 178.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -175.59 113.1 0.13 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.15 0.432 . . . . 0.0 111.812 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . 0.451 ' HG2' ' HA ' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -167.33 172.34 9.83 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.941 0.401 . . . . 0.0 111.799 179.736 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.48 135.41 51.2 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.832 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . -94.2 176.83 36.08 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 121.079 -0.581 . . . . 0.0 112.662 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 6.7 tpt -123.07 112.59 17.94 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.929 0.395 . . . . 0.0 111.75 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 27.0 m -118.32 161.39 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.714 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.53 -148.81 0.43 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.453 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' B' ' 156' ' ' ALA . 3.6 t -116.19 -124.26 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 O-C-N 122.406 -0.184 . . . . 0.0 110.638 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' B' ' 155' ' ' VAL . . . 176.29 103.3 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.877 0.37 . . . . 0.0 111.234 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.73 149.0 25.59 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.155 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -176.67 104.99 0.06 Allowed 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.313 0.578 . . . . 0.0 110.746 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . 0.446 ' N ' HD12 ' B' ' 159' ' ' ILE . 0.7 OUTLIER -137.92 38.66 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.458 -179.723 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -48.99 -53.16 21.07 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.768 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 65.48 -164.69 0.24 Allowed 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.782 0.325 . . . . 0.0 111.434 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -122.45 168.9 11.54 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.813 0.34 . . . . 0.0 111.307 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -128.41 174.13 18.95 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 121.087 -0.577 . . . . 0.0 112.888 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 3.6 m -177.8 163.18 1.81 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.766 0.317 . . . . 0.0 111.364 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -130.48 168.1 17.57 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.23 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -139.25 -138.67 0.13 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.822 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.05 -25.95 66.51 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 111.438 0.162 . . . . 0.0 111.438 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 60.2 66.63 0.94 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.066 0.46 . . . . 0.0 111.159 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -92.33 -63.7 1.2 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.826 -179.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.497 ' O ' ' HB3' ' B' ' 171' ' ' ASP . 7.4 pttp -174.79 -37.22 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.497 ' HB3' ' O ' ' B' ' 170' ' ' LYS . 35.1 t70 95.88 116.1 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 124.758 1.286 . . . . 0.0 110.433 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 1.1 t90 . . . . . 0 C--O 1.253 1.244 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.893 -179.093 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.737 " C2'" H5'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.447 1.246 0 C2'-C3'-O3' 114.918 1.599 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.737 H5'' " C2'" ' C' ' 173' ' ' ' DA' . . . . . . . . 0 P--O3' 1.617 0.829 0 C3'-C2'-C1' 105.484 1.988 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.666 ' C8 ' " H2'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 C1'-O4'-C4' 110.533 0.595 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.654 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.963 0 C1'-O4'-C4' 107.502 -1.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.976 ' C8 ' ' H72' ' C' ' 178' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C4'-C3'-C2' 104.332 1.132 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.976 ' H72' ' C8 ' ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.408 -0.925 0 C1'-O4'-C4' 107.498 -1.573 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.837 " H2'" ' H71' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.592 0 C3'-C2'-C1' 105.389 1.921 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.837 ' H71' " H2'" ' C' ' 179' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.617 0 C3'-C2'-C1' 100.247 -1.752 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.59 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 C3'-C2'-C1' 104.574 1.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.656 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.898 0 C3'-C2'-C1' 105.063 1.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.656 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.632 0 C1'-O4'-C4' 110.721 0.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.51 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.764 0 N19-C1'-C2' 115.006 0.503 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.568 0 C4'-C3'-C2' 100.94 -2.26 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.86 H2'' " O5'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.44 0.691 0 O4'-C1'-C2' 107.177 0.979 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.86 " O5'" H2'' ' D' ' 186' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 N19-C1'-C2' 115.777 0.986 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.655 0 O4'-C1'-C2' 107.062 0.875 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C3'-C2'-C1' 101.978 -0.516 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.61 " H2'" ' H71' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.803 0 C4'-C3'-C2' 104.849 1.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.61 ' H71' " H2'" ' D' ' 190' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.817 0 C4'-C3'-C2' 103.877 0.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.594 ' N7 ' H2'' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C3'-C2'-C1' 104.668 1.406 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.447 ' C6 ' H2'' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 N19-C1'-C2' 115.581 0.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.434 ' C5 ' ' C4 ' ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.41 -0.739 0 C4'-C3'-C2' 104.818 1.618 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.434 ' C4 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.405 -1.126 0 C1'-O4'-C4' 106.985 -1.939 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.623 0 C1'-O4'-C4' 110.987 0.919 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.898 0 C4'-C3'-C2' 104.492 1.292 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.424 ' N1 ' ' N3 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 C3'-C2'-C1' 101.96 -0.528 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.618 ' HE3' ' HA ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -139.79 115.45 10.08 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.584 0.706 . . . . 0.0 111.517 178.753 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.657 ' HB3' ' HA ' ' B' ' 110' ' ' ASP . 43.4 tp60 -117.69 109.15 16.28 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.373 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 1.062 ' HG3' HG23 ' B' ' 108' ' ' THR . 