data_1b4m_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 1b4m _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.508 -0.636 0 N-CA-C 117.851 2.537 . . . . 0.0 117.851 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -157.75 76.66 0.81 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -108.43 12.25 26.37 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 116.031 -1.938 . . . . 0.0 107.607 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -9.52 119.09 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.954 1 O-C-N 132.835 6.334 . . . . 0.0 115.382 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -170.26 -135.12 1.85 Allowed Glycine 0 C--O 1.21 -1.386 0 CA-C-O 116.693 -2.17 . . . . 0.0 110.259 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.475 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 1.3 p -155.56 163.75 39.56 Favored 'General case' 0 C--O 1.208 -1.093 1 O-C-N 132.168 5.275 . . . . 0.0 107.201 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.539 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.254 0.0 OUTLIER -156.92 101.59 1.95 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 128.063 3.352 . . . . 0.0 111.391 179.965 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -56.48 -18.25 10.85 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.493 ' HG3' ' CE2' ' A' ' 131' ' ' PHE . 27.7 ttm 68.28 84.98 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 103.364 -2.828 . . . . 0.0 103.364 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB3' ' HG2' ' A' ' 132' ' ' LYS . 0.2 OUTLIER -44.01 -29.67 0.62 Allowed 'General case' 0 C--N 1.312 -1.029 0 O-C-N 128.802 3.814 . . . . 0.0 111.698 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.415 ' N ' ' HG3' ' A' ' 12' ' ' GLU 0.265 1.5 m -176.15 162.9 2.55 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-N 113.718 -1.583 . . . . 0.0 112.052 -179.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.426 ' ND2' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.96 121.25 27.61 Favored 'General case' 0 CA--C 1.501 -0.94 0 CA-C-N 111.194 -2.73 . . . . 0.0 114.354 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -70.74 -63.45 1.09 Allowed 'General case' 0 CA--C 1.491 -1.325 1 O-C-N 129.654 4.346 . . . . 0.0 109.288 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -115.13 135.21 54.44 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -128.44 -56.42 1.23 Allowed 'General case' 0 CA--C 1.495 -1.173 0 CA-C-O 124.183 1.944 . . . . 0.0 110.936 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.547 ' HB2' ' CB ' ' A' ' 31' ' ' ARG . 5.3 tp10 -76.71 -37.02 56.81 Favored 'General case' 0 CA--C 1.499 -0.992 0 O-C-N 120.391 -1.443 . . . . 0.0 113.204 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.501 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.15 -25.01 46.03 Favored Glycine 0 CA--C 1.5 -0.882 0 O-C-N 128.537 3.648 . . . . 0.0 112.609 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -75.0 -37.79 61.76 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 119.136 1.468 . . . . 0.0 107.934 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 mtm -77.23 -20.95 54.54 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 112.368 -2.196 . . . . 0.0 107.628 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.501 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 3.0 ttmt -75.09 -38.42 61.23 Favored 'General case' 0 C--O 1.199 -1.572 0 C-N-CA 128.845 2.858 . . . . 0.0 114.595 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.0 -36.39 83.41 Favored 'General case' 0 C--O 1.203 -1.379 1 O-C-N 130.971 5.169 . . . . 0.0 114.163 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.413 HD13 ' N ' ' A' ' 26' ' ' ILE . 3.7 pp -94.58 -2.48 51.41 Favored 'General case' 0 C--O 1.215 -0.763 1 O-C-N 129.364 4.165 . . . . 0.0 107.969 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.7 t0 45.7 79.53 0.05 Allowed 'General case' 0 CA--C 1.483 -1.631 0 CA-C-O 128.159 3.838 . . . . 0.0 111.093 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.413 ' N ' HD13 ' A' ' 24' ' ' LEU . 15.6 tt -84.0 -50.15 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.685 0 CA-C-N 109.452 -3.522 . . . . 0.0 108.274 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -175.94 26.23 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 115.016 -2.421 . . . . 0.0 112.678 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 31.79 37.47 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.303 0 O-C-N 126.308 2.255 . . . . 0.0 117.039 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.0 172.82 17.48 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 112.363 -2.199 . . . . 0.0 106.729 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.287 0.6 OUTLIER 97.71 -7.01 0.06 Allowed 'General case' 0 N--CA 1.484 1.235 1 O-C-N 131.126 5.266 . . . . 0.0 112.667 -179.749 . . . . . . . . 4 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.547 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -75.51 -16.82 60.25 Favored 'General case' 0 C--O 1.238 0.451 1 O-C-N 131.594 5.559 . . . . 0.0 107.524 179.475 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.426 ' HG2' ' HG2' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -103.8 -11.85 17.31 Favored 'General case' 0 C--O 1.213 -0.854 0 O-C-N 127.534 3.021 . . . . 0.0 111.476 -179.638 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.3 mp -116.1 -53.36 4.55 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.194 1 O-C-N 130.349 4.781 . . . . 0.0 114.121 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HB3' ' CE2' ' A' ' 58' ' ' PHE . . . -67.78 -10.38 52.26 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.9 t -15.82 -48.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.557 0 N-CA-C 116.866 2.173 . . . . 0.0 116.866 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.406 ' N ' ' O ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER 162.2 115.38 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.604 2 O-C-N 129.814 4.446 . . . . 0.0 115.311 179.762 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HB2' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -142.42 68.79 1.31 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 110.825 -2.898 . . . . 0.0 106.906 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.4 m 93.49 -17.96 0.11 Allowed 'General case' 0 C--O 1.24 0.557 0 O-C-N 128.357 3.535 . . . . 0.0 117.42 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -12.7 89.16 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.007 0 O-C-N 127.678 3.111 . . . . 0.0 117.695 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -111.21 102.16 10.61 Favored 'General case' 0 N--CA 1.434 -1.273 1 O-C-N 132.169 5.918 . . . . 0.0 111.815 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.476 ' CD ' ' CD1' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -75.18 141.98 43.55 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 128.196 3.435 . . . . 0.0 107.425 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.462 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 3.7 mt -140.01 160.17 26.39 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 CA-C-O 123.291 1.519 . . . . 0.0 111.779 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.462 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.316 9.1 tt -132.3 142.99 41.28 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.476 0 CA-C-N 110.989 -2.823 . . . . 0.0 107.652 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.442 ' CG1' ' N ' ' A' ' 45' ' ' GLN . 2.1 t -115.98 -68.16 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 CA-C-N 113.888 -1.506 . . . . 0.0 114.661 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.442 ' N ' ' CG1' ' A' ' 44' ' ' VAL . 2.1 mt-30 69.12 133.19 0.03 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 O-C-N 124.832 1.332 . . . . 0.0 113.317 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -132.58 -24.51 1.99 Allowed 'General case' 0 C--N 1.359 0.98 1 O-C-N 130.213 4.696 . . . . 0.0 117.124 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.11 -69.85 0.4 Allowed Glycine 0 C--O 1.218 -0.905 0 CA-C-O 122.958 1.31 . . . . 0.0 111.243 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -102.61 -8.25 21.11 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-N 111.227 -2.487 . . . . 0.0 112.037 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -118.48 177.77 4.7 Favored 'General case' 0 C--N 1.354 0.793 0 CA-C-O 114.45 -2.69 . . . . 0.0 111.316 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.478 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 5.9 t80 -172.22 113.68 0.31 Allowed 'General case' 0 C--N 1.313 -1.01 1 O-C-N 132.062 5.851 . . . . 0.0 115.828 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.408 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -133.72 79.92 1.85 Allowed 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 118.594 2.813 . . . . 0.0 118.594 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.41 149.71 33.16 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 112.458 -2.155 . . . . 0.0 107.153 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -146.06 162.6 37.53 Favored 'General case' 0 CA--C 1.49 -1.365 0 O-C-N 127.259 2.849 . . . . 0.0 111.516 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.02 123.03 49.36 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 127.602 3.064 . . . . 0.0 107.647 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.438 ' HB2' ' CD1' ' A' ' 42' ' ' ILE . 0.1 OUTLIER -91.68 29.35 1.55 Allowed 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.544 ' HB3' ' CD1' ' A' ' 58' ' ' PHE . 0.6 OUTLIER -53.08 157.74 1.7 Allowed 'General case' 0 C--O 1.209 -1.051 0 O-C-N 128.853 3.845 . . . . 0.0 105.792 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.408 ' HB ' ' HB2' ' A' ' 37' ' ' LEU . 46.2 m -84.54 -7.6 59.21 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 109.212 -3.631 . . . . 0.0 109.163 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.544 ' CD1' ' HB3' ' A' ' 56' ' ' SER . 0.3 OUTLIER -101.75 -39.12 7.57 Favored 'General case' 0 C--N 1.366 1.296 0 CA-C-O 125.095 2.379 . . . . 0.0 110.466 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.79 149.56 27.55 Favored 'General case' 0 C--N 1.361 1.083 1 CA-C-N 107.794 -4.276 . . . . 0.0 117.93 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 79.71 1.62 Allowed 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 109.185 -3.643 . . . . 0.0 109.295 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -170.95 71.49 0.05 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 108.932 -3.758 . . . . 0.0 107.477 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.437 ' HB3' ' HA ' ' A' ' 53' ' ' LYS . 2.8 t0 -106.57 -127.13 0.25 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.6 2.438 . . . . 0.0 115.648 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.532 HD13 ' CZ2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -56.07 101.52 0.06 Allowed 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.368 -179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -132.2 88.91 2.6 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 127.086 2.741 . . . . 0.0 112.369 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.519 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -166.52 179.62 5.41 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 124.088 1.899 . . . . 0.0 112.785 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.59 152.23 30.6 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.76 144.01 13.68 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.866 0 O-C-N 128.915 3.884 . . . . 0.0 115.202 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.71 7.54 22.24 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 128.607 3.692 . . . . 0.0 116.936 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 1.1 t -72.84 -26.46 23.49 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.575 0 O-C-N 125.312 1.242 . . . . 0.0 109.136 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 65.68 89.86 0.09 Allowed 'General case' 0 C--O 1.212 -0.896 2 O-C-N 131.028 5.205 . . . . 0.0 109.383 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.423 ' O ' ' N ' ' A' ' 73' ' ' GLU . 3.4 t80 -74.89 67.35 1.65 Allowed 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 127.265 2.853 . . . . 0.0 112.258 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -50.01 79.12 0.0 OUTLIER 'General case' 0 CA--C 1.484 -1.591 0 CA-C-N 113.593 -1.64 . . . . 0.0 113.625 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.477 ' HB3' ' CA ' ' A' ' 82' ' ' ASN . 11.1 mt-10 52.89 -165.76 0.07 Allowed 'General case' 0 C--O 1.212 -0.89 0 C-N-CA 125.311 1.444 . . . . 0.0 111.848 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.5 t60 72.49 78.8 0.15 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 125.449 2.547 . . . . 0.0 115.843 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.41 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -122.82 170.28 10.25 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 111.925 -2.398 . . . . 0.0 112.945 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.41 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.15 138.22 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 O-C-N 128.34 3.525 . . . . 0.0 113.68 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 125.94 -17.41 6.76 Favored Glycine 0 C--O 1.213 -1.181 0 CA-C-N 112.165 -2.288 . . . . 0.0 110.067 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.7 tp -122.75 -67.85 0.92 Allowed 'General case' 0 N--CA 1.469 0.503 2 CA-C-N 106.734 -4.733 . . . . 0.0 112.869 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -104.51 -72.62 0.7 Allowed 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.2 76.2 1.18 Allowed Glycine 0 C--O 1.217 -0.96 0 CA-C-O 124.676 2.265 . . . . 0.0 111.439 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.432 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 11.6 tpp180 -150.22 -117.77 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.228 1 CA-C-N 107.195 -4.503 . . . . 0.0 113.112 179.682 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.477 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.5 OUTLIER -172.57 97.37 0.14 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.828 1.194 . . . . 0.0 112.256 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 87.8 t -135.77 126.91 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 N-CA-C 117.959 2.577 . . . . 0.0 117.959 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.476 ' CB ' ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -51.8 122.25 7.93 Favored 'General case' 0 C--O 1.218 -0.601 0 O-C-N 128.782 3.801 . . . . 0.0 106.837 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 21.5 m -133.33 83.27 2.04 Favored 'General case' 0 C--O 1.196 -1.735 0 O-C-N 128.417 3.573 . . . . 0.0 112.952 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.432 ' HG ' ' N ' ' A' ' 87' ' ' VAL . 1.1 tp -82.73 138.66 33.98 Favored 'General case' 0 N--CA 1.438 -1.047 1 CA-C-N 107.033 -4.621 . . . . 0.0 111.595 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.432 ' N ' ' HG ' ' A' ' 86' ' ' LEU . 97.3 t -123.31 140.22 47.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 124.888 1.275 . . . . 0.0 110.602 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.9 m -154.68 152.08 29.52 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 112.647 -2.069 . . . . 0.0 110.625 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.665 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 38.8 m95 -89.9 139.23 30.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 129.082 2.953 . . . . 0.0 106.847 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.29 -16.18 27.94 Favored 'General case' 0 CA--C 1.478 -1.811 1 CA-C-O 130.146 4.784 . . . . 0.0 114.925 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.68 -30.88 3.5 Favored Glycine 0 C--N 1.362 1.98 1 CA-C-N 107.542 -4.39 . . . . 0.0 103.411 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -156.16 91.0 1.23 Allowed 'General case' 0 N--CA 1.428 -1.569 1 O-C-N 132.906 5.709 . . . . 0.0 106.296 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.2 t 116.59 160.47 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 128.852 2.861 . . . . 0.0 118.029 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.477 HD11 ' CZ2' ' A' ' 89' ' ' TRP . 6.1 tp -102.81 99.07 8.99 Favored 'General case' 0 CA--C 1.49 -1.339 0 CA-C-O 125.216 2.436 . . . . 0.0 117.326 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.407 HG12 ' NZ ' ' A' ' 108' ' ' LYS 0.357 66.9 t -92.66 121.55 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 114.83 -2.509 . . . . 0.0 112.547 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.418 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -136.39 140.9 43.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 124.189 1.947 . . . . 0.0 109.387 -179.445 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.4 t -107.83 102.94 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.967 0 CA-C-N 109.267 -3.606 . . . . 0.0 118.08 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.408 ' HG3' ' C ' ' A' ' 105' ' ' ARG . 5.0 mm100 -83.09 86.34 7.03 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.128 -1.608 . . . . 0.0 107.959 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.476 ' HB3' ' CB ' ' A' ' 84' ' ' LYS . 0.6 OUTLIER -76.16 100.25 4.95 Favored 'General case' 0 C--O 1.2 -1.526 0 CA-C-N 109.498 -3.501 . . . . 0.0 107.769 -179.321 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -98.68 177.47 30.59 Favored Glycine 0 C--O 1.214 -1.1 0 O-C-N 127.597 3.061 . . . . 0.0 112.271 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -107.96 -39.91 5.39 Favored 'General case' 0 CA--C 1.494 -1.2 1 CA-C-N 106.675 -4.762 . . . . 0.0 111.989 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.43 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -117.06 -41.85 2.98 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 125.067 2.365 . . . . 0.0 115.433 179.68 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' A' ' 105' ' ' ARG . 2.0 pp20? -113.78 167.24 10.79 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 126.582 3.087 . . . . 0.0 112.561 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -126.65 90.11 3.11 Favored 'General case' 0 N--CA 1.489 1.514 1 CA-C-N 107.346 -4.479 . . . . 0.0 102.415 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.441 ' N ' ' OE1' ' A' ' 103' ' ' GLU . 5.8 mmm180 -79.74 -7.76 58.82 Favored 'General case' 0 C--N 1.317 -0.806 1 O-C-N 129.448 4.218 . . . . 0.0 113.011 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -22.51 98.59 0.01 OUTLIER Glycine 0 N--CA 1.442 -0.936 1 O-C-N 133.71 6.881 . . . . 0.0 112.333 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.581 ' HE1' ' NE2' ' A' ' 109' ' ' GLN 0.333 0.0 OUTLIER -116.79 125.27 51.35 Favored 'General case' 0 C--O 1.219 -0.536 1 O-C-N 132.415 5.42 . . . . 0.0 111.34 -179.197 . . . . . . . . 5 4 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.481 ' HB2' ' CZ3' ' A' ' 110' ' ' TRP . 0.1 OUTLIER -151.19 153.61 35.28 Favored 'General case' 0 CA--C 1.507 -0.707 0 O-C-N 128.552 3.657 . . . . 0.0 116.318 -178.518 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.581 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 0.7 OUTLIER -116.53 167.51 10.99 Favored 'General case' 0 C--N 1.36 1.055 0 CA-C-N 109.725 -3.398 . . . . 0.0 110.248 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.481 ' CZ3' ' HB2' ' A' ' 108' ' ' LYS . 0.5 OUTLIER -177.36 99.34 0.05 OUTLIER 'General case' 0 C--O 1.211 -0.929 0 O-C-N 128.309 3.505 . . . . 0.0 114.87 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.0 t -47.23 97.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.825 0 CA-C-O 124.948 2.308 . . . . 0.0 112.988 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.466 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 9.2 mm-40 -94.21 50.91 1.42 Allowed 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 109.09 -3.687 . . . . 0.0 112.604 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.19 -130.14 9.14 Favored Glycine 0 C--O 1.201 -1.934 0 O-C-N 119.465 -2.022 . . . . 0.0 113.057 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -90.77 16.26 9.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 127.405 2.282 . . . . 0.0 117.093 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.412 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -142.97 -176.52 4.94 Favored 'General case' 0 C--O 1.223 -0.303 0 O-C-N 128.529 3.643 . . . . 0.0 108.305 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.468 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -140.75 108.17 5.56 Favored 'General case' 0 CA--C 1.485 -1.54 1 O-C-N 130.283 4.739 . . . . 0.0 117.598 -179.904 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.466 ' CD2' ' HB2' ' A' ' 112' ' ' GLU . 17.4 m-30 -72.36 142.72 48.76 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 111.23 -2.714 . . . . 0.0 116.809 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.525 ' HG ' ' CZ ' ' A' ' 131' ' ' PHE . 3.1 mt -130.48 86.37 2.38 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 109.141 -3.663 . . . . 0.0 107.542 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -96.98 92.41 6.07 Favored 'General case' 0 CA--C 1.495 -1.164 0 C-N-CA 128.278 2.631 . . . . 