17.8 ttp-105 -79.31 111.58 15.69 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.786 -0.765 . . . . 0.0 109.819 179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.787 HD11 HG11 ' A' ' 28' ' ' VAL . 3.3 pt -102.34 127.8 55.61 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.771 ' HB ' ' CB ' ' B' ' 106' ' ' THR . 0.6 OUTLIER -131.71 124.73 30.4 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -177.791 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.622 HG13 ' CG1' ' B' ' 105' ' ' ILE . 0.2 OUTLIER -99.43 105.56 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.206 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.653 ' OG1' " H2'" ' C' ' 176' ' ' ' DT' . 14.5 p -70.19 89.72 0.65 Allowed 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.891 -1.152 . . . . 0.0 107.891 178.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.852 HG11 ' CB ' ' A' ' 14' ' ' TYR . 3.8 p -108.36 -119.89 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.814 -177.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.681 ' N ' HG22 ' A' ' 9' ' ' VAL . 0.8 OUTLIER 77.41 10.25 2.41 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-O 122.491 1.138 . . . . 0.0 109.089 -174.747 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.443 ' OG ' ' NZ ' ' B' ' 102' ' ' LYS . 0.5 OUTLIER -128.46 -66.83 0.82 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.507 178.59 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.824 ' CB ' ' HB3' ' B' ' 129' ' ' SER . 1.1 m-20 -51.74 -79.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -177.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.728 ' CB ' ' HB2' ' B' ' 133' ' ' GLN . 1.0 OUTLIER 177.28 40.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.39 0.995 . . . . 0.0 111.683 -178.513 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.852 ' CB ' HG11 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -82.67 -49.84 9.38 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.333 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.56 ' CD ' ' HA ' ' A' ' 10' ' ' ASP . 1.1 mp0 -49.33 -37.69 25.31 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.984 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.7 OUTLIER -56.61 -56.73 17.63 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.598 0.636 . . . . 0.0 111.687 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.786 ' HB2' ' HG2' ' B' ' 132' ' ' MET . 0.2 OUTLIER -50.48 -48.11 56.91 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.108 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.559 ' HD3' ' OH ' ' A' ' 14' ' ' TYR . 1.9 pttt -80.28 -35.59 35.65 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.475 -178.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.518 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -70.39 -22.64 62.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.256 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.146 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.0 OUTLIER -87.83 -41.54 13.18 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-O 118.805 -0.617 . . . . 0.0 109.855 179.269 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.518 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER 168.52 -7.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 177.382 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.685 ' HB ' ' CD1' ' A' ' 17' ' ' LEU . 72.2 t -122.08 85.95 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -177.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.028 ' O ' HD12 ' A' ' 24' ' ' ILE . 11.2 p30 -65.08 48.41 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.701 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.028 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER 48.08 -15.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 N-CA-C 117.203 2.298 . . . . 0.0 117.203 -179.546 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 23' ' ' ASN . 30.4 t -38.28 -62.84 0.54 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 119.137 0.88 . . . . 0.0 109.509 -178.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.483 ' O ' ' HB ' ' A' ' 30' ' ' THR . . . -83.28 -27.21 40.78 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.245 177.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.59 ' CD1' ' HG3' ' B' ' 132' ' ' MET . 0.1 OUTLIER -60.02 -62.24 2.02 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.972 0.386 . . . . 0.0 110.703 179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.918 HG23 ' CG2' ' A' ' 24' ' ' ILE . 12.4 t -51.43 -66.38 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.775 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.535 ' HA ' ' O ' ' B' ' 112' ' ' ASP . 15.5 p -47.2 -40.84 16.97 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.483 ' HB ' ' O ' ' A' ' 26' ' ' GLY . 0.5 OUTLIER -78.1 -47.82 17.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 119.558 1.072 . . . . 0.0 109.304 178.321 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.788 HG21 HG21 ' B' ' 131' ' ' THR . 9.0 m -53.24 -47.37 69.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.796 ' HA ' HD23 ' B' ' 117' ' ' LEU . 6.2 mmt -55.05 -46.83 75.4 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.656 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.528 ' HB2' ' OG ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -57.3 -49.1 77.17 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.936 0.398 . . . . 0.0 110.336 178.445 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.477 ' N ' ' HG2' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -63.64 -50.49 69.11 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.24 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.906 ' HB3' HD21 ' B' ' 117' ' ' LEU . 2.9 mm-40 -72.13 -8.59 55.53 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.808 178.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.624 ' O ' HD11 ' A' ' 39' ' ' LEU . . . -88.39 -44.1 11.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 122.667 0.387 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -57.36 4.39 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.546 0.689 . . . . 0.0 110.004 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.483 ' C ' HD12 ' A' ' 39' ' ' LEU . 2.3 mtt180 -85.0 -36.53 21.24 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.55 -1.204 . . . . 0.0 113.352 -178.204 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.891 HD23 ' CD2' ' B' ' 120' ' ' TYR . 0.1 OUTLIER 42.47 66.36 0.76 Allowed 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.779 0.432 . . . . 0.0 110.578 -176.778 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -174.24 112.8 0.17 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.883 0.373 . . . . 0.0 111.67 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -114.75 122.94 47.96 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.672 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.33 177.7 8.25 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.082 0.468 . . . . 0.0 111.822 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.59 146.96 53.93 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.836 -179.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -117.77 161.04 20.35 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.471 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -100.12 -95.28 0.26 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 111.569 0.211 . . . . 0.0 111.569 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.7 p -177.84 157.12 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 120.987 0.422 . . . . 0.0 111.811 -179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.29 175.32 8.36 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.037 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -94.91 -168.63 1.85 Allowed 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.205 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -122.54 134.13 54.55 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.63 0.252 . . . . 0.0 111.162 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -147.02 157.93 43.77 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.754 0.312 . . . . 0.0 111.464 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 176.71 165.03 31.6 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.22 -0.514 . . . . 0.0 112.407 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.99 -66.64 0.3 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.8 p -142.81 162.75 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 120.769 0.319 . . . . 0.0 111.852 -179.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -49.03 152.78 1.01 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.457 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.6 t -113.33 -122.62 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.886 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -161.87 94.57 0.94 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.96 0.41 . . . . 0.0 111.443 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.02 161.19 5.26 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.698 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -168.63 102.14 0.41 Allowed 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.058 0.456 . . . . 0.0 110.434 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.451 HG12 ' HB ' ' A' ' 30' ' ' THR . 2.9 mt -109.02 -90.11 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.628 -0.715 . . . . 0.0 112.255 -178.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 45.73 81.2 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.12 0.486 . . . . 0.0 111.913 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.526 ' HG2' ' HG3' ' A' ' 33' ' ' GLN . 14.2 tpp -132.71 86.01 2.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.702 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -104.22 171.12 7.51 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.387 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 128.81 136.31 4.13 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.212 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.8 t -153.91 145.06 22.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.567 0.223 . . . . 0.0 111.083 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -174.23 98.48 0.1 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.186 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -162.02 54.41 0.24 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.091 0.472 . . . . 0.0 111.271 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -112.85 98.84 7.45 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.447 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.78 173.17 6.34 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.13 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -113.64 -164.89 0.95 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.749 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.49 ' NZ ' ' O ' ' A' ' 72' ' ' TRP . 0.6 OUTLIER -154.77 -44.17 0.09 Allowed 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 179.74 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' A' ' 72' ' ' TRP . 10.0 t70 80.48 111.75 0.07 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.115 -1.402 . . . . 0.0 111.912 178.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.49 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.3 t90 . . . . . 0 C--O 1.253 1.286 0 CA-C-O 118.709 -0.662 . . . . 0.0 111.416 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 2.9 ptt? . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 111.061 0.023 . . . . 0.0 111.061 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.443 ' NZ ' ' OG ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -77.52 144.68 37.47 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.668 0.271 . . . . 0.0 110.651 179.427 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.671 ' CB ' ' HB2' ' A' ' 10' ' ' ASP . 1.6 tp60 -114.2 121.77 44.75 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.146 0.498 . . . . 0.0 110.22 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.64 ' HD2' ' O4 ' ' C' ' 178' ' ' ' DT' . 0.3 OUTLIER -78.83 112.39 15.93 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.071 -179.454 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 0.755 HG21 ' CD2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -113.7 114.04 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.771 ' CB ' ' HB ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -117.57 129.01 55.51 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -174.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.999 HG23 HG13 ' B' ' 109' ' ' VAL . 0.5 OUTLIER -102.37 102.59 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 174.667 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 1.062 HG23 ' HG3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -71.22 67.29 0.45 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.371 -0.531 . . . . 0.0 111.223 -179.18 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.999 HG13 HG23 ' B' ' 107' ' ' VAL . 4.7 m -96.14 -127.64 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.736 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.657 ' HA ' ' HB3' ' A' ' 3' ' ' GLN . 1.4 t70 154.12 -89.18 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 -177.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . 0.647 ' HA ' ' HG2' ' B' ' 115' ' ' GLN . 39.0 t -94.19 9.47 37.8 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 118.685 -0.674 . . . . 0.0 111.521 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.535 ' O ' ' HA ' ' A' ' 29' ' ' SER . 2.3 m-20 -74.64 56.2 0.69 Allowed 'General case' 0 C--N 1.365 1.277 0 CA-C-N 119.943 1.247 . . . . 0.0 109.271 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.55 ' HA ' HD12 ' B' ' 116' ' ' LEU . 0.9 OUTLIER 62.07 -14.78 0.05 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.983 -178.774 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.825 ' CZ ' ' HD3' ' B' ' 118' ' ' LYS . 0.2 OUTLIER -53.87 -54.67 35.32 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.117 0.484 . . . . 0.0 110.135 178.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.657 ' O ' ' HG3' ' B' ' 118' ' ' LYS . 0.0 OUTLIER -48.38 -41.11 27.9 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.168 -178.17 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' HB1' ' A' ' 36' ' ' ALA . 3.9 mt -52.46 -53.89 39.56 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.044 -0.41 . . . . 0.0 111.433 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.906 HD21 ' HB3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -53.12 -41.1 64.71 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.764 0.792 . . . . 0.0 111.727 179.785 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.825 ' HD3' ' CZ ' ' B' ' 114' ' ' TYR . 1.6 pttt -79.81 -25.74 40.75 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.51 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -59.24 -23.36 62.27 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.891 ' CD2' HD23 ' A' ' 39' ' ' LEU . 2.1 m-85 -88.35 -37.88 15.58 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.987 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.643 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 2.2 t70 117.98 75.05 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.629 1.205 . . . . 0.0 111.948 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.848 ' CG1' HD12 ' B' ' 117' ' ' LEU . 0.3 OUTLIER -166.8 -40.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.859 -179.306 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 65.59 -108.04 0.15 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 0.965 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.2 OUTLIER -153.06 2.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 178.576 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.553 ' HB3' ' OP1' ' C' ' 177' ' ' ' DG' . 81.8 p -39.04 -63.26 0.55 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.472 ' O ' ' HB ' ' B' ' 130' ' ' THR . . . -86.27 -31.52 19.37 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.303 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.723 ' HB3' HG22 ' B' ' 124' ' ' ILE . 