0.0 111.829 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.474 ' CD2' ' HB3' ' A' ' 127' ' ' CYS . 0.3 OUTLIER -110.64 -177.07 3.13 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 128.119 3.387 . . . . 0.0 108.645 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.2 t -150.44 178.32 9.16 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.978 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.5 p -173.09 60.23 0.02 OUTLIER 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 126.066 2.841 . . . . 0.0 113.078 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.97 -74.77 1.09 Allowed Glycine 0 CA--C 1.521 0.439 0 CA-C-N 111.166 -2.743 . . . . 0.0 112.79 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.91 -50.47 3.05 Favored 'General case' 0 CA--C 1.493 -1.214 0 O-C-N 126.19 1.759 . . . . 0.0 110.966 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.28 174.94 1.06 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 128.466 3.604 . . . . 0.0 109.815 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.6 p -153.81 88.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 CA-C-N 109.425 -3.534 . . . . 0.0 111.007 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.474 ' HB3' ' CD2' ' A' ' 120' ' ' LEU . 52.0 t -73.35 118.53 16.41 Favored 'General case' 0 CA--C 1.49 -1.349 0 CA-C-N 112.161 -2.29 . . . . 0.0 112.203 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -106.1 135.5 47.45 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 114.524 -2.655 . . . . 0.0 110.46 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -126.34 154.31 43.69 Favored 'General case' 0 CA--C 1.488 -1.422 1 O-C-N 129.671 4.357 . . . . 0.0 116.159 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.22 136.21 53.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.525 ' CZ ' ' HG ' ' A' ' 118' ' ' LEU . 52.4 m-85 -126.47 -179.43 4.76 Favored 'General case' 0 CA--C 1.477 -1.853 0 CA-C-N 111.709 -2.496 . . . . 0.0 113.916 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.431 ' HG2' ' HB3' ' A' ' 12' ' ' GLU 0.318 0.0 OUTLIER -157.69 45.86 0.36 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 112.369 -3.681 . . . . 0.0 108.825 -179.759 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.539 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 35.6 ttpt 15.18 102.2 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.933 1 O-C-N 130.186 4.679 . . . . 0.0 118.294 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt . . . . . 0 CA--C 1.494 -1.189 0 CA-C-O 114.383 -2.722 . . . . 0.0 112.02 -179.581 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.434 ' HG2' ' CH2' ' A' ' 89' ' ' TRP . 0.6 OUTLIER . . . . . 0 N--CA 1.446 -0.633 0 N-CA-C 118.583 2.809 . . . . 0.0 118.583 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.28 105.27 0.07 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 125.898 1.679 . . . . 0.0 109.602 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -116.43 -143.57 0.38 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 112.743 -3.503 . . . . 0.0 102.073 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.9 m120 125.42 122.45 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 1 O-C-N 131.026 5.204 . . . . 0.0 115.337 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.02 -169.96 33.16 Favored Glycine 0 C--O 1.204 -1.722 0 CA-C-N 112.108 -2.315 . . . . 0.0 111.885 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.513 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -119.01 152.11 37.0 Favored 'General case' 0 C--O 1.202 -1.412 1 O-C-N 132.15 5.265 . . . . 0.0 104.216 179.735 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.513 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -149.11 108.05 3.88 Favored 'General case' 0 CA--C 1.486 -1.506 1 O-C-N 132.426 6.079 . . . . 0.0 112.517 -179.976 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -76.52 100.73 5.37 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 116.213 -2.195 . . . . 0.0 108.156 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 4.9 ttm -32.53 -42.42 0.07 Allowed 'General case' 0 N--CA 1.474 0.759 0 O-C-N 127.409 2.943 . . . . 0.0 108.78 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 85.25 -55.84 0.09 Allowed 'General case' 0 CA--C 1.51 -0.569 1 O-C-N 131.461 5.475 . . . . 0.0 112.224 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -157.44 -175.67 5.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 124.815 2.245 . . . . 0.0 111.419 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.527 ' N ' ' ND2' ' A' ' 14' ' ' ASN . 1.5 p30 -155.26 168.0 28.51 Favored 'General case' 0 CA--C 1.483 -1.617 0 CA-C-N 111.513 -2.585 . . . . 0.0 114.109 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -89.9 -80.61 0.31 Allowed 'General case' 0 CA--C 1.503 -0.859 0 O-C-N 128.781 3.801 . . . . 0.0 110.01 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -114.14 126.84 55.53 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 123.216 1.484 . . . . 0.0 112.31 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.402 ' CZ ' HG23 ' A' ' 35' ' ' VAL . 5.7 p90 -109.74 -44.81 3.76 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-O 124.095 1.902 . . . . 0.0 107.883 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.429 ' HG3' ' CB ' ' A' ' 31' ' ' ARG . 5.2 tt0 -66.8 -37.22 84.12 Favored 'General case' 0 C--O 1.215 -0.721 0 O-C-N 120.685 -1.259 . . . . 0.0 113.732 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.18 -33.01 81.67 Favored Glycine 0 N--CA 1.475 1.24 1 O-C-N 129.36 4.163 . . . . 0.0 109.73 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.69 -44.18 57.29 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-O 124.878 2.275 . . . . 0.0 107.447 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -61.28 -23.47 65.7 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 124.389 2.042 . . . . 0.0 113.282 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -76.58 -27.3 55.77 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 108.441 -3.982 . . . . 0.0 112.684 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.26 -42.24 79.92 Favored 'General case' 0 N--CA 1.477 0.915 1 O-C-N 129.883 4.489 . . . . 0.0 111.679 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.482 ' CD2' ' N ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -84.73 -16.33 42.04 Favored 'General case' 0 N--CA 1.483 1.184 1 O-C-N 130.194 4.684 . . . . 0.0 103.966 -179.698 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.4 t0 55.33 84.0 0.08 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 128.561 3.663 . . . . 0.0 110.587 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.444 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 20.2 tt -124.39 53.59 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 1 CA-C-N 107.988 -4.187 . . . . 0.0 107.237 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.55 -171.74 0.85 Allowed 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 113.239 -1.8 . . . . 0.0 113.584 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 65.75 46.92 2.22 Favored 'General case' 0 CA--C 1.501 -0.924 0 O-C-N 126.288 2.242 . . . . 0.0 116.518 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 88.86 163.04 0.06 Allowed 'General case' 0 C--O 1.2 -1.506 0 O-C-N 127.387 2.929 . . . . 0.0 107.858 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 t 122.38 -31.64 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.016 2 O-C-N 133.214 6.571 . . . . 0.0 109.142 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.429 ' CB ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -105.56 163.96 12.26 Favored 'General case' 0 C--O 1.243 0.725 1 O-C-N 132.357 6.036 . . . . 0.0 108.103 179.34 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 mttt 82.68 10.02 0.65 Allowed 'General case' 0 C--O 1.2 -1.53 0 O-C-N 127.63 3.081 . . . . 0.0 109.922 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.8 mp -145.36 -57.81 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.58 2 O-C-N 132.009 5.818 . . . . 0.0 107.357 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.526 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -82.92 62.15 6.33 Favored 'General case' 0 C--O 1.203 -1.377 0 CA-C-N 112.235 -2.257 . . . . 0.0 113.797 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.402 HG23 ' CZ ' ' A' ' 17' ' ' PHE . 3.2 t -83.81 -45.48 18.38 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.322 0 CA-C-N 111.032 -2.804 . . . . 0.0 109.589 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.474 ' CD ' ' HB2' ' A' ' 39' ' ' GLN . 1.0 OUTLIER 168.0 113.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.664 2 O-C-N 131.416 5.448 . . . . 0.0 109.475 179.793 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.518 ' HG ' ' CD2' ' A' ' 58' ' ' PHE . 0.4 OUTLIER -90.11 -9.08 49.7 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 127.496 2.997 . . . . 0.0 111.449 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.464 ' CG2' ' N ' ' A' ' 39' ' ' GLN . 0.8 OUTLIER 164.31 -65.19 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.135 0 O-C-N 128.158 3.411 . . . . 0.0 112.289 179.886 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.474 ' HB2' ' CD ' ' A' ' 36' ' ' ARG . 14.0 tm0? 66.58 146.5 0.04 OUTLIER 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.406 ' N ' ' CD ' ' A' ' 39' ' ' GLN . 20.1 m -162.01 104.77 1.17 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 130.837 3.655 . . . . 0.0 112.004 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 0.8 OUTLIER -86.98 146.37 26.16 Favored 'General case' 0 N--CA 1.488 1.425 1 O-C-N 129.662 4.351 . . . . 0.0 109.054 -179.433 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.463 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 3.0 mt -134.84 154.91 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-N 114.506 -1.225 . . . . 0.0 110.574 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.533 HG13 ' CE1' ' A' ' 50' ' ' PHE . 13.7 tt -130.27 124.75 58.41 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 O-C-N 128.37 3.544 . . . . 0.0 107.463 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.2 t -98.36 -32.54 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.173 0 CA-C-N 113.303 -1.771 . . . . 0.0 111.501 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.486 ' HB2' ' CD1' ' A' ' 50' ' ' PHE . 25.0 tt0 8.16 91.03 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.02 0 O-C-N 127.38 2.925 . . . . 0.0 118.111 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.82 -35.05 15.03 Favored 'General case' 0 CA--C 1.477 -1.84 2 CA-C-N 106.678 -4.783 . . . . 0.0 114.857 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.17 -111.81 0.5 Allowed Glycine 0 C--O 1.204 -1.774 0 O-C-N 120.457 -1.402 . . . . 0.0 112.493 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -52.51 -28.11 19.2 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 125.964 1.626 . . . . 0.0 111.854 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -117.46 138.75 51.65 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 128.487 2.715 . . . . 0.0 109.279 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.533 ' CE1' HG13 ' A' ' 43' ' ' ILE . 1.7 t80 -149.73 113.54 5.07 Favored 'General case' 0 CA--C 1.483 -1.631 0 O-C-N 127.501 3.001 . . . . 0.0 113.014 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.4 mttm -119.19 82.81 1.93 Allowed 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.413 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -58.8 133.16 55.73 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 128.491 3.62 . . . . 0.0 106.719 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.402 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.5 OUTLIER -144.43 154.3 42.81 Favored 'General case' 0 CA--C 1.488 -1.427 0 C-N-CA 115.087 -2.645 . . . . 0.0 111.453 -179.509 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.77 155.38 18.36 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 127.57 3.044 . . . . 0.0 111.658 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -138.09 49.27 1.95 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.985 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -88.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 1 O-C-N 130.971 5.169 . . . . 0.0 107.93 179.796 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.476 HG23 ' CD2' ' A' ' 37' ' ' LEU . 0.9 OUTLIER 155.88 -33.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.18 1 O-C-N 131.577 5.548 . . . . 0.0 104.313 -179.575 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.526 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 8.6 m-85 -69.03 -49.37 58.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 125.955 2.035 . . . . 0.0 108.098 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -155.23 120.18 4.85 Favored 'General case' 0 C--N 1.364 1.227 2 CA-C-N 106.869 -4.696 . . . . 0.0 112.845 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 m-20 -104.85 21.94 16.08 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 111.232 -2.713 . . . . 0.0 111.724 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -117.29 98.52 6.48 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 128.586 3.679 . . . . 0.0 109.622 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -108.95 -79.7 0.58 Allowed 'General case' 0 C--O 1.205 -1.25 1 O-C-N 129.298 4.124 . . . . 0.0 113.361 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.541 ' HG ' ' CZ ' ' A' ' 65' ' ' PHE . 1.1 tp -125.54 119.53 28.4 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -144.75 88.85 1.93 Allowed 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.541 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -150.12 -163.61 1.82 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 123.451 1.595 . . . . 0.0 110.23 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -145.59 152.24 39.38 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.42 HG22 ' NE1' ' A' ' 89' ' ' TRP . 3.1 t -61.55 130.94 26.35 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.586 0 C-N-CA 116.724 -1.991 . . . . 0.0 113.544 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.14 -0.73 89.33 Favored Glycine 0 N--CA 1.486 1.998 0 CA-C-N 110.763 -2.926 . . . . 0.0 116.461 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.418 HG13 ' N ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -49.85 -39.13 14.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 125.208 1.181 . . . . 0.0 109.66 -179.654 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 57.17 65.14 1.44 Allowed 'General case' 0 C--O 1.211 -0.946 1 O-C-N 130.67 4.981 . . . . 0.0 108.546 -179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.448 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.1 t80 -49.16 92.65 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.68 2 O-C-N 133.421 6.701 . . . . 0.0 110.866 -179.384 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -57.29 63.84 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.997 0 O-C-N 126.403 2.314 . . . . 0.0 113.93 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HB3' ' CA ' ' A' ' 82' ' ' ASN 0.258 5.3 mt-10 56.36 -170.59 0.08 Allowed 'General case' 0 CA--C 1.484 -1.574 0 CA-C-O 125.373 2.511 . . . . 0.0 110.05 179.743 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.75 93.11 0.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 109.225 -3.625 . . . . 0.0 109.004 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.43 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 2.0 p -96.07 -55.86 2.83 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 111.301 -2.681 . . . . 0.0 116.91 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.43 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 48.1 165.31 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.933 1 O-C-N 129.348 4.155 . . . . 0.0 115.562 -179.515 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.18 -51.39 3.42 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 112.36 -2.2 . . . . 0.0 112.497 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.444 ' HA ' ' CD1' ' A' ' 26' ' ' ILE 0.267 2.5 tp -119.8 -0.79 10.63 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 127.975 2.809 . . . . 0.0 117.417 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -154.99 -74.08 0.11 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 116.545 -2.062 . . . . 0.0 113.199 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.93 72.88 1.28 Allowed Glycine 0 C--O 1.212 -1.219 0 CA-C-O 122.578 1.099 . . . . 0.0 111.825 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -136.89 -148.45 0.28 Allowed 'General case' 0 C--N 1.351 0.651 0 CA-C-N 110.185 -3.007 . . . . 0.0 109.107 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.475 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 40.6 m-20 -161.69 100.15 1.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 125.637 1.835 . . . . 0.0 109.516 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 40.4 t -129.13 146.81 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 O-C-N 127.265 2.853 . . . . 0.0 118.534 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.413 ' CB ' ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -79.87 88.23 5.29 Favored 'General case' 0 C--O 1.218 -0.595 1 O-C-N 130.423 4.827 . . . . 0.0 108.254 179.436 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.448 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 8.0 m -99.22 85.83 3.29 Favored 'General case' 0 C--O 1.193 -1.882 1 O-C-N 130.258 4.724 . . . . 0.0 114.034 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.9 tt -89.63 155.71 19.06 Favored 'General case' 0 N--CA 1.442 -0.854 1 CA-C-N 107.509 -4.405 . . . . 0.0 110.238 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.422 HG22 ' CZ ' ' A' ' 65' ' ' PHE . 2.4 p -140.14 132.49 33.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 127.087 2.155 . . . . 0.0 109.692 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.8 t -155.8 -178.69 7.48 Favored 'General case' 0 CA--C 1.485 -1.55 0 CA-C-O 125.419 2.533 . . . . 0.0 111.584 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.693 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 58.5 m95 -99.25 145.6 27.1 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 118.577 -2.577 . . . . 0.0 108.647 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.467 ' CB ' HG21 ' A' ' 93' ' ' THR . 7.2 tp10 -93.09 -44.45 8.37 Favored 'General case' 0 C--O 1.201 -1.455 1 CA-C-O 131.529 5.443 . . . . 0.0 112.15 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 174.93 -46.64 0.13 Allowed Glycine 0 N--CA 1.478 1.491 1 CA-C-N 106.634 -4.803 . . . . 0.0 104.464 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -141.48 36.53 1.67 Allowed 'General case' 0 C--O 1.202 -1.438 1 O-C-N 130.305 4.18 . . . . 0.0 110.881 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.467 HG21 ' CB ' ' A' ' 90' ' ' GLU . 3.6 t -176.09 158.72 2.02 Favored 'General case' 0 C--O 1.203 -1.354 0 N-CA-C 118.048 2.61 . . . . 0.0 118.048 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.4 tp -90.01 94.55 9.84 Favored 'General case' 0 CA--C 1.492 -1.258 0 O-C-N 128.613 3.695 . . . . 0.0 117.244 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.449 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.366 38.2 t -91.91 126.72 44.47 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-N 108.816 -3.811 . . . . 0.0 111.923 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.4 m -131.64 123.74 28.47 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 127.077 2.736 . . . . 0.0 103.795 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.1 t -96.31 119.73 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 110.854 -2.884 . . . . 0.0 112.657 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.497 ' HG3' ' CB ' ' A' ' 105' ' ' ARG 0.307 0.1 OUTLIER -94.68 104.24 16.16 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 110.895 -2.866 . . . . 0.0 107.886 179.647 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.413 ' HB3' ' CB ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -119.9 106.92 12.52 Favored 'General case' 0 C--O 1.206 -1.227 0 O-C-N 127.27 2.856 . . . . 0.0 110.681 -179.611 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -120.47 -169.12 13.86 Favored Glycine 0 C--O 1.209 -1.415 0 CA-C-O 124.033 1.907 . . . . 0.0 109.57 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -72.69 -13.39 61.34 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 108.376 -3.912 . . . . 0.0 112.459 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -160.63 -43.24 0.05 OUTLIER 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 117.407 2.373 . . . . 0.0 117.407 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.432 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 28.4 mt-10 -56.04 144.78 27.69 Favored 'General case' 0 C--O 1.208 -1.121 0 O-C-N 126.716 2.51 . . . . 0.0 117.668 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -127.11 60.56 1.38 Allowed 'General case' 0 N--CA 1.491 1.593 1 CA-C-N 107.597 -4.365 . . . . 0.0 102.0 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.497 ' CB ' ' HG3' ' A' ' 98' ' ' GLN . 0.7 OUTLIER -69.32 -15.54 63.36 Favored 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.118 5.261 . . . . 0.0 113.792 -179.667 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.427 ' CA ' ' HG2' ' A' ' 98' ' ' GLN . . . -21.11 96.08 0.01 OUTLIER Glycine 0 C--O 1.21 -1.346 2 O-C-N 134.041 7.088 . . . . 