8.4 tp -56.97 -62.2 1.91 Allowed 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 117.3 0.55 . . . . 0.0 111.52 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.965 HG23 ' CG2' ' B' ' 124' ' ' ILE . 1.5 t -53.48 -59.55 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.797 0.808 . . . . 0.0 109.079 178.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.824 ' HB3' ' CB ' ' A' ' 12' ' ' ASP . 3.5 m -48.29 -50.09 31.28 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.194 -1.366 . . . . 0.0 112.965 179.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.472 ' HB ' ' O ' ' B' ' 126' ' ' GLY . 0.4 OUTLIER -83.57 -50.3 8.37 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 122.163 -0.336 . . . . 0.0 111.587 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.788 HG21 HG21 ' A' ' 31' ' ' THR . 0.5 OUTLIER -55.62 -41.94 74.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -179.153 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.953 ' SD ' HG13 ' B' ' 128' ' ' VAL . 0.0 OUTLIER -60.73 -46.72 89.32 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.333 178.912 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.728 ' HB2' ' CB ' ' A' ' 13' ' ' SER . 0.6 OUTLIER -49.26 -35.87 18.9 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 118.179 0.445 . . . . 0.0 110.526 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' B' ' 138' ' ' ARG . 0.0 OUTLIER -70.71 -49.22 49.29 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.513 179.279 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.591 ' CB ' HD21 ' A' ' 17' ' ' LEU . 30.3 mm-40 -77.92 -13.67 59.8 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.964 0.411 . . . . 0.0 110.612 177.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.984 ' HB1' ' HB3' ' A' ' 16' ' ' LEU . . . -83.55 -34.64 25.18 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.371 0.669 . . . . 0.0 110.074 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.81 -50.89 8.18 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.985 0.898 . . . . 0.0 109.933 178.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' B' ' 134' ' ' ASN . 0.0 OUTLIER -62.39 -20.21 64.21 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 113.849 -1.523 . . . . 0.0 114.143 -177.178 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 1.146 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -43.67 118.38 1.39 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.67 0.668 . . . . 0.0 111.081 -179.418 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.42 156.21 8.13 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -179.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -132.94 124.78 28.45 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.877 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' B' ' 143' ' ' ARG . 9.8 tm-20 -62.3 -73.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.194 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' B' ' 142' ' ' GLU . 0.0 OUTLIER 177.07 -58.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.413 -179.818 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 29.4 t-105 -118.6 -29.85 5.31 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.38 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.62 102.08 0.07 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.015 0.436 . . . . 0.0 110.912 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.562 ' O ' HG13 ' B' ' 146' ' ' VAL . 8.9 p -69.21 79.08 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.332 0.587 . . . . 0.0 111.251 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.09 176.32 5.19 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.362 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -143.78 156.13 44.39 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.017 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -91.33 66.95 5.65 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.151 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.74 -59.25 5.68 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.252 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 101.46 163.1 27.27 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.984 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -103.05 123.36 46.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.722 0.296 . . . . 0.0 110.87 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 10.5 p -94.91 139.76 18.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.39 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.02 176.85 9.4 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.213 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.401 HG12 ' N ' ' B' ' 156' ' ' ALA . 5.6 t -104.57 -123.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.228 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.401 ' N ' HG12 ' B' ' 155' ' ' VAL . . . -175.58 58.89 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.705 0.288 . . . . 0.0 111.239 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 55.13 -166.47 0.1 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.463 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -170.77 99.89 0.23 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.009 0.433 . . . . 0.0 111.137 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 24.1 mm -139.39 104.16 2.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.04 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -75.85 114.88 14.97 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.324 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 9.0 mmt -122.71 144.26 49.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.019 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.45 132.11 35.18 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.14 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -91.58 179.73 41.84 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.617 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 11.3 p -158.09 159.99 36.85 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.595 0.236 . . . . 0.0 111.057 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -150.73 166.08 31.53 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.449 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -134.01 127.66 32.76 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.466 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.78 126.15 54.51 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.896 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.31 152.77 26.42 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.246 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -175.8 -161.82 0.09 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.493 ' O ' ' HB3' ' B' ' 171' ' ' ASP . 0.0 OUTLIER -175.08 -31.41 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.405 -179.807 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.493 ' HB3' ' O ' ' B' ' 170' ' ' LYS . 36.6 t70 90.81 -105.33 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.392 1.077 . . . . 0.0 111.285 179.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 40.0 t-105 . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.071 -0.966 . . . . 0.0 111.159 -179.936 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.495 H2'' ' C6 ' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 C3'-C2'-C1' 101.285 -1.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.594 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 101.333 -0.976 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.594 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.607 0 O4'-C1'-C2' 107.415 1.195 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.653 " H2'" ' OG1' ' A' ' 8' ' ' THR . . . . . . . . 0 O4'--C1' 1.407 -0.981 0 C1'-O4'-C4' 107.173 -1.805 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.628 " O5'" H2'' ' C' ' 176' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-C2' 107.111 0.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.64 ' O4 ' ' HD2' ' B' ' 104' ' ' ARG . . . . . . . . 0 O4'--C1' 1.408 -0.951 0 C1'-O4'-C4' 107.399 -1.643 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.522 H2'' " O5'" ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 C3'-C2'-C1' 104.996 1.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.714 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 C3'-C2'-C1' 100.754 -1.39 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.714 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 O4'-C1'-C2' 107.248 1.043 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.582 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.944 0 C3'-C2'-C1' 105.003 1.645 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.582 " O5'" H2'' ' C' ' 182' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 O4'-C1'-C2' 107.116 0.924 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.472 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.7 0 C4'-C3'-C2' 103.967 0.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.579 0 C4'-C3'-C2' 100.947 -2.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.609 0 O4'-C1'-C2' 106.951 0.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.485 H2'' " O5'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C3'-C2'-C1' 106.564 2.76 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.485 " O5'" H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 105.207 1.791 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.555 " H2'" ' OG1' ' B' ' 108' ' ' THR . . . . . . . . 0 O5'--C5' 1.432 -0.519 0 C4'-C3'-C2' 103.979 0.779 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.516 ' C8 ' ' C7 ' ' D' ' 191' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.528 1.018 0 C1'-O4'-C4' 105.987 -2.652 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.718 " H2'" ' N7 ' ' D' ' 192' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 105.308 1.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.718 ' N7 ' " H2'" ' D' ' 191' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 106.212 2.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.539 ' O4 ' ' HD3' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 C3'-C2'-C1' 104.845 1.532 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.602 " H1'" " O4'" ' D' ' 195' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.644 0 C3'-C2'-C1' 104.399 1.214 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.602 " O4'" " H1'" ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.406 -1.079 0 C1'-O4'-C4' 106.778 -2.087 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.429 ' C5 ' ' C4 ' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.572 0 C1'-O4'-C4' 110.881 0.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.429 ' C4 ' ' C5 ' ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.702 0 C4'-C3'-C2' 104.072 0.872 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.455 ' C2 ' ' N1 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.718 0 O4'-C4'-C3' 106.106 0.506 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.485 ' O ' ' HB2' ' A' ' 2' ' ' LYS . 1.7 ttp . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 120.562 0.22 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 1' ' ' MET . 7.4 mmtm 72.44 133.73 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.234 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.583 ' HB3' ' HB2' ' B' ' 110' ' ' ASP . 2.0 tt0 -108.8 112.38 24.62 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.531 0.681 . . . . 0.0 111.535 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.911 ' HG2' HG22 ' B' ' 106' ' ' THR . 8.3 ttm-85 -79.57 99.98 7.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.171 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.914 HG21 ' CE1' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -101.87 130.3 51.79 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.969 0 N-CA-C 106.787 -1.561 . . . . 0.0 106.787 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.974 ' HB ' HG23 ' B' ' 106' ' ' THR . 0.5 OUTLIER -127.09 134.23 50.28 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.344 -0.942 . . . . 0.0 112.765 -176.193 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 1.009 ' O ' HG23 ' B' ' 105' ' ' ILE . 0.9 OUTLIER -99.53 81.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 177.493 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.536 ' HA ' ' HA ' ' B' ' 104' ' ' ARG . 69.7 p -68.89 71.3 0.22 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.162 -0.961 . . . . 0.0 110.85 -178.191 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.852 HG21 ' HB3' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -77.89 -102.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.729 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.722 ' HB2' ' HA ' ' B' ' 102' ' ' LYS . 27.3 t0 113.88 14.09 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.363 0.665 . . . . 0.0 110.719 -178.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 177.73 -23.09 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.68 ' HB2' HG11 ' A' ' 9' ' ' VAL . 2.4 m-20 -72.27 56.01 0.34 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 -176.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.542 ' O ' ' HB3' ' B' ' 132' ' ' MET . 61.6 m 57.91 0.91 0.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 177.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.852 ' HB3' HG21 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -68.02 -49.31 62.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.507 ' HG3' ' CD2' ' A' ' 14' ' ' TYR . 4.5 mt-30 -49.41 -36.94 23.66 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -176.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB3' ' HB1' ' B' ' 136' ' ' ALA . 0.3 OUTLIER -63.16 -56.37 17.35 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.736 ' HB2' ' SD ' ' B' ' 132' ' ' MET . 0.4 OUTLIER -46.47 -47.17 19.27 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 112.169 -178.159 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.518 ' HB3' ' HA ' ' A' ' 23' ' ' ASN . 1.4 pttt -79.57 -29.67 41.36 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.818 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.443 ' N ' ' HG3' ' A' ' 18' ' ' LYS . . . -74.82 -25.35 58.96 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.019 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.947 ' CD2' HD23 ' B' ' 139' ' ' LEU . 0.1 OUTLIER -87.9 -38.13 15.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.234 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.507 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER 158.28 12.97 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 177.255 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.484 ' O ' HG12 ' A' ' 22' ' ' VAL . 75.8 t -134.34 79.91 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.584 -0.697 . . . . 0.0 111.716 -178.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.983 ' O ' HD12 ' A' ' 24' ' ' ILE . 0.7 OUTLIER -66.66 52.92 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.945 0.403 . . . . 0.0 111.349 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.983 HD12 ' O ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER 41.6 -8.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 118.375 2.731 . . . . 0.0 118.375 178.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.996 ' HA ' HG22 ' B' ' 107' ' ' VAL . 0.1 OUTLIER -38.73 -62.48 0.61 Allowed 'General case' 0 C--O 1.245 0.837 0 CA-C-N 120.13 1.332 . . . . 0.0 109.852 -178.464 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.85 -24.89 57.31 Favored Glycine 0 CA--C 1.522 0.506 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.621 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.7 ' HB3' HG22 ' A' ' 24' ' ' ILE . 7.8 tp -67.49 -61.5 1.87 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 117.207 0.503 . . . . 0.0 111.471 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.986 HG22 ' CG2' ' B' ' 128' ' ' VAL . 33.5 t -45.0 -63.0 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.61 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.778 ' HB3' ' HB2' ' B' ' 112' ' ' ASP . 