0.0 115.351 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.49 ' HE1' ' NE2' ' A' ' 109' ' ' GLN 0.315 0.0 OUTLIER -114.38 129.77 56.66 Favored 'General case' 0 C--O 1.196 -1.727 1 O-C-N 132.259 5.329 . . . . 0.0 110.389 179.762 . . . . . . . . 5 4 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.9 ptpt -158.03 168.02 28.27 Favored 'General case' 0 C--N 1.354 0.774 1 O-C-N 130.681 4.988 . . . . 0.0 117.91 -178.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.49 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 2.3 mp0 -125.26 172.68 9.36 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 115.2 -2.333 . . . . 0.0 110.799 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.487 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER 175.41 71.12 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.977 1 O-C-N 130.222 4.702 . . . . 0.0 117.948 -179.586 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 44.9 t -18.45 116.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.484 -1.583 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -127.18 68.99 1.28 Allowed 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.81 100.61 0.06 OUTLIER Glycine 0 C--O 1.207 -1.537 0 CA-C-O 118.129 -1.373 . . . . 0.0 115.647 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 39.58 41.77 0.81 Allowed 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 10.3 pttm 177.2 170.06 0.56 Allowed 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 128.978 3.924 . . . . 0.0 107.769 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.511 HD22 ' CE2' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -148.85 121.1 8.37 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 115.362 -2.535 . . . . 0.0 113.038 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.487 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 8.9 m-85 -67.15 154.84 40.26 Favored 'General case' 0 C--N 1.362 1.138 0 CA-C-N 111.374 -2.648 . . . . 0.0 112.895 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.467 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -130.21 39.88 3.6 Favored 'General case' 0 N--CA 1.476 0.833 2 O-C-N 131.418 5.449 . . . . 0.0 106.501 179.632 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 120' ' ' LEU . 0.1 OUTLIER -51.9 122.17 7.89 Favored 'General case' 0 CA--C 1.508 -0.651 0 O-C-N 128.853 3.846 . . . . 0.0 110.889 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.482 ' HB2' ' CB ' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -141.15 168.37 19.94 Favored 'General case' 0 CA--C 1.486 -1.51 1 O-C-N 130.33 4.769 . . . . 0.0 109.579 -179.811 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.1 t -135.16 175.73 9.32 Favored 'General case' 0 C--O 1.198 -1.621 0 O-C-N 127.112 2.758 . . . . 0.0 105.224 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.6 p 174.2 84.87 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.52 0 O-C-N 124.925 1.391 . . . . 0.0 111.115 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 71.91 39.64 58.89 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-O 123.749 1.749 . . . . 0.0 111.223 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.14 37.05 6.83 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 109.53 -3.335 . . . . 0.0 112.482 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -96.3 -13.3 23.43 Favored 'General case' 0 C--O 1.199 -1.586 0 O-C-N 127.125 2.765 . . . . 0.0 107.851 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 35.6 m 27.57 60.55 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 C-N-CA 127.505 2.322 . . . . 0.0 115.144 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.0 t -55.02 112.09 0.98 Allowed 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 125.344 1.458 . . . . 0.0 111.793 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 53.4 ttm-85 -105.76 100.88 10.43 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -85.01 173.78 10.26 Favored 'General case' 0 CA--C 1.489 -1.389 0 CA-C-N 112.962 -1.926 . . . . 0.0 113.545 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.449 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 2.2 m -135.88 157.12 38.34 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.467 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 63.6 m-85 -140.96 175.83 9.3 Favored 'General case' 0 CA--C 1.493 -1.215 0 O-C-N 128.196 3.435 . . . . 0.0 115.718 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.293 0.0 OUTLIER -163.96 119.81 1.62 Allowed 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 110.731 -2.941 . . . . 0.0 103.606 179.834 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.509 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 9.2 tttt -53.09 126.17 19.79 Favored 'General case' 0 C--O 1.198 -1.614 0 O-C-N 127.176 2.798 . . . . 0.0 110.72 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.124 0 O-C-N 125.712 1.882 . . . . 0.0 115.972 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.74 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -101.31 81.31 2.19 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -101.11 -83.45 0.45 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 113.725 -3.036 . . . . 0.0 108.127 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.9 113.02 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.733 1 O-C-N 129.191 4.057 . . . . 0.0 114.451 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.56 -130.72 1.84 Allowed Glycine 0 C--O 1.207 -1.569 0 O-C-N 126.52 2.388 . . . . 0.0 112.472 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.424 HG21 HG21 ' A' ' 40' ' ' THR . 1.2 m -174.57 144.01 0.84 Allowed 'General case' 0 C--N 1.314 -0.954 1 O-C-N 130.661 4.389 . . . . 0.0 106.398 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.59 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.2 134.8 22.15 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 111.967 -2.379 . . . . 0.0 114.621 -179.539 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -69.54 -14.81 63.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.471 ' HE1' ' CG ' ' A' ' 39' ' ' GLN . 5.2 ttp 55.2 57.74 5.26 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -17.88 -49.6 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.883 0 O-C-N 128.514 3.634 . . . . 0.0 111.903 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.3 165.39 28.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 110.273 -3.148 . . . . 0.0 111.406 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.24 129.91 11.56 Favored 'General case' 0 CA--C 1.482 -1.651 0 CA-C-N 110.42 -3.082 . . . . 0.0 111.466 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' A' ' 17' ' ' PHE . 7.0 mm-40 -88.46 -174.59 4.65 Favored 'General case' 0 CA--C 1.496 -1.125 1 O-C-N 129.471 4.232 . . . . 0.0 112.119 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 33.24 -81.76 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.55 0 C-N-CA 125.855 1.662 . . . . 0.0 113.763 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.424 ' N ' ' O ' ' A' ' 15' ' ' GLU . 1.4 t80 73.81 -59.39 0.56 Allowed 'General case' 0 C--O 1.203 -1.364 0 O-C-N 126.203 2.189 . . . . 0.0 113.165 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.451 ' CG ' ' HG2' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -76.4 -48.86 18.35 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.536 -1.665 . . . . 0.0 115.241 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.479 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.47 -19.92 28.36 Favored Glycine 0 CA--C 1.494 -1.222 0 CA-C-O 116.934 -2.037 . . . . 0.0 112.893 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -36.89 38.96 Favored 'General case' 0 C--O 1.21 -0.983 0 O-C-N 128.13 2.9 . . . . 0.0 106.387 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -25.57 57.56 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 111.048 -2.796 . . . . 0.0 107.554 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.479 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -79.92 -28.76 39.74 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 129.065 2.946 . . . . 0.0 114.238 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.53 -28.67 66.21 Favored 'General case' 0 N--CA 1.477 0.912 2 O-C-N 130.818 5.074 . . . . 0.0 113.344 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.486 ' CD1' ' HB ' ' A' ' 26' ' ' ILE . 4.1 pp -103.04 -4.39 24.66 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 127.946 3.279 . . . . 0.0 108.999 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 54.25 82.59 0.09 Allowed 'General case' 0 CA--C 1.484 -1.571 0 C-N-CA 131.027 3.731 . . . . 0.0 114.519 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.486 ' HB ' ' CD1' ' A' ' 24' ' ' LEU . 16.2 tt -111.65 42.76 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-N 111.501 -2.591 . . . . 0.0 106.883 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.531 ' O ' ' CG ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -47.21 151.53 0.69 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 114.247 -2.787 . . . . 0.0 108.957 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.531 ' CG ' ' O ' ' A' ' 27' ' ' ASP . 4.8 m-30 147.12 -27.68 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.783 1 O-C-N 131.276 5.36 . . . . 0.0 111.28 179.169 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 90.52 73.32 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.542 0 O-C-N 127.049 2.718 . . . . 0.0 108.125 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -26.43 27.76 Favored 'General case' 0 C--O 1.212 -0.899 1 CA-C-N 105.708 -5.224 . . . . 0.0 111.816 179.761 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.451 ' HG2' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -89.93 -171.24 3.08 Favored 'General case' 0 C--N 1.319 -0.739 1 O-C-N 129.283 4.114 . . . . 0.0 110.874 -179.925 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 96.64 -37.64 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.415 1 O-C-N 130.905 5.128 . . . . 0.0 112.848 -179.663 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.06 34.16 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 128.514 3.634 . . . . 0.0 108.675 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -129.57 20.9 5.59 Favored 'General case' 0 C--O 1.206 -1.185 1 CA-C-O 128.63 4.062 . . . . 0.0 111.373 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.27 -40.75 57.57 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-N 108.542 -3.936 . . . . 0.0 110.038 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.47 99.0 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.858 0 CA-C-N 110.562 -3.017 . . . . 0.0 115.717 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.561 ' HG ' ' CD2' ' A' ' 58' ' ' PHE . 1.4 pp -100.08 -1.26 37.3 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 105.41 -2.071 . . . . 0.0 105.41 178.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.425 ' N ' HD13 ' A' ' 37' ' ' LEU . 2.9 m 142.72 128.38 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.161 1 O-C-N 131.098 5.249 . . . . 0.0 110.393 -178.71 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.471 ' CG ' ' HE1' ' A' ' 11' ' ' MET . 0.6 OUTLIER -130.81 140.95 50.31 Favored 'General case' 0 CA--C 1.494 -1.178 0 O-C-N 126.3 2.25 . . . . 0.0 113.321 -179.359 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.431 HG23 ' CD1' ' A' ' 42' ' ' ILE . 38.9 m -156.03 104.13 2.26 Favored 'General case' 0 C--O 1.21 -1.02 0 O-C-N 128.62 3.7 . . . . 0.0 114.371 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.461 ' HE3' ' CD1' ' A' ' 118' ' ' LEU . 0.0 OUTLIER -96.68 118.96 34.27 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.456 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 3.8 mp -105.92 155.79 6.83 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 1 O-C-N 129.289 4.118 . . . . 0.0 111.1 179.587 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.456 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.307 2.4 tt -132.05 141.18 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.41 0 O-C-N 127.555 3.035 . . . . 0.0 106.486 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.7 t -141.08 85.12 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.752 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.53 131.51 37.6 Favored 'General case' 0 CA--C 1.494 -1.182 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.439 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -140.78 -6.87 1.11 Allowed 'General case' 0 CA--C 1.483 -1.626 0 O-C-N 127.777 3.173 . . . . 0.0 118.06 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 115.21 102.88 2.42 Favored Glycine 0 N--CA 1.474 1.209 0 CA-C-N 120.752 1.615 . . . . 0.0 111.177 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 56.42 26.46 10.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 126.314 1.832 . . . . 0.0 112.102 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -173.5 85.57 0.05 Allowed 'General case' 0 C--O 1.22 -0.475 0 O-C-N 128.235 3.459 . . . . 0.0 112.704 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.477 ' CD1' HD23 ' A' ' 94' ' ' LEU . 35.9 t80 -108.36 119.18 38.75 Favored 'General case' 0 CA--C 1.502 -0.899 0 O-C-N 127.623 3.077 . . . . 0.0 113.99 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -128.15 100.72 5.97 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.476 ' O ' ' N ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -78.21 124.1 27.68 Favored 'General case' 0 C--O 1.217 -0.638 0 O-C-N 129.019 3.95 . . . . 0.0 106.203 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.35 138.22 47.68 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 126.519 2.387 . . . . 0.0 111.232 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.432 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 4.7 t -100.1 143.74 29.95 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 125.936 2.023 . . . . 0.0 110.11 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -118.16 37.54 3.97 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 112.148 -2.296 . . . . 0.0 115.626 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.438 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 63.3 m -96.51 106.79 19.1 Favored 'General case' 0 N--CA 1.476 0.864 1 O-C-N 131.643 5.589 . . . . 0.0 106.318 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.5 m -43.69 -48.42 7.88 Favored 'General case' 0 CA--C 1.501 -0.919 0 O-C-N 127.942 3.277 . . . . 0.0 110.761 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.561 ' CD2' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -50.89 -37.2 42.21 Favored 'General case' 0 C--N 1.365 1.245 0 O-C-N 126.421 2.325 . . . . 0.0 111.692 -179.714 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -169.31 124.84 0.87 Allowed 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 129.926 4.516 . . . . 0.0 117.941 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.432 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 3.9 m-80 -115.56 79.07 1.24 Allowed 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 111.231 -2.713 . . . . 0.0 108.86 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -62.01 -47.31 85.34 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 126.934 2.646 . . . . 0.0 106.69 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 52.83 123.2 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 130.098 4.624 . . . . 0.0 117.154 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.49 ' CD2' ' CZ2' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -86.06 95.04 9.4 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 127.173 2.796 . . . . 0.0 109.256 178.841 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -131.39 92.38 3.17 Favored 'General case' 0 C--O 1.208 -1.105 0 C-N-CA 116.409 -2.116 . . . . 0.0 109.597 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.489 ' CE2' ' HB ' ' A' ' 87' ' ' VAL . 0.1 OUTLIER -143.37 -141.78 0.13 Allowed 'General case' 0 CA--C 1.484 -1.582 0 CA-C-N 112.566 -2.106 . . . . 0.0 111.114 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.26 0.8 OUTLIER -158.83 159.79 35.48 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 179.819 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.456 HG12 ' CD1' ' A' ' 89' ' ' TRP . 15.4 t -77.42 144.73 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 O-C-N 125.03 1.457 . . . . 0.0 111.732 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 75.21 1.48 64.12 Favored Glycine 0 CA--C 1.491 -1.434 0 CA-C-N 109.916 -3.311 . . . . 0.0 116.397 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.305 1.4 t -67.54 -45.77 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 CA-C-N 112.374 -1.913 . . . . 0.0 107.527 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 72.9 92.3 0.08 Allowed 'General case' 0 C--N 1.353 0.72 0 CA-C-N 109.613 -3.449 . . . . 0.0 109.898 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.404 ' O ' ' N ' ' A' ' 73' ' ' GLU . 1.5 m-30 -71.55 82.82 0.83 Allowed 'General case' 0 C--N 1.356 0.879 0 O-C-N 128.085 3.366 . . . . 0.0 111.013 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 12.7 p30 -56.22 79.29 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 113.707 -1.588 . . . . 0.0 111.736 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.453 ' HB3' ' CA ' ' A' ' 82' ' ' ASN . 1.4 mt-10 56.38 89.71 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 123.182 1.468 . . . . 0.0 109.936 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.4 ' CD2' ' CE2' ' A' ' 71' ' ' PHE . 1.3 t60 -163.68 98.44 0.88 Allowed 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 111.69 -2.505 . . . . 0.0 115.107 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.42 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -127.81 -60.61 1.15 Allowed 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.33 -1.305 . . . . 0.0 111.139 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.42 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.1 OUTLIER 49.27 -178.86 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 128.428 3.966 . . . . 0.0 116.248 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.55 -84.7 0.27 Allowed Glycine 0 C--O 1.211 -1.326 0 CA-C-N 108.833 -3.803 . . . . 0.0 112.747 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.477 HD13 ' CD1' ' A' ' 26' ' ' ILE . 5.4 tp -57.72 -60.98 2.87 Favored 'General case' 0 N--CA 1.451 -0.376 1 CA-C-N 107.481 -4.359 . . . . 0.0 114.285 179.874 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.474 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 8.1 t0 -115.09 -54.79 2.53 Favored 'General case' 0 CA--C 1.494 -1.187 0 O-C-N 126.928 2.642 . . . . 0.0 110.594 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 68.64 89.25 0.07 OUTLIER Glycine 0 N--CA 1.473 1.129 0 CA-C-N 112.133 -2.303 . . . . 0.0 111.651 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.9 tpp85 -129.4 -131.65 0.21 Allowed 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 111.743 -2.228 . . . . 0.0 112.139 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.453 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 6.9 p-10 -164.09 81.05 0.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 117.997 -1.481 . . . . 0.0 107.729 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.425 HG13 ' N ' ' A' ' 99' ' ' LYS . 0.1 OUTLIER -126.31 133.41 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.505 0 N-CA-C 118.754 2.872 . . . . 0.0 118.754 -179.36 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 90.36 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.705 0 O-C-N 128.595 3.684 . . . . 0.0 107.421 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 83' ' ' VAL . 94.6 m -86.73 58.14 4.89 Favored 'General case' 0 C--O 1.201 -1.49 0 CA-C-N 109.648 -3.433 . . . . 0.0 113.818 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.4 tt -62.82 144.6 56.41 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 109.141 -3.663 . . . . 0.0 112.81 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.489 ' HB ' ' CE2' ' A' ' 65' ' ' PHE . 2.0 p -130.7 132.76 64.08 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 CA-C-N 110.812 -2.904 . . . . 0.0 109.466 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.256 90.1 m -153.82 169.63 22.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 111.477 -2.601 . . . . 0.0 110.716 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.66 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 23.8 m95 -98.38 138.96 34.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 C-N-CA 128.55 2.74 . . . . 0.0 106.22 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.445 ' CB ' HG21 ' A' ' 93' ' ' THR . 1.6 tt0 -95.96 -47.08 6.27 Favored 'General case' 0 CA--C 1.479 -1.773 1 CA-C-O 128.776 4.131 . . . . 0.0 116.292 -179.55 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -176.43 -51.65 0.06 OUTLIER Glycine 0 C--O 1.197 -2.196 0 CA-C-N 109.302 -3.59 . . . . 0.0 106.333 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.01 31.49 1.78 Allowed 'General case' 0 C--O 1.209 -1.036 1 O-C-N 131.945 5.144 . . . . 0.0 111.176 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.445 HG21 ' CB ' ' A' ' 90' ' ' GLU . 0.8 OUTLIER -167.83 165.46 13.97 Favored 'General case' 0 C--O 1.202 -1.425 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.477 HD23 ' CD1' ' A' ' 50' ' ' PHE . 2.1 tp -95.12 86.17 4.52 Favored 'General case' 0 C--O 1.204 -1.314 0 CA-C-N 111.138 -2.756 . . . . 