7.4 p -48.78 -47.32 41.97 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.988 1.315 . . . . 0.0 113.091 177.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.6 m -61.5 -51.26 69.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.45 ' OG1' HG21 ' B' ' 131' ' ' THR . 7.1 m -59.11 -41.84 89.12 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.27 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.881 ' HG3' ' HA ' ' B' ' 114' ' ' TYR . 0.2 OUTLIER -52.64 -52.23 56.54 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.174 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.471 ' HB2' ' CB ' ' B' ' 113' ' ' SER . 2.3 tt0 -62.79 -51.71 66.01 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.269 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -56.28 -51.35 68.47 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HG2' HD21 ' B' ' 127' ' ' LEU . 3.0 tp10 -65.8 -29.07 69.5 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.204 178.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.67 ' HB1' HD22 ' B' ' 116' ' ' LEU . . . -70.48 -44.31 67.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.116 0.484 . . . . 0.0 110.257 178.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -56.28 7.19 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.38 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.33 -33.98 25.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.704 -1.134 . . . . 0.0 113.646 -176.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.484 HD23 ' HA ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER 30.8 53.69 0.17 Allowed 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.321 0.581 . . . . 0.0 111.811 -178.066 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 1.1 tpt180 177.75 84.03 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.898 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -142.85 147.83 36.05 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.605 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.31 171.63 11.74 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.063 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -82.68 -62.64 1.55 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 68.11 173.13 0.28 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.075 0.464 . . . . 0.0 111.932 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -175.69 140.95 0.47 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.188 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.427 HG22 ' H ' ' A' ' 47' ' ' GLU . 3.3 p -140.94 165.86 19.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.551 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.427 ' H ' HG22 ' A' ' 46' ' ' VAL . 1.5 mm-40 -83.94 178.44 7.88 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.988 0.423 . . . . 0.0 111.834 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -157.86 -176.69 6.07 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.021 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.47 146.44 35.94 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.033 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -77.08 158.96 30.18 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.988 0.423 . . . . 0.0 111.271 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -100.44 161.53 18.93 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 121.036 -0.602 . . . . 0.0 113.077 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.8 ptm -119.76 173.12 7.22 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.804 0.335 . . . . 0.0 111.479 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.4 m -122.62 153.03 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.483 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -118.05 168.61 10.38 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.467 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.588 HG12 ' HD3' ' A' ' 57' ' ' ARG . 2.4 t -109.53 -10.3 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.823 179.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.413 ' O ' ' HD2' ' A' ' 57' ' ' ARG . . . 47.81 66.62 0.99 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.031 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.588 ' HD3' HG12 ' A' ' 55' ' ' VAL . 4.3 mpt_? -129.54 110.53 11.92 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.089 0.471 . . . . 0.0 111.851 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -148.47 89.94 1.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.295 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 65.6 mt -129.03 -59.87 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.827 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -55.24 128.96 36.45 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.984 0.421 . . . . 0.0 111.284 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.9 mtp -174.2 125.94 0.34 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.645 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -118.06 138.46 52.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.855 0.359 . . . . 0.0 111.573 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -128.53 84.84 0.32 Allowed Glycine 0 C--N 1.334 0.445 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.444 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.3 t -82.33 -170.87 3.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.971 0.415 . . . . 0.0 111.575 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.52 ' O ' ' HB3' ' A' ' 66' ' ' ALA . 2.4 m-85 -125.2 -172.29 2.55 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.254 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' A' ' 65' ' ' PHE . . . 79.12 157.28 0.16 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.713 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -133.17 -63.15 0.77 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.151 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.54 -178.86 4.9 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.813 0.339 . . . . 0.0 111.497 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.16 -58.48 2.13 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 71' ' ' ASP . 16.6 ttpp 177.74 -31.15 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.263 0.554 . . . . 0.0 109.538 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.491 ' HB3' ' O ' ' A' ' 70' ' ' LYS . 20.6 t70 75.77 -70.58 0.14 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.764 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.418 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.3 t90 . . . . . 0 C--O 1.255 1.363 0 CA-C-O 118.587 -0.72 . . . . 0.0 111.141 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' MET . . . . . 0.524 ' O ' ' HB2' ' B' ' 102' ' ' LYS . 9.2 tpt . . . . . 0 N--CA 1.495 1.791 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.722 ' HA ' ' HB2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER 79.47 138.16 0.07 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.069 0.461 . . . . 0.0 110.351 -178.87 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' GLN . . . . . 0.478 ' CG ' ' HE2' ' A' ' 14' ' ' TYR . 57.6 tp60 -121.95 117.5 26.57 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.938 0.875 . . . . 0.0 110.553 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.749 ' NH1' ' H62' ' C' ' 179' ' ' ' DA' . 39.6 ttt85 -79.26 109.43 13.59 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.095 -1.412 . . . . 0.0 112.899 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' ILE . . . . . 1.009 HG23 ' O ' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -96.58 116.87 39.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.892 0 N-CA-C 103.739 -2.689 . . . . 0.0 103.739 174.4 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.974 HG23 ' HB ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -118.52 112.18 19.57 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.593 -174.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' VAL . . . . . 0.996 HG22 ' HA ' ' A' ' 25' ' ' SER . 1.0 OUTLIER -102.44 106.17 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.525 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' THR . . . . . 0.79 ' CG2' ' HG3' ' A' ' 4' ' ' ARG . 25.6 p -72.07 90.38 1.18 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.822 HG21 ' CB ' ' B' ' 114' ' ' TYR . 0.0 OUTLIER -104.68 -146.75 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 118.882 -0.58 . . . . 0.0 111.832 -178.38 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.591 ' CB ' ' O ' ' B' ' 109' ' ' VAL . 8.7 t70 105.13 5.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -175.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 24.6 t -150.23 -41.18 0.13 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 113.66 -1.609 . . . . 0.0 110.414 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' ASP . . . . . 0.778 ' HB2' ' HB3' ' A' ' 29' ' ' SER . 0.3 OUTLIER -74.71 33.78 0.1 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.501 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.471 ' CB ' ' HB2' ' A' ' 33' ' ' GLN . 0.2 OUTLIER 72.21 3.86 4.82 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 177.383 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . 0.914 ' CE1' HG21 ' A' ' 5' ' ' ILE . 1.9 t80 -57.75 -55.63 32.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.203 0.456 . . . . 0.0 111.507 179.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.562 ' HA ' ' CG ' ' B' ' 118' ' ' LYS . 15.2 mt-30 -49.68 -42.7 46.27 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -177.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' LEU . . . . . 0.67 HD22 ' HB1' ' A' ' 36' ' ' ALA . 0.5 OUTLIER -49.19 -30.66 7.21 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.692 0.282 . . . . 0.0 111.726 179.774 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' LEU . . . . . 0.697 HD12 ' SD ' ' A' ' 32' ' ' MET . 0.4 OUTLIER -78.56 -57.55 3.71 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.372 0.606 . . . . 0.0 111.574 178.314 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' LYS . . . . . 0.61 ' HD3' ' CE2' ' B' ' 114' ' ' TYR . 0.1 OUTLIER -65.09 -25.48 67.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.995 -179.909 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.453 ' N ' ' O ' ' B' ' 115' ' ' GLN . . . -54.95 -27.98 47.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.079 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' TYR . . . . . 0.554 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 18.1 m-30 -88.21 -47.41 8.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.667 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.554 ' HB2' ' O ' ' B' ' 120' ' ' TYR . 5.0 m-20 143.45 41.51 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.193 0.933 . . . . 0.0 110.52 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' VAL . . . . . 0.737 ' O ' HG13 ' B' ' 122' ' ' VAL . 6.1 p -160.25 87.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-O 121.661 0.743 . . . . 0.0 111.592 -177.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . 0.702 ' O ' ' HE1' ' A' ' 32' ' ' MET . 1.2 m120 -63.22 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' ILE . . . . . 1.025 ' CG2' HG23 ' B' ' 128' ' ' VAL . 0.1 OUTLIER -146.86 4.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' SER . . . . . 0.872 ' HA ' HG22 ' A' ' 7' ' ' VAL . 1.2 t -39.51 -64.63 0.46 Allowed 'General case' 0 C--O 1.244 0.814 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.011 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -87.94 -21.53 45.98 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.696 ' HB3' HG22 ' B' ' 124' ' ' ILE . 0.1 OUTLIER -64.43 -56.72 12.38 Favored 'General case' 0 N--CA 1.444 -0.735 0 C-N-CA 122.73 0.412 . . . . 0.0 110.911 179.577 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' VAL . . . . . 1.025 HG23 ' CG2' ' B' ' 124' ' ' ILE . 2.2 t -56.67 -60.99 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' SER . . . . . 0.656 ' CB ' ' HB3' ' A' ' 12' ' ' ASP . 2.2 p -47.15 -38.8 12.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.147 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 93.1 m -70.96 -48.58 52.59 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' THR . . . . . 0.463 HG23 HD21 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -66.62 -31.86 72.81 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 120.236 -0.586 . . . . 0.0 111.124 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' MET . . . . . 0.736 ' SD ' ' HB2' ' A' ' 17' ' ' LEU . 4.7 mmt -65.39 -57.04 9.33 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' GLN . . . . . 0.51 ' HB2' ' OG ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -48.79 -37.13 18.28 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 -75.05 -41.41 59.14 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.997 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.669 ' CB ' HD21 ' A' ' 17' ' ' LEU . 1.6 mm-40 -84.25 -12.75 54.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.81 0.338 . . . . 0.0 110.832 177.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' ALA . . . . . 0.652 ' O ' HD11 ' B' ' 139' ' ' LEU . . . -87.34 -29.61 21.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.42 0.688 . . . . 0.0 109.313 178.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' B' ' 133' ' ' GLN . 2.1 mmt180 -81.45 -48.25 12.13 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.763 0.792 . . . . 0.0 110.102 178.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -78.7 -40.27 34.19 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 113.958 -1.474 . . . . 0.0 112.969 -177.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' LEU . . . . . 0.947 HD23 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER 26.79 67.67 0.06 Allowed 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.496 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.441 ' O ' ' HD3' ' B' ' 140' ' ' ARG . 0.0 OUTLIER -95.37 13.3 26.24 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -95.19 43.07 1.09 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -97.71 174.08 6.8 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.967 0.413 . . . . 0.0 111.828 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -46.6 141.67 3.62 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.351 -179.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 144' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -131.4 167.04 19.97 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.185 0.516 . . . . 0.0 111.772 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 145' ' ' LYS . . . . . . . . . . . . . 41.0 mttt -87.52 -57.38 2.97 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.7 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 40.3 t 48.84 79.44 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -179.28 156.04 0.74 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.553 179.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 148' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.33 54.59 0.31 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.896 0.379 . . . . 0.0 110.959 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -172.87 142.65 1.14 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.02 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -95.37 -58.11 2.22 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.05 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 161.23 -143.84 9.28 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.489 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 14.1 mmt -98.39 102.38 14.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.876 0.369 . . . . 0.0 110.807 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 153' ' ' VAL . . . . . . . . . . . . . 22.2 t -85.21 75.75 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.353 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 154' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -178.94 -85.1 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.065 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 155' ' ' VAL . . . . . 0.532 ' O ' ' HB3' ' B' ' 156' ' ' ALA . 0.8 OUTLIER 51.38 126.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 CA-C-O 123.461 1.601 . . . . 