0.0 117.477 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.344 2.5 t -82.25 125.82 39.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.737 0 CA-C-N 109.653 -3.43 . . . . 0.0 111.976 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.434 ' HB2' ' CZ3' ' A' ' 107' ' ' TRP . 14.3 m -132.49 129.13 38.77 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 125.727 2.679 . . . . 0.0 105.24 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -114.19 77.57 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.58 0 CA-C-N 110.754 -2.93 . . . . 0.0 118.902 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -60.62 111.44 1.61 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 119.682 -1.886 . . . . 0.0 108.088 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.425 ' N ' HG13 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.27 143.5 35.96 Favored 'General case' 0 C--O 1.195 -1.813 0 C-N-CA 113.744 -3.182 . . . . 0.0 113.306 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 146.39 137.87 3.1 Favored Glycine 0 C--O 1.213 -1.159 0 C-N-CA 119.259 -1.448 . . . . 0.0 111.032 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 66.88 -59.92 0.36 Allowed 'General case' 0 C--N 1.353 0.753 0 CA-C-N 110.206 -2.997 . . . . 0.0 112.179 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.19 -31.81 0.05 Allowed 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.29 146.69 54.31 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 125.879 2.752 . . . . 0.0 117.311 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.404 ' O ' ' N ' ' A' ' 122' ' ' CYS . 11.6 m-20 -127.25 78.97 1.85 Allowed 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.224 -4.989 . . . . 0.0 101.683 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -98.42 3.11 48.39 Favored 'General case' 0 C--O 1.199 -1.602 1 O-C-N 131.078 5.237 . . . . 0.0 112.664 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -33.56 85.66 0.01 OUTLIER Glycine 0 N--CA 1.428 -1.884 2 O-C-N 133.004 6.44 . . . . 0.0 114.929 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.49 ' CZ2' ' CD2' ' A' ' 63' ' ' LEU 0.273 0.0 OUTLIER -97.42 129.56 44.63 Favored 'General case' 0 C--O 1.197 -1.669 0 O-C-N 129.934 3.961 . . . . 0.0 109.807 179.308 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.405 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.2 OUTLIER -155.03 156.67 36.33 Favored 'General case' 0 C--O 1.211 -0.942 0 O-C-N 129.011 3.944 . . . . 0.0 115.951 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.431 ' NE2' ' CD1' ' A' ' 107' ' ' TRP 0.299 39.2 mm-40 -114.05 165.97 12.09 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 111.201 -2.727 . . . . 0.0 110.927 -177.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.423 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.8 OUTLIER -175.76 95.71 0.06 Allowed 'General case' 0 C--O 1.213 -0.858 1 O-C-N 129.986 4.553 . . . . 0.0 116.009 177.955 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.3 t -38.85 98.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.91 0 CA-C-O 127.036 3.303 . . . . 0.0 112.277 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -104.2 56.19 0.72 Allowed 'General case' 0 CA--C 1.488 -1.408 0 CA-C-N 109.361 -3.563 . . . . 0.0 117.235 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 105.17 -111.61 3.79 Favored Glycine 0 C--O 1.205 -1.712 0 CA-C-N 113.593 -1.639 . . . . 0.0 113.09 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -112.74 19.36 17.49 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 117.413 2.375 . . . . 0.0 117.413 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.464 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 4.5 pttt -158.91 163.43 36.56 Favored 'General case' 0 N--CA 1.476 0.825 2 O-C-N 131.189 5.306 . . . . 0.0 109.807 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.8 mt -105.39 173.13 6.44 Favored 'General case' 0 CA--C 1.494 -1.206 0 O-C-N 127.104 2.753 . . . . 0.0 112.503 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -133.9 93.73 3.15 Favored 'General case' 0 C--O 1.206 -1.206 0 O-C-N 127.95 3.281 . . . . 0.0 113.803 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.533 HD12 ' CZ ' ' A' ' 131' ' ' PHE . 2.3 mp -79.6 70.93 6.17 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 111.467 -2.606 . . . . 0.0 106.479 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.423 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 17.0 mt-10 -85.6 108.14 17.84 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 127.387 2.929 . . . . 0.0 109.075 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.459 ' CD2' ' HB3' ' A' ' 127' ' ' CYS . 0.6 OUTLIER -126.28 177.78 6.22 Favored 'General case' 0 N--CA 1.484 1.275 1 O-C-N 130.091 4.619 . . . . 0.0 113.013 179.83 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.1 m -125.76 170.55 11.46 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 110.593 -3.003 . . . . 0.0 105.364 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER -169.37 38.37 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 123.888 1.804 . . . . 0.0 111.592 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 117.18 -67.3 0.32 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 112.735 -2.03 . . . . 0.0 108.257 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -173.8 43.34 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.005 0 CA-C-N 109.661 -3.269 . . . . 0.0 109.932 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -120.86 4.89 10.49 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 111.669 -2.514 . . . . 0.0 110.006 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 8.0 p 6.67 71.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 O-C-N 128.433 3.583 . . . . 0.0 114.925 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.459 ' HB3' ' CD2' ' A' ' 120' ' ' LEU . 0.5 OUTLIER -66.11 142.82 57.64 Favored 'General case' 0 C--O 1.219 -0.538 0 O-C-N 120.441 -1.412 . . . . 0.0 111.142 -179.532 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.61 147.54 48.68 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 128.432 3.583 . . . . 0.0 110.949 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -122.7 171.06 9.43 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 118.312 -1.355 . . . . 0.0 112.654 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.15 138.3 30.15 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.422 0 N-CA-C 103.543 -2.762 . . . . 0.0 103.543 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.533 ' CZ ' HD12 ' A' ' 118' ' ' LEU . 45.5 m-85 -126.31 179.97 5.03 Favored 'General case' 0 CA--C 1.488 -1.426 0 CA-C-O 128.149 3.833 . . . . 0.0 117.965 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER -161.89 113.35 1.68 Allowed 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 111.196 -2.729 . . . . 0.0 103.773 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.59 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 33.3 ttpt -58.07 89.77 0.01 OUTLIER 'General case' 0 C--O 1.194 -1.867 0 O-C-N 126.654 2.471 . . . . 0.0 115.299 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt . . . . . 0 C--O 1.26 1.616 0 O-C-N 127.866 3.229 . . . . 0.0 117.906 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 25.0 mttt . . . . . 0 CA--C 1.491 -1.326 0 CA-C-O 122.325 1.06 . . . . 0.0 113.096 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -72.02 -151.86 0.02 OUTLIER 'General case' 0 C--O 1.24 0.562 0 N-CA-C 104.531 -2.396 . . . . 0.0 104.531 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -171.14 135.89 1.03 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 103.28 -2.859 . . . . 0.0 103.28 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -51.43 124.76 12.71 Favored 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 131.456 5.472 . . . . 0.0 113.345 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.11 -173.95 43.97 Favored Glycine 0 C--O 1.206 -1.647 0 CA-C-O 116.426 -2.319 . . . . 0.0 113.895 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.2 m -127.18 124.37 38.86 Favored 'General case' 0 C--O 1.209 -1.036 1 O-C-N 132.911 5.712 . . . . 0.0 104.937 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.509 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -118.0 90.35 3.31 Favored 'General case' 0 CA--C 1.493 -1.249 1 O-C-N 129.224 4.077 . . . . 0.0 114.467 179.882 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.57 100.19 0.05 OUTLIER 'General case' 0 C--O 1.218 -0.579 0 O-C-N 126.901 2.626 . . . . 0.0 108.039 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.42 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -33.37 -58.04 0.4 Allowed 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.04 3.337 . . . . 0.0 107.335 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 90.37 -28.21 0.04 OUTLIER 'General case' 0 C--O 1.199 -1.603 1 O-C-N 131.818 5.699 . . . . 0.0 111.006 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.256 3.3 p -175.7 177.25 1.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 124.513 2.102 . . . . 0.0 110.882 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -146.08 168.86 19.9 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 108.828 -3.805 . . . . 0.0 111.458 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -102.18 -107.09 0.25 Allowed 'General case' 0 CA--C 1.477 -1.841 2 O-C-N 133.237 6.586 . . . . 0.0 111.828 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -84.77 87.03 7.28 Favored 'General case' 0 C--O 1.21 -1.013 0 O-C-N 118.783 -2.448 . . . . 0.0 110.464 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.44 -52.23 65.45 Favored 'General case' 0 C--O 1.207 -1.176 0 CA-C-O 127.584 3.564 . . . . 0.0 112.62 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.48 ' CG ' ' HG3' ' A' ' 31' ' ' ARG . 1.1 mp0 -62.06 -51.79 66.54 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 112.297 -2.229 . . . . 0.0 116.379 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.481 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.07 -21.65 11.23 Favored Glycine 0 CA--C 1.484 -1.86 1 O-C-N 129.563 4.289 . . . . 0.0 113.651 -179.931 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.456 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -73.81 -45.7 49.81 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 126.237 2.922 . . . . 0.0 105.654 179.615 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.6 mtm -71.73 -25.38 62.04 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 112.543 -2.117 . . . . 0.0 112.066 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.481 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 1.0 OUTLIER -79.73 -33.92 40.42 Favored 'General case' 0 C--O 1.215 -0.753 0 O-C-N 128.024 3.327 . . . . 0.0 114.989 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.97 78.0 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 109.462 -3.517 . . . . 0.0 113.675 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.423 ' CD1' ' HA ' ' A' ' 79' ' ' ASP . 1.1 pp -84.19 -7.15 59.44 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 128.304 3.502 . . . . 0.0 108.093 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 46.35 93.67 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.59 0 CA-C-O 127.269 3.414 . . . . 0.0 111.105 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.4 HD13 ' HA ' ' A' ' 78' ' ' LEU . 19.7 tt -111.07 28.45 2.07 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 1 CA-C-O 129.093 4.282 . . . . 0.0 108.869 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.443 ' C ' ' CD1' ' A' ' 28' ' ' PHE . 30.5 m-20 77.03 53.35 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 CA-C-N 108.637 -3.892 . . . . 0.0 110.427 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.605 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER 12.15 69.97 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.104 1 O-C-N 130.319 4.762 . . . . 0.0 117.374 179.036 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.87 -175.01 2.91 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 112.591 -2.095 . . . . 0.0 106.677 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.2 m 93.57 -20.51 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 2 O-C-N 132.95 6.406 . . . . 0.0 114.707 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.48 ' HG3' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -77.53 -171.4 2.14 Favored 'General case' 0 N--CA 1.44 -0.936 1 O-C-N 130.83 5.081 . . . . 0.0 110.839 179.737 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.501 ' C ' ' CG1' ' A' ' 33' ' ' ILE . 0.3 OUTLIER 75.75 21.26 1.69 Allowed 'General case' 0 CA--C 1.498 -1.034 0 O-C-N 128.749 3.78 . . . . 0.0 113.643 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.501 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -170.12 -40.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 O-C-N 128.917 3.886 . . . . 0.0 113.268 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.526 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -72.77 -12.91 61.19 Favored 'General case' 0 C--O 1.209 -1.048 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.56 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -15.03 -48.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 O-C-N 128.789 3.806 . . . . 0.0 114.659 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.428 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 14.7 tpt180 -177.79 144.56 0.37 Allowed 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 127.321 2.888 . . . . 0.0 115.219 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.551 ' HG ' ' CD2' ' A' ' 58' ' ' PHE . 1.1 pp -175.52 147.96 0.88 Allowed 'General case' 0 CA--C 1.539 0.532 2 O-C-N 130.675 4.984 . . . . 0.0 109.005 178.73 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 m 1.97 58.42 0.0 OUTLIER 'General case' 0 CA--C 1.482 -1.653 1 O-C-N 133.467 6.729 . . . . 0.0 112.982 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.429 ' HG3' ' N ' ' A' ' 40' ' ' THR . 1.4 tp60 -74.19 137.94 43.44 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.429 ' N ' ' HG3' ' A' ' 39' ' ' GLN . 2.9 m -150.6 124.28 9.13 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 109.524 -3.489 . . . . 0.0 114.782 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.432 ' HD2' ' HB2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -109.99 156.85 19.95 Favored 'General case' 0 N--CA 1.49 1.553 1 O-C-N 129.55 4.281 . . . . 0.0 101.938 179.044 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.487 ' N ' ' O ' ' A' ' 53' ' ' LYS . 66.3 mt -149.18 157.71 6.68 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 O-C-N 126.717 2.511 . . . . 0.0 112.198 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.442 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 0.2 OUTLIER -142.02 135.79 29.24 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 109.014 -3.721 . . . . 0.0 105.981 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.1 t -119.35 -32.62 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.194 0 CA-C-N 112.032 -2.349 . . . . 0.0 116.449 -178.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.416 ' HG2' HD12 ' A' ' 43' ' ' ILE . 0.5 OUTLIER 23.45 72.09 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -18.75 64.89 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 108.705 -3.861 . . . . 0.0 110.744 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.96 -95.92 0.16 Allowed Glycine 0 C--O 1.2 -2.016 0 CA-C-N 113.637 -1.619 . . . . 0.0 114.23 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -82.05 -27.44 32.99 Favored 'General case' 0 C--O 1.22 -0.497 0 O-C-N 125.874 1.573 . . . . 0.0 111.124 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.7 99.22 11.09 Favored 'General case' 0 CA--C 1.54 0.591 1 O-C-N 129.601 4.313 . . . . 0.0 108.462 179.32 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.448 ' CD2' ' CD1' ' A' ' 94' ' ' LEU . 90.5 t80 -100.38 104.16 15.58 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 128.447 3.592 . . . . 0.0 114.526 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 36.9 mttm -125.72 83.03 2.12 Favored 'General case' 0 CA--C 1.496 -1.115 1 O-C-N 129.181 4.051 . . . . 0.0 119.097 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.493 ' CB ' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.09 151.85 46.4 Favored 'General case' 0 C--N 1.362 1.146 1 O-C-N 129.281 4.113 . . . . 0.0 106.373 179.664 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -144.84 165.44 28.12 Favored 'General case' 0 CA--C 1.49 -1.342 0 C-N-CA 115.328 -2.549 . . . . 0.0 111.901 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -129.8 137.05 50.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 125.234 2.445 . . . . 0.0 108.171 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -119.7 51.15 1.19 Allowed 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 110.799 -2.91 . . . . 0.0 115.725 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.45 115.05 27.69 Favored 'General case' 0 N--CA 1.483 1.192 1 O-C-N 133.832 6.957 . . . . 0.0 105.178 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.3 p -45.11 -44.36 10.46 Favored 'General case' 0 CA--C 1.511 -0.541 1 O-C-N 129.361 4.163 . . . . 0.0 110.296 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.551 ' CD2' ' HG ' ' A' ' 37' ' ' LEU . 6.3 m-85 -48.75 -71.57 0.06 Allowed 'General case' 0 C--N 1.366 1.311 0 O-C-N 128.433 3.583 . . . . 0.0 110.499 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.2 mmt180 -128.44 133.29 48.51 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-N 108.876 -3.784 . . . . 0.0 113.257 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -136.39 83.53 2.01 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 126.821 2.576 . . . . 0.0 107.32 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -99.37 -37.37 9.26 Favored 'General case' 0 C--N 1.32 -0.677 0 O-C-N 127.952 3.283 . . . . 0.0 108.672 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.63 152.01 0.06 Allowed 'General case' 0 C--O 1.199 -1.556 0 O-C-N 128.527 3.642 . . . . 0.0 116.684 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.531 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 7.3 tp -99.33 73.88 1.9 Allowed 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 112.577 -2.101 . . . . 0.0 110.908 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.86 100.26 9.49 Favored 'General case' 0 CA--C 1.487 -1.449 0 O-C-N 126.998 2.686 . . . . 0.0 113.148 -179.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.531 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 21.0 m-85 -127.01 -175.23 3.36 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 126.093 2.854 . . . . 0.0 106.994 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -134.75 115.24 13.51 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.351 -3.203 . . . . 0.0 102.351 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 p -46.72 123.84 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.483 -1.616 0 O-C-N 126.954 2.659 . . . . 0.0 116.083 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 60.8 53.8 42.24 Favored Glycine 0 CA--C 1.487 -1.683 0 O-C-N 127.324 2.89 . . . . 0.0 117.923 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.277 1.8 p -122.26 10.25 5.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.354 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 52.44 72.9 0.37 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.377 5.423 . . . . 0.0 108.308 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.413 ' O ' ' N ' ' A' ' 73' ' ' GLU . 7.7 t80 -63.71 82.16 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.066 0 CA-C-N 108.582 -3.917 . . . . 0.0 118.325 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -65.13 84.94 0.05 Allowed 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 123.436 1.588 . . . . 0.0 109.417 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 71' ' ' PHE . 32.3 tt0 -71.14 148.91 46.92 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-O 124.819 2.247 . . . . 0.0 108.168 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.9 m80 -140.6 59.39 1.55 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-N 110.257 -3.156 . . . . 0.0 109.852 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.42 ' OG1' ' N ' ' A' ' 81' ' ' ARG . 27.9 p -35.22 146.65 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 110.391 -3.095 . . . . 0.0 114.73 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.81 144.04 0.07 Allowed 'General case' 0 C--O 1.212 -0.911 0 O-C-N 128.994 3.934 . . . . 0.0 111.396 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.91 2.48 64.66 Favored Glycine 0 C--O 1.205 -1.675 0 CA-C-N 111.55 -2.568 . . . . 0.0 107.43 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.4 ' HA ' HD13 ' A' ' 26' ' ' ILE . 8.1 tp -147.99 -57.86 0.24 Allowed 'General case' 0 CA--C 1.506 -0.72 1 O-C-N 131.185 4.697 . . . . 0.0 117.266 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.423 ' HA ' ' CD1' ' A' ' 24' ' ' LEU . 60.3 t0 -111.13 -62.59 1.52 Allowed 'General case' 0 CA--C 1.502 -0.875 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.06 64.79 1.29 Allowed Glycine 0 N--CA 1.476 1.365 0 CA-C-O 126.171 3.095 . . . . 0.0 109.808 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.42 ' N ' ' OG1' ' A' ' 75' ' ' THR . 5.4 tpt180 -145.75 -131.63 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 109.166 -3.517 . . . . 0.0 112.635 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -164.15 -100.78 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 115.114 -2.374 . . . . 