0.0 115.314 179.453 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 156' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' B' ' 155' ' ' VAL . . . 88.4 107.81 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 111.423 -2.626 . . . . 0.0 112.164 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 157' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -141.26 103.46 4.43 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.529 179.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 158' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' B' ' 158' ' ' PHE . 0.0 OUTLIER -168.93 83.13 0.14 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.135 0.493 . . . . 0.0 111.63 -179.495 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 159' ' ' ILE . . . . . . . . . . . . . 21.4 mm -119.67 93.32 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.009 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 160' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -85.45 5.78 29.66 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 161' ' ' MET . . . . . . . . . . . . . 1.1 mmt -72.76 69.15 0.9 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.247 0.546 . . . . 0.0 110.408 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 162' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -69.9 68.16 0.28 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.495 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -68.46 -42.07 82.84 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 121.231 -0.509 . . . . 0.0 113.139 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 71.17 77.18 0.18 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.008 0.432 . . . . 0.0 111.57 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -158.47 134.3 9.0 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.959 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 166' ' ' ALA . . . . . . . . . . . . . . . -155.34 62.91 0.62 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.991 0.424 . . . . 0.0 111.675 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.88 67.39 1.22 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.286 0.565 . . . . 0.0 111.596 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -70.77 82.37 0.63 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.974 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 169' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -97.11 176.67 5.85 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.641 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 170' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' B' ' 171' ' ' ASP . 0.0 OUTLIER 176.76 -26.92 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.267 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 171' ' ' ASP . . . . . 0.515 ' HB2' ' O ' ' B' ' 170' ' ' LYS . 6.3 m-20 80.0 141.07 0.07 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.65 179.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 172' ' ' TRP . . . . . . . . . . . . . 54.1 m95 . . . . . 0 C--O 1.25 1.112 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.034 -179.646 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 173' ' ' ' DA' . . . . . 0.441 " H1'" " H5'" ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.442 0.882 0 C4'-C3'-C2' 104.876 1.676 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 174' ' ' ' DT' . . . . . 0.649 H2'' ' C8 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 P--O3' 1.616 0.721 0 C4'-C3'-C2' 101.758 -1.442 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 175' ' ' ' DA' . . . . . 0.649 ' C8 ' H2'' ' C' ' 174' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.521 0 C3'-C2'-C1' 104.997 1.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 176' ' ' ' DT' . . . . . 0.602 H2'' " O5'" ' C' ' 177' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.41 -0.799 0 C1'-O4'-C4' 107.621 -1.485 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 177' ' ' ' DG' . . . . . 0.678 ' OP2' ' HA ' ' A' ' 7' ' ' VAL . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 C4'-C3'-C2' 104.286 1.086 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 178' ' ' ' DT' . . . . . 0.598 ' H72' ' CG2' ' A' ' 6' ' ' THR . . . . . . . . 0 O4'--C1' 1.409 -0.85 0 C3'-C2'-C1' 104.876 1.555 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 179' ' ' ' DA' . . . . . 0.749 ' H62' ' NH1' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.432 -0.49 0 C3'-C2'-C1' 105.551 2.036 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 180' ' ' ' DT' . . . . . 0.624 H2'' ' N7 ' ' C' ' 181' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.587 0 C3'-C2'-C1' 100.91 -1.278 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 181' ' ' ' DA' . . . . . 0.624 ' N7 ' H2'' ' C' ' 180' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.724 0 C3'-C2'-C1' 104.142 1.03 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 182' ' ' ' DC' . . . . . 0.507 H2'' " O5'" ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.832 0 C4'-C3'-C2' 104.789 1.589 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 183' ' ' ' DC' . . . . . 0.552 H2'' ' C6 ' ' C' ' 184' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 N19-C1'-C2' 112.98 -0.763 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 184' ' ' ' DC' . . . . . 0.552 ' C6 ' H2'' ' C' ' 183' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 C3'-C2'-C1' 101.477 -0.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 185' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.64 0 C4'-C3'-C2' 100.959 -2.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D ' 186' ' ' ' DT' . . . . . 0.578 H2'' " O4'" ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 C1'-O4'-C4' 110.319 0.442 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 187' ' ' ' DC' . . . . . 0.621 H2'' ' N7 ' ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C3'-C2'-C1' 101.961 -0.528 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 188' ' ' ' DG' . . . . . 0.621 ' N7 ' H2'' ' D' ' 187' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.63 0 C3'-C2'-C1' 101.981 -0.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 189' ' ' ' DG' . . . . . 0.407 " O4'" " H2'" ' D' ' 188' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.649 0 O4'-C1'-N19 108.269 0.587 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 190' ' ' ' DG' . . . . . 0.552 ' N7 ' ' NH1' ' A' ' 4' ' ' ARG . . . . . . . . 0 O5'--C5' 1.425 -0.939 0 C4'-C3'-C2' 104.879 1.679 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 191' ' ' ' DT' . . . . . 0.588 ' H72' HG21 ' B' ' 106' ' ' THR . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 C1'-O4'-C4' 106.883 -2.012 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 192' ' ' ' DA' . . . . . 0.634 ' H62' ' NE ' ' B' ' 104' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C3'-C2'-C1' 105.805 2.218 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 193' ' ' ' DT' . . . . . 0.54 H2'' ' C8 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.591 0 N19-C1'-C2' 115.758 0.974 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 194' ' ' ' DA' . . . . . 0.54 ' C8 ' H2'' ' D' ' 193' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.838 0 C4'-C3'-C2' 104.804 1.604 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 195' ' ' ' DC' . . . . . 0.417 ' C5 ' ' C5 ' ' D' ' 194' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.407 -0.999 0 C1'-O4'-C4' 106.929 -1.979 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 196' ' ' ' DA' . . . . . 0.497 " H2'" ' H71' ' D' ' 197' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.573 0 C3'-C2'-C1' 104.229 1.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 197' ' ' ' DT' . . . . . 0.497 ' H71' " H2'" ' D' ' 196' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 N19-C1'-C2' 115.325 0.703 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 198' ' ' ' DA' . . . . . 0.459 ' C2 ' ' C2 ' ' C' ' 175' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.67 0 C1'-O4'-C4' 110.407 0.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_