0.0 108.294 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.416 HG11 ' N ' ' A' ' 84' ' ' LYS . 21.2 t 91.82 146.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 O-C-N 128.544 3.653 . . . . 0.0 117.027 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.416 ' N ' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -90.86 87.31 6.6 Favored 'General case' 0 C--O 1.219 -0.522 2 O-C-N 129.398 4.186 . . . . 0.0 107.289 179.508 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 61.7 m -96.41 86.15 4.1 Favored 'General case' 0 C--O 1.202 -1.404 0 O-C-N 128.229 3.456 . . . . 0.0 112.091 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 tp -87.24 94.69 9.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 108.595 -3.911 . . . . 0.0 116.259 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.2 t -74.4 141.74 15.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 O-C-N 119.586 -1.946 . . . . 0.0 108.763 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.407 ' CG2' ' HB ' ' A' ' 95' ' ' VAL . 9.3 t -164.04 172.73 13.44 Favored 'General case' 0 CA--C 1.488 -1.43 0 CA-C-O 126.87 3.224 . . . . 0.0 110.833 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.686 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 49.7 m95 -98.71 136.93 38.05 Favored 'General case' 0 N--CA 1.437 -1.101 0 O-C-N 117.916 -2.99 . . . . 0.0 109.377 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.497 ' CG ' ' CG2' ' A' ' 95' ' ' VAL . 0.3 OUTLIER -93.1 -11.15 33.64 Favored 'General case' 0 CA--C 1.475 -1.94 1 CA-C-O 133.642 6.449 . . . . 0.0 113.966 179.569 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.34 -42.18 1.33 Allowed Glycine 0 C--O 1.198 -2.152 1 CA-C-N 107.588 -4.369 . . . . 0.0 104.594 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -152.85 60.8 0.79 Allowed 'General case' 0 C--O 1.204 -1.312 1 O-C-N 131.594 4.938 . . . . 0.0 110.577 -179.768 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.463 ' CG2' ' HB2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.91 130.5 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.124 0 O-C-N 127.084 2.74 . . . . 0.0 118.048 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.448 ' CD1' ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -74.13 92.32 2.18 Favored 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 130.323 4.765 . . . . 0.0 110.758 179.787 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.497 ' CG2' ' CG ' ' A' ' 90' ' ' GLU 0.284 79.5 t -90.36 140.6 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 1 O-C-N 130.655 4.972 . . . . 0.0 115.248 -179.75 . . . . . . . . 4 3 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.501 ' HB3' ' CZ3' ' A' ' 107' ' ' TRP . 4.5 t -143.95 122.71 12.63 Favored 'General case' 0 C--O 1.195 -1.778 0 O-C-N 125.573 1.796 . . . . 0.0 106.328 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.4 t -101.34 105.2 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.862 0 CA-C-N 111.172 -2.74 . . . . 0.0 111.902 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.439 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 5.1 mt-30 -86.29 100.79 12.53 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 123.822 1.772 . . . . 0.0 109.88 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.12 96.75 8.67 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 110.037 -3.256 . . . . 0.0 110.507 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -93.29 -97.67 1.48 Allowed Glycine 0 C--O 1.206 -1.646 0 CA-C-N 112.719 -2.037 . . . . 0.0 110.891 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.64 -53.17 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 108.974 -3.613 . . . . 0.0 109.244 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.447 ' CD ' ' HB3' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -94.02 -39.61 10.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 111.047 -2.797 . . . . 0.0 112.833 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.447 ' HB3' ' CD ' ' A' ' 102' ' ' LYS . 2.0 pt-20 -115.96 146.63 41.94 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 111.163 -2.744 . . . . 0.0 114.899 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -106.07 97.54 7.34 Favored 'General case' 0 N--CA 1.478 0.957 2 O-C-N 130.29 4.743 . . . . 0.0 102.9 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.422 ' HD3' ' HA ' ' A' ' 122' ' ' CYS . 0.1 OUTLIER -101.5 5.46 41.89 Favored 'General case' 0 C--O 1.214 -0.781 1 O-C-N 130.483 4.864 . . . . 0.0 110.065 -179.724 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.439 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -45.75 93.68 0.01 OUTLIER Glycine 0 N--CA 1.426 -2.012 2 O-C-N 132.393 6.058 . . . . 0.0 114.277 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.595 ' HE1' ' NE2' ' A' ' 109' ' ' GLN 0.289 0.0 OUTLIER -108.24 136.32 48.09 Favored 'General case' 0 C--O 1.214 -0.802 1 O-C-N 132.262 5.331 . . . . 0.0 110.304 179.808 . . . . . . . . 5 4 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.39 159.33 43.52 Favored 'General case' 0 CA--C 1.506 -0.728 1 O-C-N 131.121 5.263 . . . . 0.0 113.391 -178.637 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.595 ' NE2' ' HE1' ' A' ' 107' ' ' TRP 0.279 1.0 OUTLIER -134.04 123.53 24.68 Favored 'General case' 0 C--N 1.368 1.371 0 C-N-CA 115.999 -2.28 . . . . 0.0 111.172 -178.393 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.531 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -117.46 171.32 8.07 Favored 'General case' 0 CA--C 1.498 -1.031 0 O-C-N 128.987 3.93 . . . . 0.0 112.163 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.1 t -109.57 98.81 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.905 0 CA-C-O 124.499 2.095 . . . . 0.0 112.443 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -108.14 85.68 2.16 Favored 'General case' 0 CA--C 1.479 -1.766 0 CA-C-O 125.816 2.722 . . . . 0.0 113.317 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 90.25 -109.28 3.63 Favored Glycine 0 C--O 1.2 -2.024 0 CA-C-N 113.027 -1.897 . . . . 0.0 115.439 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -105.93 -7.78 17.99 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 114.572 -2.632 . . . . 0.0 113.829 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.437 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -127.1 174.06 9.2 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 133.132 6.52 . . . . 0.0 110.227 179.954 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -136.43 128.26 29.21 Favored 'General case' 0 C--O 1.202 -1.429 0 O-C-N 124.787 1.305 . . . . 0.0 110.517 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.531 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.1 m-85 -78.57 167.17 21.66 Favored 'General case' 0 C--O 1.202 -1.44 0 O-C-N 128.618 3.699 . . . . 0.0 110.11 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.513 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -140.45 59.54 1.55 Allowed 'General case' 0 CA--C 1.509 -0.624 1 CA-C-N 107.291 -4.504 . . . . 0.0 108.079 -179.845 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.2 109.26 1.48 Allowed 'General case' 0 CA--C 1.506 -0.722 0 O-C-N 127.525 3.016 . . . . 0.0 110.525 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.13 148.98 39.75 Favored 'General case' 0 CA--C 1.487 -1.461 1 O-C-N 130.044 4.59 . . . . 0.0 109.902 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 45.5 m -118.47 162.03 19.02 Favored 'General case' 0 C--O 1.208 -1.113 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -161.25 33.52 0.14 Allowed 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 124.2 1.952 . . . . 0.0 113.941 179.799 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 104.04 -94.49 1.08 Allowed Glycine 0 CA--C 1.505 -0.531 0 CA-C-N 111.428 -2.624 . . . . 0.0 112.272 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.85 -31.58 45.69 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 112.171 -2.014 . . . . 0.0 111.625 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -103.33 176.87 5.01 Favored 'General case' 0 C--O 1.214 -0.785 1 O-C-N 129.104 4.003 . . . . 0.0 109.332 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.1 m -156.19 87.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 CA-C-N 108.842 -3.799 . . . . 0.0 111.672 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 t -66.49 113.71 4.93 Favored 'General case' 0 CA--C 1.489 -1.392 0 C-N-CA 125.58 1.552 . . . . 0.0 112.765 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.73 93.58 9.31 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 117.612 -1.635 . . . . 0.0 110.858 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -75.82 165.54 24.86 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 117.532 2.419 . . . . 0.0 117.532 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.508 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -132.46 150.11 32.97 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.428 0 CA-C-O 124.373 2.035 . . . . 0.0 109.058 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.513 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 88.7 m-85 -148.89 175.13 11.53 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 110.854 -2.884 . . . . 0.0 116.509 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.437 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -155.78 137.05 13.88 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 111.9 -2.409 . . . . 0.0 104.98 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.467 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 5.7 ttpt -77.74 94.91 4.54 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 118.185 2.661 . . . . 0.0 118.185 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt . . . . . 0 C--O 1.259 1.557 0 CA-C-O 114.895 -2.479 . . . . 0.0 116.852 179.857 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 mttt . . . . . 0 CA--C 1.492 -1.275 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -67.92 -53.36 27.0 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.411 ' HB2' ' HB3' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 69.24 169.67 0.3 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.956 2.66 . . . . 0.0 107.468 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 26.31 120.04 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.43 1 O-C-N 129.361 4.163 . . . . 0.0 117.876 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -169.51 -128.32 1.0 Allowed Glycine 0 CA--C 1.532 1.112 0 CA-C-N 112.267 -2.242 . . . . 0.0 114.2 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.538 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 3.7 t 168.63 147.74 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.948 1 O-C-N 133.323 5.954 . . . . 0.0 106.479 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.538 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -145.72 103.02 3.74 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.496 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' N ' ' A' ' 12' ' ' GLU 0.259 1.8 mt-10 -64.56 92.49 0.09 Allowed 'General case' 0 C--O 1.213 -0.861 0 O-C-N 126.72 2.513 . . . . 0.0 108.52 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.523 ' HG3' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -42.26 96.01 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 1 O-C-N 130.227 4.704 . . . . 0.0 103.81 -179.917 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' GLU . 27.8 tt0 -35.81 -37.45 0.1 Allowed 'General case' 0 C--O 1.21 -1.014 1 O-C-N 130.383 4.802 . . . . 0.0 107.403 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.263 4.6 p 173.55 141.08 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 110.723 -2.944 . . . . 0.0 110.327 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -96.69 130.37 43.93 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 111.746 -2.479 . . . . 0.0 110.913 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -116.77 140.64 49.2 Favored 'General case' 0 CA--C 1.499 -1.01 0 O-C-N 128.047 3.342 . . . . 0.0 110.563 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 49.53 69.7 0.57 Allowed 'General case' 0 C--O 1.205 -1.287 0 CA-C-O 126.146 2.879 . . . . 0.0 109.963 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -95.38 -40.44 9.51 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 111.41 -2.632 . . . . 0.0 107.974 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -74.93 -39.13 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 111.183 -2.735 . . . . 0.0 111.089 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.09 -26.72 73.95 Favored Glycine 0 CA--C 1.487 -1.708 0 O-C-N 127.187 2.805 . . . . 0.0 110.771 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -71.61 -31.69 67.18 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 124.961 2.315 . . . . 0.0 109.054 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 12.0 mtt -75.11 -27.04 59.68 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.874 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -79.91 -31.24 40.15 Favored 'General case' 0 C--N 1.317 -0.814 1 O-C-N 133.475 6.734 . . . . 0.0 114.92 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.82 91.38 Favored 'General case' 0 C--O 1.208 -1.086 2 O-C-N 130.835 5.084 . . . . 0.0 113.621 -179.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.5 pp -103.09 -8.26 20.67 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 110.623 -2.99 . . . . 0.0 109.543 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 49.17 99.18 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.155 1 CA-C-O 128.565 4.031 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.3 tt -124.53 42.67 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 109.556 -3.474 . . . . 0.0 109.537 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 76.45 137.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.441 0 CA-C-N 110.339 -3.118 . . . . 0.0 107.479 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -106.0 -172.64 2.13 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 116.42 2.008 . . . . 0.0 116.42 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 58.03 30.85 19.85 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 124.443 2.068 . . . . 0.0 106.343 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -101.84 -16.05 16.7 Favored 'General case' 0 C--O 1.209 -1.057 1 CA-C-N 107.783 -4.281 . . . . 0.0 115.115 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.434 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -86.57 -172.43 4.02 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 128.893 3.87 . . . . 0.0 109.949 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HG2' HG13 ' A' ' 33' ' ' ILE . 0.2 OUTLIER 82.71 7.84 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 O-C-N 129.05 3.968 . . . . 0.0 113.254 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.437 HG13 ' HG2' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -147.21 -41.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 128.561 3.663 . . . . 0.0 111.0 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -90.5 24.93 2.44 Favored 'General case' 0 C--O 1.209 -1.032 0 CA-C-O 123.637 1.684 . . . . 0.0 113.865 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 66.7 t -55.36 -27.41 20.48 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.399 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.203 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? 140.01 134.1 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.862 2 O-C-N 130.621 4.95 . . . . 0.0 108.975 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.516 ' CD2' ' CG ' ' A' ' 58' ' ' PHE . 0.3 OUTLIER -102.54 15.36 29.46 Favored 'General case' 0 N--CA 1.439 -1.019 2 O-C-N 130.377 4.798 . . . . 0.0 111.184 -179.703 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 173.54 -53.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.316 1 O-C-N 132.125 5.891 . . . . 0.0 111.113 179.64 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.416 ' NE2' ' HB3' ' A' ' 11' ' ' MET . 17.1 tt0 67.94 140.29 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 O-C-N 127.488 2.993 . . . . 0.0 115.439 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.0 m 162.42 109.39 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.82 1 O-C-N 131.189 5.305 . . . . 0.0 113.307 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.433 ' CE ' ' CD2' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -98.52 156.12 16.94 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 127.714 3.134 . . . . 0.0 106.764 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.432 ' HB ' ' HE3' ' A' ' 53' ' ' LYS . 4.4 mp -135.99 162.94 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 O-C-N 128.58 3.675 . . . . 0.0 111.497 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.492 ' CD1' ' HB2' ' A' ' 45' ' ' GLN 0.292 0.2 OUTLIER -134.5 133.25 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.566 1 CA-C-N 107.93 -4.214 . . . . 0.0 108.472 179.771 . . . . . . . . 5 4 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.5 t -107.95 -64.71 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.312 0 CA-C-N 112.226 -2.261 . . . . 0.0 108.985 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.492 ' HB2' ' CD1' ' A' ' 43' ' ' ILE . 0.0 OUTLIER 56.01 91.96 0.03 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.01 -40.52 11.05 Favored 'General case' 0 CA--C 1.49 -1.328 2 O-C-N 131.031 5.207 . . . . 0.0 113.255 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.56 -93.23 0.09 OUTLIER Glycine 0 C--O 1.2 -1.977 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.808 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.51 -19.14 24.15 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 127.516 2.539 . . . . 0.0 110.332 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.43 110.93 23.29 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 129.078 3.986 . . . . 0.0 109.917 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.496 ' CE2' HD22 ' A' ' 63' ' ' LEU . 1.7 t80 -115.84 110.25 18.77 Favored 'General case' 0 CA--C 1.497 -1.061 0 O-C-N 127.53 3.019 . . . . 0.0 111.64 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 79.47 1.44 Allowed 'General case' 0 C--O 1.202 -1.401 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.85 160.75 5.49 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 127.216 2.822 . . . . 0.0 107.507 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.432 ' HE3' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -161.91 148.87 14.02 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 115.226 -2.59 . . . . 0.0 110.301 -179.254 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 t -103.83 136.73 42.95 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-O 124.135 1.922 . . . . 0.0 109.618 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -92.55 6.86 45.67 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 115.908 -1.996 . . . . 0.0 113.038 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.4 m -47.61 102.85 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 O-C-N 131.638 5.587 . . . . 0.0 104.872 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 p -33.13 -43.82 0.11 Allowed 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.479 5.487 . . . . 0.0 109.364 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.516 ' CG ' ' CD2' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -51.37 -68.19 0.19 Allowed 'General case' 0 C--N 1.35 0.62 0 O-C-N 128.755 3.784 . . . . 0.0 111.31 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.12 135.16 30.63 Favored 'General case' 0 CA--C 1.508 -0.641 1 O-C-N 129.283 4.114 . . . . 0.0 111.962 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.57 100.4 7.11 Favored 'General case' 0 C--O 1.2 -1.503 0 O-C-N 128.835 3.835 . . . . 0.0 112.275 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -177.39 113.61 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 1 O-C-N 129.337 4.148 . . . . 0.0 108.186 -179.856 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -77.66 0.46 Allowed 'General case' 0 CA--C 1.495 -1.171 0 O-C-N 126.812 2.57 . . . . 0.0 116.56 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.553 ' CD1' ' CZ2' ' A' ' 107' ' ' TRP . 9.8 tp -112.07 39.91 2.3 Favored 'General case' 0 N--CA 1.435 -1.207 0 N-CA-C 119.554 3.168 . . . . 0.0 119.554 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.09 101.99 0.26 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 104.276 -2.491 . . . . 0.0 104.276 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.543 ' CD1' ' CG2' ' A' ' 87' ' ' VAL . 2.2 m-85 -147.18 -175.23 4.75 Favored 'General case' 0 CA--C 1.496 -1.12 1 CA-C-O 128.726 4.108 . . . . 0.0 112.304 -179.633 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.472 HG23 ' CG2' ' A' ' 69' ' ' VAL . 2.0 m -150.74 166.45 30.4 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.481 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.404 ' N ' HG23 ' A' ' 66' ' ' THR . 14.0 t -96.07 130.4 44.8 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.33 0 O-C-N 127.395 2.934 . . . . 0.0 115.544 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.75 34.81 59.16 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.224 -1.941 . . . . 0.0 116.439 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.472 ' CG2' HG23 ' A' ' 66' ' ' THR . 15.0 t -118.21 55.92 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 117.528 -1.225 . . . . 0.0 109.601 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -15.42 86.13 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.801 1 O-C-N 131.934 5.771 . . . . 0.0 115.612 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.402 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.3 m-85 -59.74 94.09 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 109.528 -3.487 . . . . 0.0 114.082 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 80.27 0.3 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 126.984 2.677 . . . . 0.0 108.654 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.468 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 67.57 150.92 0.07 Allowed 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 125.408 2.528 . . . . 0.0 112.929 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.97 62.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 108.88 -3.782 . . . . 0.0 116.166 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.404 ' C ' ' CG ' ' A' ' 76' ' ' LYS . 55.9 p -136.09 115.94 13.12 Favored 'General case' 0 C--O 1.211 -0.954 0 O-C-N 119.434 -2.041 . . . . 0.0 109.743 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.404 ' CG ' ' C ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -155.24 -64.1 0.12 Allowed 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 126.501 3.048 . . . . 0.0 111.561 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -47.96 -37.76 16.28 Favored Glycine 0 N--CA 1.468 0.831 0 CA-C-N 109.289 -3.596 . . . . 0.0 111.516 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . 0.281 1.5 tp -124.28 32.89 5.4 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.3 t0 174.46 -83.43 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 123.499 1.618 . . . . 0.0 112.983 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.93 76.91 0.99 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.674 2.083 . . . . 0.0 110.57 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -148.74 -133.19 0.06 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 111.275 -2.462 . . . . 0.0 114.09 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.468 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 2.0 p30 177.95 105.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 125.199 1.562 . . . . 0.0 109.835 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 99.6 t -136.67 134.04 48.81 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.299 0 N-CA-C 117.665 2.469 . . . . 0.0 117.665 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -60.56 107.88 0.75 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 112.116 -2.311 . . . . 0.0 106.809 178.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.402 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 94.9 m -109.77 65.55 0.62 Allowed 'General case' 0 C--O 1.204 -1.33 0 CA-C-O 126.34 2.971 . . . . 0.0 118.372 -178.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.7 tt -65.78 142.3 58.02 Favored 'General case' 0 CA--C 1.514 -0.426 1 CA-C-N 108.04 -4.164 . . . . 0.0 112.602 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.543 ' CG2' ' CD1' ' A' ' 65' ' ' PHE . 30.8 t -125.35 144.62 34.78 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 CA-C-N 110.995 -2.82 . . . . 0.0 109.682 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 t -159.72 170.54 21.32 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-O 125.743 2.687 . . . . 0.0 110.117 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.683 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 32.4 m95 -94.22 145.26 24.84 Favored 'General case' 0 CA--C 1.507 -0.703 0 C-N-CA 128.015 2.526 . . . . 0.0 106.156 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.487 ' CB ' HG22 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -95.82 -36.28 11.19 Favored 'General case' 0 C--O 1.197 -1.681 1 CA-C-O 129.888 4.661 . . . . 0.0 113.109 179.708 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.46 -47.02 0.44 Allowed Glycine 0 N--CA 1.481 1.659 1 CA-C-N 107.361 -4.472 . . . . 0.0 106.078 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -122.84 2.17 9.4 Favored 'General case' 0 N--CA 1.429 -1.49 1 O-C-N 132.74 5.612 . . . . 0.0 113.207 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.493 ' CB ' ' HA ' ' A' ' 110' ' ' TRP . 1.3 t -160.65 175.68 12.39 Favored 'General case' 0 C--O 1.202 -1.43 0 N-CA-C 119.407 3.114 . . . . 0.0 119.407 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.453 ' CD2' HD23 ' A' ' 63' ' ' LEU 0.257 2.9 tp -92.34 106.59 18.56 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 109.872 -3.331 . . . . 0.0 114.805 179.633 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.487 HG22 ' CB ' ' A' ' 90' ' ' GLU 0.327 41.1 t -108.15 126.09 64.78 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.136 0 CA-C-N 111.003 -2.817 . . . . 0.0 111.862 179.506 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.461 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -137.56 150.69 47.68 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 122.255 1.026 . . . . 0.0 108.999 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.0 m -130.79 108.08 14.88 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.545 0 CA-C-O 127.229 3.395 . . . . 0.0 118.046 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.415 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 2.9 mm-40 -85.09 112.19 20.43 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 112.243 -2.253 . . . . 0.0 108.007 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -51.68 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 128.419 3.574 . . . . 0.0 112.585 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.75 155.09 9.75 Favored Glycine 0 C--O 1.219 -0.811 0 CA-C-O 124.276 2.042 . . . . 0.0 109.128 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.29 -16.27 14.62 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 110.704 -2.748 . . . . 0.0 111.276 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -50.06 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 127.131 2.172 . . . . 0.0 113.122 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -97.04 166.56 11.54 Favored 'General case' 0 C--O 1.198 -1.633 0 CA-C-O 123.295 1.522 . . . . 0.0 113.486 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -124.48 97.33 5.26 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 108.752 -3.84 . . . . 0.0 103.398 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.424 ' HD3' ' HB3' ' A' ' 122' ' ' CYS . 0.1 OUTLIER -89.65 2.38 54.82 Favored 'General case' 0 C--O 1.203 -1.36 0 C-N-CA 125.071 1.348 . . . . 0.0 113.421 -179.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.415 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -46.06 115.48 1.75 Allowed Glycine 0 C--O 1.203 -1.84 2 CA-C-N 108.177 -4.101 . . . . 0.0 112.506 179.816 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.553 ' CZ2' ' CD1' ' A' ' 63' ' ' LEU 0.262 0.0 OUTLIER -114.02 144.93 42.29 Favored 'General case' 0 C--O 1.193 -1.888 0 O-C-N 129.974 3.985 . . . . 0.0 110.344 179.218 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.3 169.74 21.53 Favored 'General case' 0 C--O 1.207 -1.141 1 O-C-N 129.851 4.47 . . . . 0.0 116.6 -179.053 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.498 ' NE2' ' NE1' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -138.42 157.4 46.28 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 109.221 -3.627 . . . . 0.0 109.503 -179.99 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.493 ' HA ' ' CB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -146.08 12.29 1.23 Allowed 'General case' 0 CA--C 1.502 -0.878 1 O-C-N 129.835 4.46 . . . . 0.0 116.044 179.228 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 5.8 t 34.22 55.4 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-O 127.226 3.393 . . . . 0.0 116.303 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -60.63 104.53 0.35 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 110.154 -3.203 . . . . 0.0 114.536 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 58.17 -84.1 0.01 OUTLIER Glycine 0 C--O 1.204 -1.771 0 CA-C-N 114.03 -1.441 . . . . 0.0 115.991 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -134.35 49.27 2.26 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 116.428 2.011 . . . . 0.0 116.428 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.433 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.322 -0.604 0 O-C-N 127.406 2.941 . . . . 0.0 109.488 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.433 ' CD2' ' CE ' ' A' ' 41' ' ' LYS . 3.3 tt -116.0 82.23 1.74 Allowed 'General case' 0 CA--C 1.484 -1.558 0 O-C-N 128.434 3.584 . . . . 0.0 116.597 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -54.05 109.26 0.45 Allowed 'General case' 0 CA--C 1.502 -0.866 0 CA-C-N 109.984 -3.28 . . . . 0.0 114.878 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.498 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -92.02 56.77 2.96 Favored 'General case' 0 C--N 1.36 1.059 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.0 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.04 140.33 58.38 Favored 'General case' 0 CA--C 1.489 -1.366 0 C-N-CA 126.838 2.055 . . . . 0.0 107.945 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.65 162.6 41.06 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 118.32 -1.352 . . . . 0.0 109.062 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.7 t -134.43 151.53 51.24 Favored 'General case' 0 C--O 1.199 -1.579 0 O-C-N 127.147 2.78 . . . . 0.0 104.421 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.424 ' HB3' ' HD3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -141.53 30.99 1.69 Allowed 'General case' 0 CA--C 1.496 -1.11 0 CA-C-O 123.768 1.747 . . . . 0.0 114.506 -179.237 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 119.38 -61.15 0.49 Allowed Glycine 0 C--O 1.223 -0.541 0 CA-C-N 109.732 -3.394 . . . . 0.0 113.587 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -162.75 69.87 0.26 Allowed 'General case' 0 C--O 1.205 -1.271 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -140.71 -49.95 0.44 Allowed 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 110.659 -2.973 . . . . 0.0 109.85 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.4 p 49.1 87.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.131 1 O-C-N 131.55 5.531 . . . . 0.0 112.337 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -72.34 126.9 30.97 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 112.528 -2.124 . . . . 0.0 109.728 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 6.2 mmt85 -106.69 80.39 1.45 Allowed 'General case' 0 CA--C 1.484 -1.578 0 O-C-N 125.762 1.913 . . . . 0.0 112.37 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.11 161.71 2.28 Favored 'General case' 0 C--N 1.35 0.617 0 O-C-N 127.396 2.935 . . . . 0.0 114.548 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -152.42 109.32 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.211 0 CA-C-O 126.449 3.023 . . . . 0.0 104.838 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.523 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 4.2 m-85 -109.69 174.28 5.94 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-N 108.859 -3.791 . . . . 0.0 116.743 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.47 125.38 7.17 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 110.821 -2.9 . . . . 0.0 104.508 179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.534 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 18.8 ttpt -70.63 116.05 10.51 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 128.206 3.441 . . . . 0.0 109.72 178.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.486 -1.513 0 N-CA-C 118.038 2.607 . . . . 0.0 118.038 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.1 mttt . . . . . 0 N--CA 1.443 -0.792 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 57.97 89.44 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 124.428 2.061 . . . . 0.0 108.142 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -148.96 47.21 1.0 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 112.945 -1.934 . . . . 0.0 107.633 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.24 148.88 0.11 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 127.409 2.943 . . . . 0.0 113.082 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.3 174.96 40.04 Favored Glycine 0 C--O 1.223 -0.567 0 CA-C-N 110.969 -2.832 . . . . 0.0 112.77 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.425 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -116.77 136.87 52.62 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 130.104 4.061 . . . . 0.0 103.877 179.759 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.531 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.274 0.0 OUTLIER -138.88 100.2 3.98 Favored 'General case' 0 CA--C 1.495 -1.143 0 O-C-N 128.564 3.665 . . . . 0.0 112.085 -179.595 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.21 -24.4 0.46 Allowed 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 115.685 -2.102 . . . . 0.0 114.972 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.405 ' HB3' ' HG2' ' A' ' 39' ' ' GLN . 3.5 ttm 83.32 -67.58 0.07 Allowed 'General case' 0 C--O 1.244 0.813 0 O-C-N 128.364 3.54 . . . . 0.0 106.072 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.402 ' CB ' ' O ' ' A' ' 11' ' ' MET . 36.0 tt0 108.08 -44.77 0.0 OUTLIER 'General case' 0 C--O 1.206 -1.222 1 O-C-N 130.364 4.79 . . . . 0.0 111.231 179.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 177.39 153.64 0.26 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 109.004 -3.725 . . . . 0.0 110.73 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -123.69 134.71 53.68 Favored 'General case' 0 CA--C 1.486 -1.502 0 CA-C-N 111.809 -2.451 . . . . 0.0 111.943 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -73.27 -176.56 2.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 128.936 3.898 . . . . 0.0 111.572 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -9.54 80.73 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.082 0 CA-C-O 124.648 2.166 . . . . 0.0 115.479 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.523 ' CD2' ' HA ' ' A' ' 35' ' ' VAL . 8.3 t80 -80.94 -31.92 34.77 Favored 'General case' 0 C--O 1.203 -1.379 0 CA-C-N 110.038 -3.255 . . . . 0.0 110.258 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -78.24 -49.4 13.82 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 110.725 -2.943 . . . . 0.0 112.905 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -60.95 -21.59 59.12 Favored Glycine 0 C--N 1.342 0.915 0 O-C-N 127.92 3.262 . . . . 0.0 111.723 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.24 -39.34 59.98 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 127.399 2.47 . . . . 0.0 105.701 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.504 ' HE2' ' CE2' ' A' ' 17' ' ' PHE 0.251 31.9 mtt -79.74 -23.96 41.91 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 112.533 -2.121 . . . . 0.0 111.631 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -76.99 -23.84 52.27 Favored 'General case' 0 C--N 1.313 -1.007 0 O-C-N 128.798 3.811 . . . . 0.0 113.102 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.05 -54.62 9.29 Favored 'General case' 0 C--O 1.201 -1.451 1 O-C-N 129.906 4.504 . . . . 0.0 109.453 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.458 ' CD1' ' HB ' ' A' ' 26' ' ' ILE . 0.4 OUTLIER -74.33 -18.93 60.63 Favored 'General case' 0 N--CA 1.488 1.457 1 O-C-N 129.809 4.443 . . . . 0.0 106.237 -179.984 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 45.34 84.33 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.363 0 CA-C-O 126.441 3.02 . . . . 0.0 106.705 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.458 ' HB ' ' CD1' ' A' ' 24' ' ' LEU . 9.9 tt -94.8 -30.26 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.531 1 CA-C-N 107.866 -4.243 . . . . 0.0 115.353 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.439 ' N ' HG21 ' A' ' 26' ' ' ILE . 1.7 t70 -168.55 -175.74 2.58 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 118.345 -2.722 . . . . 0.0 109.997 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -127.52 115.5 18.94 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 63.81 41.46 6.82 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.871 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.11 -5.13 50.97 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 128.725 3.766 . . . . 0.0 110.648 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -75.94 -162.8 0.24 Allowed 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 128.647 2.779 . . . . 0.0 109.236 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.432 ' HG2' HG13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER 77.46 4.75 3.1 Favored 'General case' 0 CA--C 1.485 -1.549 0 O-C-N 127.424 2.953 . . . . 0.0 114.133 179.553 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.432 HG13 ' HG2' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -147.71 -73.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-N 113.416 -1.72 . . . . 0.0 113.43 179.418 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -48.98 -19.85 0.45 Allowed 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.523 ' HA ' ' CD2' ' A' ' 17' ' ' PHE . 53.7 t -26.48 -48.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.584 0 O-C-N 126.463 2.352 . . . . 0.0 109.841 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.421 ' HD2' ' HB2' ' A' ' 39' ' ' GLN . 4.6 tpp180 164.54 125.58 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.376 2 O-C-N 131.145 5.278 . . . . 0.0 111.41 178.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.538 ' HG ' ' CD1' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -142.42 85.45 1.91 Allowed 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 110.006 -3.27 . . . . 0.0 104.994 -179.9 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m 87.85 120.81 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.896 1 O-C-N 135.346 7.904 . . . . 0.0 110.689 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.421 ' HB2' ' HD2' ' A' ' 36' ' ' ARG . 46.4 tp60 -135.8 141.72 44.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 120.513 1.506 . . . . 0.0 110.821 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.3 m -168.99 80.74 0.13 Allowed 'General case' 0 C--O 1.212 -0.879 2 O-C-N 132.258 5.974 . . . . 0.0 112.364 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.427 ' CE ' ' HB ' ' A' ' 43' ' ' ILE . 0.5 OUTLIER -68.93 144.85 54.06 Favored 'General case' 0 N--CA 1.485 1.321 1 O-C-N 129.674 4.359 . . . . 0.0 103.415 -179.975 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.488 ' N ' ' O ' ' A' ' 53' ' ' LYS . 4.2 mt -138.54 103.6 2.27 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.438 0 CA-C-O 124.087 1.899 . . . . 0.0 115.387 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.589 ' CD1' ' CE1' ' A' ' 50' ' ' PHE 0.289 0.3 OUTLIER -88.17 141.04 14.86 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 1 CA-C-N 107.753 -4.294 . . . . 0.0 108.81 179.8 . . . . . . . . 5 4 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.454 ' CG1' ' N ' ' A' ' 45' ' ' GLN . 2.1 t -124.8 -66.5 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.367 0 CA-C-N 111.898 -2.41 . . . . 0.0 114.445 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.507 ' HG3' ' CG ' ' A' ' 50' ' ' PHE . 9.6 mt-30 64.39 123.38 0.02 OUTLIER 'General case' 0 CA--C 1.488 -1.424 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -152.01 37.97 0.57 Allowed 'General case' 0 CA--C 1.489 -1.384 0 C-N-CA 114.563 -2.855 . . . . 0.0 116.362 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.0 93.22 0.54 Allowed Glycine 0 C--O 1.201 -1.954 0 CA-C-N 118.985 0.811 . . . . 0.0 111.575 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 53.22 43.92 30.9 Favored 'General case' 0 CA--C 1.507 -0.698 0 O-C-N 128.066 2.862 . . . . 0.0 113.449 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 179.68 96.06 0.02 OUTLIER 'General case' 0 C--O 1.232 0.175 1 O-C-N 129.465 4.228 . . . . 0.0 109.942 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.589 ' CE1' ' CD1' ' A' ' 43' ' ' ILE . 2.0 t80 -118.75 109.95 16.68 Favored 'General case' 0 CA--C 1.483 -1.613 1 O-C-N 130.094 4.621 . . . . 0.0 112.813 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -112.86 80.48 1.35 Allowed 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 118.951 2.945 . . . . 0.0 118.951 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.474 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -63.01 150.36 42.65 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 127.742 3.151 . . . . 0.0 105.668 179.072 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -159.14 133.36 7.71 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 115.845 -2.342 . . . . 0.0 110.502 -179.14 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.29 148.11 22.77 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 126.128 2.142 . . . . 0.0 111.006 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -112.16 48.35 0.99 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 127.305 2.878 . . . . 0.0 115.081 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.533 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 1.5 p -73.04 158.18 35.91 Favored 'General case' 0 N--CA 1.475 0.814 1 O-C-N 133.091 6.494 . . . . 0.0 105.166 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -103.92 24.03 11.95 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 129.026 3.954 . . . . 0.0 107.141 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.538 ' CD1' ' HG ' ' A' ' 37' ' ' LEU . 14.5 p90 -137.36 -50.71 0.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.82 2.156 . . . . 0.0 116.82 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 -79.78 0.56 Allowed 'General case' 0 CA--C 1.503 -0.859 0 C-N-CA 115.238 -2.585 . . . . 0.0 116.781 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 64.82 67.9 0.53 Allowed 'General case' 0 C--O 1.2 -1.539 0 O-C-N 126.264 2.228 . . . . 0.0 108.883 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 -46.04 41.14 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 110.834 -2.894 . . . . 0.0 109.776 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 47.7 t0 74.24 122.13 0.04 OUTLIER 'General case' 0 CA--C 1.503 -0.838 1 O-C-N 130.437 4.836 . . . . 0.0 110.288 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.589 ' CD1' ' CZ2' ' A' ' 107' ' ' TRP . 13.8 tp -77.14 47.45 0.55 Allowed 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.297 2.248 . . . . 0.0 112.028 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -63.08 96.88 0.1 Allowed 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 106.476 -1.676 . . . . 0.0 106.476 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -134.48 169.17 17.66 Favored 'General case' 0 N--CA 1.475 0.783 1 CA-C-O 129.828 4.632 . . . . 0.0 107.908 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -156.54 126.66 6.47 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 109.715 -3.402 . . . . 0.0 105.041 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.467 HG22 ' CD1' ' A' ' 89' ' ' TRP . 7.2 p -48.27 132.91 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 0 O-C-N 126.277 2.236 . . . . 0.0 116.15 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.14 -0.44 73.56 Favored Glycine 0 C--N 1.359 1.848 0 O-C-N 127.34 2.9 . . . . 0.0 116.943 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -65.08 -40.47 89.04 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 C-N-CA 118.398 -1.321 . . . . 0.0 109.565 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 65.12 88.41 0.11 Allowed 'General case' 0 C--N 1.361 1.096 0 O-C-N 128.337 3.523 . . . . 0.0 110.628 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.462 ' O ' ' N ' ' A' ' 73' ' ' GLU . 0.4 OUTLIER -70.44 75.94 0.56 Allowed 'General case' 0 C--O 1.216 -0.707 0 O-C-N 127.643 3.089 . . . . 0.0 110.743 -179.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -48.36 81.02 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.462 ' N ' ' O ' ' A' ' 71' ' ' PHE . 25.4 mt-10 60.47 -176.47 0.11 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 123.249 1.5 . . . . 0.0 107.9 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 47.7 t60 92.15 97.38 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 109.825 -3.352 . . . . 0.0 116.477 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.28 166.51 24.85 Favored 'General case' 0 C--O 1.198 -1.642 0 CA-C-N 112.111 -2.313 . . . . 0.0 108.925 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 172.07 -31.12 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 O-C-N 126.134 2.146 . . . . 0.0 113.187 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.7 -33.03 48.13 Favored Glycine 0 C--O 1.208 -1.511 0 N-CA-C 107.057 -2.417 . . . . 0.0 107.057 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.407 HD13 ' CD1' ' A' ' 26' ' ' ILE . 3.3 tp -140.68 101.49 4.09 Favored 'General case' 0 N--CA 1.448 -0.527 1 CA-C-N 107.427 -4.387 . . . . 0.0 115.399 179.903 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.454 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 23.4 t0 92.06 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.776 0 O-C-N 128.954 3.909 . . . . 0.0 113.489 179.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.88 82.41 1.4 Allowed Glycine 0 N--CA 1.469 0.862 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.35 -170.4 2.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 111.476 -2.362 . . . . 0.0 109.663 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.494 ' N ' ' ND2' ' A' ' 82' ' ' ASN . 0.6 OUTLIER -135.59 87.79 2.35 Favored 'General case' 0 C--O 1.202 -1.431 0 O-C-N 127.552 3.032 . . . . 0.0 106.723 179.693 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.489 HG13 ' CG ' ' A' ' 98' ' ' GLN . 94.8 t -119.19 142.79 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.557 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -178.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.414 ' N ' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -68.45 73.83 0.24 Allowed 'General case' 0 C--O 1.218 -0.604 0 O-C-N 127.22 2.825 . . . . 0.0 108.1 179.9 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.5 m -76.92 70.61 3.36 Favored 'General case' 0 C--O 1.195 -1.793 0 CA-C-N 109.76 -3.382 . . . . 0.0 112.096 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 165.98 7.82 Favored 'General case' 0 C--O 1.214 -0.788 1 CA-C-N 107.459 -4.428 . . . . 0.0 113.659 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.408 ' CG2' ' HA ' ' A' ' 67' ' ' VAL . 0.3 OUTLIER -157.52 116.5 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.364 0 CA-C-N 112.467 -2.151 . . . . 0.0 108.625 179.772 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -150.0 173.98 13.23 Favored 'General case' 0 CA--C 1.474 -1.946 0 CA-C-N 110.574 -3.012 . . . . 0.0 111.023 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.692 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.0 m95 -96.71 151.67 19.41 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-O 114.832 -2.509 . . . . 0.0 107.982 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.482 ' CB ' HG21 ' A' ' 93' ' ' THR . 7.0 tp10 -100.67 -40.55 7.31 Favored 'General case' 0 C--O 1.199 -1.597 1 CA-C-O 131.663 5.506 . . . . 0.0 112.143 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 176.35 -48.6 0.11 Allowed Glycine 0 C--O 1.207 -1.548 0 CA-C-N 108.723 -3.853 . . . . 0.0 105.708 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -151.09 41.73 0.75 Allowed 'General case' 0 N--CA 1.444 -0.748 1 O-C-N 130.586 4.345 . . . . 0.0 110.656 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.482 HG21 ' CB ' ' A' ' 90' ' ' GLU . 0.6 OUTLIER -172.37 153.86 3.07 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 112.091 -2.322 . . . . 0.0 115.367 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.505 HD23 ' CD2' ' A' ' 50' ' ' PHE . 3.1 tp -88.9 93.96 9.77 Favored 'General case' 0 CA--C 1.481 -1.684 0 O-C-N 128.32 3.513 . . . . 0.0 118.561 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.465 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.341 53.0 t -89.61 114.75 28.03 Favored 'Isoleucine or valine' 0 C--N 1.358 0.977 0 CA-C-N 113.014 -1.903 . . . . 0.0 112.72 178.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 75.4 m -119.41 110.35 16.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 103.333 -2.84 . . . . 0.0 103.333 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.56 74.36 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.482 -1.639 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.489 ' CG ' HG13 ' A' ' 83' ' ' VAL . 0.1 OUTLIER -53.49 100.19 0.03 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.88 88.3 4.24 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-N 110.647 -2.979 . . . . 0.0 113.745 -178.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.425 ' HA2' ' CG2' ' A' ' 83' ' ' VAL . . . -62.66 -86.56 0.05 OUTLIER Glycine 0 CA--C 1.534 1.223 0 N-CA-C 106.631 -2.588 . . . . 0.0 106.631 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 177.25 -57.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 128.369 3.04 . . . . 0.0 111.312 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -37.07 18.79 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 110.653 -2.976 . . . . 0.0 115.62 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.479 ' HG3' ' CZ ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -120.35 175.97 5.71 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 110.297 -3.138 . . . . 0.0 111.988 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.486 ' HB2' ' CG2' ' A' ' 121' ' ' THR . 0.0 OUTLIER -124.69 115.83 21.39 Favored 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.637 -4.801 . . . . 0.0 102.212 179.267 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.479 ' CZ ' ' HG3' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -115.39 24.8 11.32 Favored 'General case' 0 C--O 1.209 -1.06 0 O-C-N 128.256 3.473 . . . . 0.0 108.217 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -81.65 129.29 8.95 Favored Glycine 0 N--CA 1.427 -1.953 2 O-C-N 133.492 6.745 . . . . 0.0 115.15 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.589 ' CZ2' ' CD1' ' A' ' 63' ' ' LEU 0.258 0.0 OUTLIER -115.57 136.22 53.29 Favored 'General case' 0 C--O 1.202 -1.409 0 O-C-N 129.554 3.737 . . . . 0.0 108.419 177.746 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.533 ' HD3' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -153.03 174.59 13.98 Favored 'General case' 0 C--O 1.206 -1.23 1 O-C-N 129.432 4.208 . . . . 0.0 114.484 -178.634 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.415 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -134.01 162.54 31.78 Favored 'General case' 0 C--N 1.361 1.102 0 CA-C-N 110.518 -3.037 . . . . 0.0 109.445 -179.502 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.533 ' CZ3' ' HD3' ' A' ' 108' ' ' LYS . 0.4 OUTLIER -170.0 66.47 0.05 Allowed 'General case' 0 C--N 1.31 -1.116 1 O-C-N 131.711 5.632 . . . . 0.0 115.799 -179.931 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 39.7 t -17.84 99.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.269 0 C-N-CA 128.213 2.605 . . . . 0.0 114.896 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.493 ' HB2' ' CE1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -94.08 38.54 1.08 Allowed 'General case' 0 CA--C 1.49 -1.361 0 CA-C-N 111.819 -2.446 . . . . 0.0 116.317 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.7 -100.82 1.02 Allowed Glycine 0 C--O 1.213 -1.191 0 O-C-N 126.448 2.343 . . . . 0.0 118.065 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -107.01 12.6 28.47 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.894 2.553 . . . . 0.0 117.894 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.408 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 6.6 pttt -157.08 150.03 23.68 Favored 'General case' 0 C--N 1.314 -0.936 1 O-C-N 129.437 4.211 . . . . 0.0 109.192 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.34 174.16 10.35 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 126.203 2.189 . . . . 0.0 112.776 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 112' ' ' GLU . 11.4 m-85 -146.9 89.61 1.83 Allowed 'General case' 0 C--O 1.213 -0.833 0 C-N-CA 115.129 -2.628 . . . . 0.0 112.513 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 11.2 mt -83.01 58.86 4.61 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 110.08 -3.236 . . . . 0.0 108.423 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -76.32 91.96 3.29 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 129.713 3.205 . . . . 0.0 111.531 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.73 -179.12 5.45 Favored 'General case' 0 N--CA 1.489 1.504 1 O-C-N 129.367 4.167 . . . . 0.0 110.365 179.628 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.486 ' CG2' ' HB2' ' A' ' 104' ' ' ASN . 18.3 m -129.38 159.08 37.32 Favored 'General case' 0 CA--C 1.492 -1.271 0 O-C-N 127.274 2.859 . . . . 0.0 105.792 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.55 73.27 0.37 Allowed 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 126.738 3.161 . . . . 0.0 113.268 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 63.76 33.29 86.83 Favored Glycine 0 C--O 1.217 -0.909 0 CA-C-N 110.218 -3.174 . . . . 0.0 112.151 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 79.24 51.72 0.03 OUTLIER 'General case' 0 CA--C 1.492 -1.26 0 O-C-N 128.854 3.326 . . . . 0.0 112.43 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -129.8 24.24 5.36 Favored 'General case' 0 C--O 1.217 -0.614 0 O-C-N 127.572 3.045 . . . . 0.0 106.773 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 7.7 p -10.91 79.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 CA-C-N 108.734 -3.848 . . . . 0.0 115.864 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 16.7 t -65.04 151.07 46.95 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.794 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 96.63 3.45 Favored 'General case' 0 CA--C 1.5 -0.967 0 O-C-N 125.101 1.5 . . . . 0.0 112.989 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -73.14 170.2 15.42 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 113.906 -3.118 . . . . 0.0 111.402 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 89.8 t -140.61 140.32 33.95 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.552 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.408 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 14.9 m-85 -123.2 -177.66 3.75 Favored 'General case' 0 CA--C 1.477 -1.857 0 CA-C-N 109.994 -3.275 . . . . 0.0 116.86 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.317 2.9 tptt -167.94 107.77 0.55 Allowed 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 103.218 -2.882 . . . . 0.0 103.218 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.49 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 23.0 ttpt -57.53 93.3 0.01 OUTLIER 'General case' 0 C--O 1.195 -1.796 0 O-C-N 127.094 2.746 . . . . 0.0 112.126 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.265 1.876 0 O-C-N 126.85 2.593 . . . . 0.0 114.028 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.453 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 17.3 pttp . . . . . 0 CA--C 1.503 -0.863 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -81.27 87.41 6.12 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 125.778 1.924 . . . . 0.0 107.024 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -117.84 138.71 51.91 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -125.51 77.7 1.67 Allowed 'General case' 0 C--N 1.317 -0.845 0 O-C-N 128.348 3.53 . . . . 0.0 111.6 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -125.64 -144.96 6.34 Favored Glycine 0 C--O 1.204 -1.733 0 CA-C-N 111.199 -2.728 . . . . 0.0 114.32 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.44 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -160.41 152.28 20.04 Favored 'General case' 0 N--CA 1.478 0.968 1 O-C-N 133.395 5.997 . . . . 0.0 104.898 179.974 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.527 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -150.21 122.55 8.42 Favored 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.922 2.639 . . . . 0.0 117.13 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.45 95.52 10.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 126.678 2.486 . . . . 0.0 106.096 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -33.85 -37.78 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 O-C-N 128.516 3.635 . . . . 0.0 106.236 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 78.97 -70.73 0.1 Allowed 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 125.43 2.538 . . . . 0.0 112.206 179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -134.39 169.69 16.86 Favored 'General case' 0 N--CA 1.433 -1.296 1 CA-C-N 108.175 -4.102 . . . . 0.0 107.809 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.568 ' N ' ' ND2' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -146.47 137.79 24.44 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 108.471 -3.968 . . . . 0.0 112.251 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -79.63 -74.35 0.3 Allowed 'General case' 0 CA--C 1.505 -0.775 0 O-C-N 126.181 2.176 . . . . 0.0 109.033 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -96.87 140.76 30.94 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.796 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -144.05 -52.32 0.32 Allowed 'General case' 0 CA--C 1.491 -1.291 0 CA-C-N 112.488 -2.142 . . . . 0.0 111.179 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.403 ' N ' ' CG ' ' A' ' 17' ' ' PHE . 1.8 tm-20 -70.25 -48.95 54.63 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 124.484 1.114 . . . . 0.0 111.991 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.486 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -60.26 -22.19 58.03 Favored Glycine 0 CA--C 1.492 -1.376 1 O-C-N 129.219 4.074 . . . . 0.0 111.822 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.8 -38.53 32.81 Favored 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.492 ' HG3' ' CG2' ' A' ' 26' ' ' ILE 0.318 0.4 OUTLIER -70.37 -24.79 63.02 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 110.373 -3.103 . . . . 0.0 110.227 -179.598 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.486 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.53 -33.2 42.15 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 129.175 4.047 . . . . 0.0 112.697 179.705 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.405 ' HA ' ' NE2' ' A' ' 125' ' ' GLN . . . -61.59 -37.43 83.86 Favored 'General case' 0 C--O 1.207 -1.163 2 O-C-N 132.316 6.01 . . . . 0.0 113.979 -179.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.463 ' CD1' ' HB2' ' A' ' 79' ' ' ASP 0.351 2.3 mm? -74.87 -45.14 45.04 Favored 'General case' 0 C--O 1.211 -0.954 2 CA-C-N 106.38 -4.918 . . . . 0.0 109.041 -178.241 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.27 12.1 t70 91.83 46.35 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.512 3 O-C-N 133.302 6.626 . . . . 0.0 112.809 -179.892 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.492 ' CG2' ' HG3' ' A' ' 21' ' ' MET . 0.6 OUTLIER -105.28 21.33 3.57 Favored 'Isoleucine or valine' 0 C--N 1.361 1.104 1 CA-C-N 107.525 -4.398 . . . . 0.0 111.259 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -87.38 147.27 25.53 Favored 'General case' 0 C--N 1.359 0.988 0 CA-C-N 111.704 -2.498 . . . . 0.0 110.598 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -176.3 43.21 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.672 0 O-C-N 127.189 2.806 . . . . 0.0 113.242 179.867 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 69.22 48.48 0.66 Allowed 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 126.067 2.841 . . . . 0.0 109.392 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.89 -45.78 6.49 Favored 'General case' 0 C--N 1.361 1.089 1 CA-C-N 107.231 -4.532 . . . . 0.0 114.386 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -179.6 0.29 Allowed 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 114.504 -2.665 . . . . 0.0 111.392 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.17 11.09 3.57 Favored 'General case' 0 CA--C 1.488 -1.406 1 O-C-N 130.881 5.113 . . . . 0.0 112.433 179.934 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.6 mt -147.9 -51.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.019 1 O-C-N 132.516 6.135 . . . . 0.0 111.043 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' A' ' 37' ' ' LEU . . . -77.62 1.72 18.81 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.523 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 t -51.74 -29.85 11.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 124.036 1.874 . . . . 0.0 109.971 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.453 ' HD2' ' HB3' ' A' ' 39' ' ' GLN . 0.0 OUTLIER 164.89 133.83 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 109.011 -3.722 . . . . 0.0 111.258 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.473 ' CD1' ' HB3' ' A' ' 58' ' ' PHE . 0.7 OUTLIER -157.94 96.85 1.5 Allowed 'General case' 0 C--O 1.215 -0.724 2 O-C-N 130.045 4.591 . . . . 0.0 108.081 179.152 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.1 m 62.77 52.65 2.7 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 128.677 3.736 . . . . 0.0 109.863 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.453 ' HB3' ' HD2' ' A' ' 36' ' ' ARG . 37.4 tt0 -74.3 154.38 38.95 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 113.047 -1.888 . . . . 0.0 112.104 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.424 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 82.7 m 177.59 125.3 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.209 1 O-C-N 132.754 6.284 . . . . 0.0 111.847 179.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 8.5 tmtt? -112.74 142.46 45.33 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 127.23 2.831 . . . . 0.0 107.668 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.449 ' N ' ' HD3' ' A' ' 41' ' ' LYS . 2.5 mp -131.6 159.85 42.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 127.456 2.973 . . . . 0.0 111.044 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.4 HG12 ' CE1' ' A' ' 50' ' ' PHE 0.262 0.0 OUTLIER -131.41 150.74 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.604 0 CA-C-N 110.912 -2.858 . . . . 0.0 107.968 179.98 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.423 HG13 ' N ' ' A' ' 45' ' ' GLN . 1.2 t -132.4 -54.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.029 0 C-N-CA 116.544 -2.062 . . . . 0.0 116.102 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.423 ' N ' HG13 ' A' ' 44' ' ' VAL . 0.0 OUTLIER 44.48 88.52 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 -179.754 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.71 45.9 0.98 Allowed 'General case' 0 N--CA 1.481 1.095 1 O-C-N 129.322 4.139 . . . . 0.0 114.622 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.58 93.42 0.36 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-O 117.8 -1.556 . . . . 0.0 113.61 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 75.49 -30.9 0.2 Allowed 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 117.527 2.417 . . . . 0.0 117.527 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -109.11 100.98 10.07 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.415 2.686 . . . . 0.0 108.191 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.4 ' CE1' HG12 ' A' ' 43' ' ' ILE . 25.8 t80 -99.67 102.06 13.43 Favored 'General case' 0 C--N 1.311 -1.109 1 O-C-N 130.353 4.783 . . . . 0.0 115.059 -178.769 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -115.21 67.62 0.7 Allowed 'General case' 0 CA--C 1.493 -1.215 1 O-C-N 129.623 4.327 . . . . 0.0 117.797 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.428 HG23 ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -58.52 125.88 25.22 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 127.694 3.121 . . . . 0.0 105.838 179.247 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -129.56 154.17 47.32 Favored 'General case' 0 CA--C 1.485 -1.535 0 O-C-N 128.503 3.627 . . . . 0.0 112.284 -178.081 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.56 167.46 9.84 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 126.039 2.087 . . . . 0.0 109.938 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -137.93 39.56 2.35 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.451 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 14.7 m -75.5 154.32 36.98 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 128.437 3.586 . . . . 0.0 105.245 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.6 p -85.65 -1.51 57.23 Favored 'General case' 0 N--CA 1.481 1.091 1 O-C-N 131.285 5.366 . . . . 0.0 109.125 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.473 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 2.5 p90 -118.21 -40.87 2.91 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.66 128.02 18.86 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 112.695 -2.048 . . . . 0.0 115.052 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -113.09 -161.75 0.77 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 128.677 3.735 . . . . 0.0 107.256 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 60.9 83.62 0.14 Allowed 'General case' 0 CA--C 1.504 -0.808 0 O-C-N 126.408 2.317 . . . . 0.0 110.194 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.19 -65.99 0.93 Allowed 'General case' 0 C--O 1.208 -1.114 0 O-C-N 126.749 2.53 . . . . 0.0 113.894 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.578 ' CD1' ' CZ2' ' A' ' 107' ' ' TRP . 5.2 tp -136.82 41.87 2.49 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 118.455 2.761 . . . . 0.0 118.455 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.56 98.07 0.24 Allowed 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.491 ' CD2' HG23 ' A' ' 87' ' ' VAL . 5.9 m-85 -140.63 -178.36 5.49 Favored 'General case' 0 CA--C 1.488 -1.408 1 CA-C-O 129.427 4.442 . . . . 0.0 110.01 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.401 HG23 ' CG2' ' A' ' 69' ' ' VAL . 1.6 m -150.61 121.91 7.83 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 109.648 -3.433 . . . . 0.0 104.143 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.501 HG12 ' CD1' ' A' ' 89' ' ' TRP . 5.2 t -61.25 144.1 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 O-C-N 128.134 3.396 . . . . 0.0 116.59 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.95 15.97 61.12 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-N 108.94 -3.754 . . . . 0.0 117.201 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.401 ' CG2' HG23 ' A' ' 66' ' ' THR 0.269 11.1 t -81.07 -25.43 10.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 C-N-CA 119.044 -1.062 . . . . 0.0 109.344 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 67.86 77.6 0.25 Allowed 'General case' 0 C--N 1.364 1.208 0 O-C-N 129.06 3.975 . . . . 0.0 108.909 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 73' ' ' GLU . 1.3 m-85 -60.51 99.0 0.07 Allowed 'General case' 0 C--N 1.355 0.811 0 O-C-N 127.497 2.998 . . . . 0.0 115.836 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -68.55 73.11 0.23 Allowed 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 112.358 -2.201 . . . . 0.0 111.352 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.489 ' HB3' ' CA ' ' A' ' 82' ' ' ASN . 6.7 mt-10 53.11 -156.51 0.18 Allowed 'General case' 0 CA--C 1.507 -0.683 0 CA-C-O 121.499 0.666 . . . . 0.0 112.339 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.664 ' ND1' HD22 ' A' ' 82' ' ' ASN . 18.8 m80 71.5 87.97 0.11 Allowed 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 124.763 2.221 . . . . 0.0 112.631 -179.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -125.93 122.56 36.33 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-N 110.214 -3.175 . . . . 0.0 113.04 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.24 168.96 18.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 127.657 3.098 . . . . 0.0 112.254 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.13 34.63 64.52 Favored Glycine 0 C--O 1.207 -1.536 0 CA-C-N 111.782 -2.463 . . . . 0.0 107.845 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.5 tp -167.45 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.51 -0.57 1 O-C-N 130.417 4.245 . . . . 0.0 116.501 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.463 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 7.7 t70 -155.17 -57.4 0.1 Allowed 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 116.197 -2.201 . . . . 0.0 113.055 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.63 76.86 1.31 Allowed Glycine 0 C--O 1.213 -1.169 0 O-C-N 126.104 2.127 . . . . 0.0 111.619 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -137.05 -156.91 0.73 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 111.342 -2.429 . . . . 0.0 111.168 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.664 HD22 ' ND1' ' A' ' 74' ' ' HIS . 0.5 OUTLIER -160.14 105.08 1.51 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 128.167 3.417 . . . . 0.0 108.488 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 12.8 t -144.27 135.33 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.2 0 N-CA-C 117.48 2.4 . . . . 0.0 117.48 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.479 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -49.58 145.07 5.26 Favored 'General case' 0 N--CA 1.467 0.39 1 O-C-N 129.708 4.38 . . . . 0.0 106.266 178.183 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 78.3 m -150.42 66.14 0.95 Allowed 'General case' 0 C--O 1.201 -1.459 0 O-C-N 127.537 3.023 . . . . 0.0 115.251 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -62.04 140.58 58.36 Favored 'General case' 0 N--CA 1.432 -1.373 1 CA-C-N 108.12 -4.127 . . . . 0.0 110.811 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.491 HG23 ' CD2' ' A' ' 65' ' ' PHE . 3.9 t -132.39 135.98 56.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 C-N-CA 126.1 1.76 . . . . 0.0 108.414 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.477 ' HA ' ' CG1' ' A' ' 67' ' ' VAL . 9.7 t -159.81 156.67 27.89 Favored 'General case' 0 CA--C 1.473 -1.982 0 CA-C-O 124.462 2.077 . . . . 0.0 109.28 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.691 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 38.5 m95 -90.34 145.31 25.06 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-O 114.602 -2.618 . . . . 0.0 106.761 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.478 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 7.0 tp10 -97.38 -8.53 29.32 Favored 'General case' 0 CA--C 1.489 -1.367 1 CA-C-O 129.462 4.458 . . . . 0.0 112.055 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.95 -19.17 11.22 Favored Glycine 0 C--O 1.2 -2.023 0 CA-C-N 108.731 -3.85 . . . . 0.0 106.097 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -158.96 44.88 0.27 Allowed 'General case' 0 N--CA 1.431 -1.391 1 O-C-N 131.826 5.074 . . . . 0.0 111.766 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.459 ' C ' ' CZ3' ' A' ' 89' ' ' TRP . 15.1 t 164.1 144.88 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.916 2.561 . . . . 0.0 117.916 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.465 ' CD2' HD23 ' A' ' 63' ' ' LEU . 1.2 tp -87.55 83.17 7.28 Favored 'General case' 0 CA--C 1.504 -0.798 0 O-C-N 127.397 2.936 . . . . 0.0 114.907 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.478 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.355 73.8 t -81.03 127.63 39.38 Favored 'Isoleucine or valine' 0 C--N 1.351 0.672 1 O-C-N 129.285 4.116 . . . . 0.0 111.394 179.663 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.42 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -139.23 141.39 37.87 Favored 'General case' 0 C--O 1.196 -1.749 0 N-CA-C 103.953 -2.61 . . . . 0.0 103.953 -179.019 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.2 t -121.87 91.13 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.736 0 N-CA-C 119.719 3.229 . . . . 0.0 119.719 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.459 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 17.4 mm-40 -65.97 97.84 0.39 Allowed 'General case' 0 C--N 1.361 1.072 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.479 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 1.1 tmtm? -39.29 -49.24 1.93 Allowed 'General case' 0 N--CA 1.48 1.075 0 O-C-N 128.507 3.629 . . . . 0.0 112.417 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.4 133.97 4.1 Favored Glycine 0 C--O 1.206 -1.652 1 CA-C-O 128.076 4.153 . . . . 0.0 113.879 179.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.46 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -100.78 -46.36 5.17 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 108.955 -3.622 . . . . 0.0 107.607 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.46 ' CG ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -146.24 16.44 1.34 Allowed 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 127.798 2.439 . . . . 0.0 115.965 179.773 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.65 -178.73 7.54 Favored 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 125.859 1.664 . . . . 0.0 114.349 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -125.39 88.22 2.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 127.699 3.124 . . . . 0.0 102.827 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.459 ' HB2' ' CG ' ' A' ' 98' ' ' GLN . 57.9 mmt-85 -92.92 2.79 56.6 Favored 'General case' 0 C--O 1.212 -0.894 0 O-C-N 126.9 2.625 . . . . 0.0 113.427 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -37.98 99.44 0.01 OUTLIER Glycine 0 C--O 1.209 -1.41 2 O-C-N 131.974 5.796 . . . . 0.0 113.093 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.578 ' CZ2' ' CD1' ' A' ' 63' ' ' LEU 0.299 0.0 OUTLIER -108.63 126.8 53.36 Favored 'General case' 0 C--O 1.209 -1.032 0 O-C-N 128.954 3.385 . . . . 0.0 110.025 179.546 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -153.52 155.08 35.54 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 128.299 3.904 . . . . 0.0 113.809 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.469 ' CG ' ' CD2' ' A' ' 118' ' ' LEU . 0.8 OUTLIER -114.93 -179.42 3.62 Favored 'General case' 0 C--N 1.366 1.283 1 CA-C-N 108.006 -4.179 . . . . 0.0 109.562 -179.186 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.455 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.6 OUTLIER 174.55 77.86 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.509 1 O-C-N 132.017 5.823 . . . . 0.0 117.743 179.113 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 63.6 t -27.55 101.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.817 1 CA-C-O 128.61 4.053 . . . . 0.0 117.435 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -111.06 -179.79 3.83 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 112.257 -2.247 . . . . 0.0 111.852 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -25.8 73.94 0.0 OUTLIER Glycine 0 C--O 1.204 -1.742 0 C-N-CA 127.284 2.373 . . . . 0.0 116.633 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 43.25 68.45 0.51 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 127.674 2.39 . . . . 0.0 116.823 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.475 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 9.3 pttt 160.33 164.83 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.161 1 O-C-N 133.128 6.517 . . . . 0.0 108.33 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.14 151.55 23.89 Favored 'General case' 0 CA--C 1.478 -1.789 0 O-C-N 127.088 2.743 . . . . 0.0 113.544 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -113.14 98.34 7.08 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 113.425 -1.716 . . . . 0.0 115.609 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.469 ' CD2' ' CG ' ' A' ' 109' ' ' GLN . 8.3 mt -85.98 77.61 9.63 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 128.178 3.424 . . . . 0.0 107.593 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.455 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.4 mt-10 -88.81 95.24 10.21 Favored 'General case' 0 CA--C 1.494 -1.19 0 O-C-N 126.666 2.479 . . . . 0.0 111.434 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.404 ' CB ' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -110.79 166.11 11.29 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 127.307 2.879 . . . . 0.0 108.466 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 20.2 m -122.18 156.35 33.89 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 110.498 -3.046 . . . . 0.0 105.259 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.426 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.8 OUTLIER -162.35 59.9 0.23 Allowed 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 125.283 2.468 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.44 32.93 14.82 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 113.426 -1.715 . . . . 0.0 113.478 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 73.11 28.03 1.94 Allowed 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 111.576 -2.312 . . . . 0.0 111.485 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.405 ' NE2' ' HA ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -87.15 -28.06 22.68 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 110.896 -2.866 . . . . 0.0 108.165 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.404 ' CG1' ' C ' ' A' ' 125' ' ' GLN . 0.3 OUTLIER 45.81 119.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 1 O-C-N 131.38 5.425 . . . . 0.0 113.477 -179.766 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.1 t -112.19 120.51 42.04 Favored 'General case' 0 CA--C 1.5 -0.954 0 O-C-N 117.991 -2.943 . . . . 0.0 111.452 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 99.0 8.09 Favored 'General case' 0 CA--C 1.51 -0.578 0 O-C-N 127.105 2.753 . . . . 0.0 112.038 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -79.68 172.2 14.1 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 12.2 t -140.42 148.66 22.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 103.788 -2.671 . . . . 0.0 103.788 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.475 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 18.8 m-85 -138.24 -177.18 4.72 Favored 'General case' 0 CA--C 1.485 -1.534 0 CA-C-O 127.454 3.502 . . . . 0.0 116.797 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.277 9.2 tppt? -162.7 105.18 1.07 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 110.975 -2.83 . . . . 0.0 103.418 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.527 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 6.2 ttpt -68.59 78.39 0.28 Allowed 'General case' 0 C--O 1.201 -1.455 0 CA-C-N 111.969 -2.378 . . . . 0.0 113.496 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt . . . . . 0 CA--C 1.481 -1.677 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -179.939 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.523 ' HG2' ' CZ2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.583 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -71.2 -169.74 0.41 Allowed 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.399 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -164.95 148.54 8.65 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 104.451 -2.425 . . . . 0.0 104.451 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -46.16 158.3 0.1 Allowed 'General case' 0 C--N 1.313 -0.982 1 O-C-N 132.83 6.331 . . . . 0.0 116.566 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.77 -167.53 33.68 Favored Glycine 0 C--O 1.203 -1.828 0 O-C-N 127.332 2.895 . . . . 0.0 112.314 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.433 HG21 ' N ' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -144.01 147.01 33.29 Favored 'General case' 0 C--N 1.316 -0.852 1 O-C-N 132.64 5.553 . . . . 0.0 107.801 -179.946 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.534 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -140.56 130.1 24.08 Favored 'General case' 0 C--N 1.323 -0.548 1 O-C-N 133.282 6.614 . . . . 0.0 111.137 -179.644 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -86.47 -6.25 58.96 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 126.753 2.533 . . . . 0.0 115.332 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.527 ' HG3' ' CE1' ' A' ' 131' ' ' PHE . 19.8 ttm 54.88 85.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.678 0 O-C-N 125.073 1.483 . . . . 0.0 107.257 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 132' ' ' LYS . 34.3 tt0 -25.43 -38.01 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 131.034 3.734 . . . . 0.0 110.741 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 173.47 169.17 0.17 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 126.753 3.168 . . . . 0.0 111.513 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -104.88 160.86 14.67 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 108.653 -3.885 . . . . 0.0 114.757 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -122.97 -64.41 1.18 Allowed 'General case' 0 CA--C 1.494 -1.183 1 O-C-N 130.275 4.734 . . . . 0.0 113.978 179.79 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -127.22 85.9 2.43 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.681 -1.145 . . . . 0.0 113.872 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -43.44 7.62 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.687 3.117 . . . . 0.0 112.378 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.262 32.9 tt0 -79.6 -35.34 39.73 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 111.096 -2.775 . . . . 0.0 114.282 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -76.91 -22.73 71.05 Favored Glycine 0 N--CA 1.478 1.481 0 C-N-CA 115.301 -3.333 . . . . 0.0 110.917 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.501 ' CE1' HD12 ' A' ' 120' ' ' LEU . 8.9 t80 -62.4 -33.38 74.65 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 124.608 2.147 . . . . 0.0 108.522 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.51 ' HB3' ' CG2' ' A' ' 26' ' ' ILE 0.282 51.4 mtp -75.64 -26.05 57.4 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-N 112.876 -1.965 . . . . 0.0 108.63 -179.752 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -80.02 -29.05 39.31 Favored 'General case' 0 C--N 1.312 -1.057 0 O-C-N 125.511 1.757 . . . . 0.0 112.841 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.61 -46.23 84.35 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 111.061 -2.79 . . . . 0.0 113.925 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.407 HD13 ' C ' ' A' ' 25' ' ' ASP . 4.0 pp -83.82 -27.12 28.99 Favored 'General case' 0 N--CA 1.48 1.043 1 O-C-N 130.029 4.581 . . . . 0.0 103.005 179.11 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.407 ' C ' HD13 ' A' ' 24' ' ' LEU . 0.3 OUTLIER 80.99 93.4 0.05 OUTLIER 'General case' 0 CA--C 1.483 -1.633 1 CA-C-O 129.486 4.469 . . . . 0.0 114.312 179.252 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.51 ' CG2' ' HB3' ' A' ' 21' ' ' MET . 1.0 OUTLIER -134.23 20.78 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-O 127.415 3.483 . . . . 0.0 107.669 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.54 99.45 0.03 OUTLIER 'General case' 0 C--N 1.366 1.309 0 CA-C-N 112.27 -2.241 . . . . 0.0 113.516 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -132.98 16.01 4.22 Favored 'General case' 0 CA--C 1.488 -1.423 0 O-C-N 128.81 3.819 . . . . 0.0 112.144 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 48.6 38.65 11.69 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-O 126.321 2.962 . . . . 0.0 109.987 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.19 -11.17 33.38 Favored 'General case' 0 C--N 1.349 0.556 1 CA-C-N 108.326 -4.034 . . . . 0.0 112.092 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -102.31 -172.37 2.12 Favored 'General case' 0 C--O 1.222 -0.373 1 O-C-N 130.791 5.057 . . . . 0.0 110.872 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 91.6 -9.27 0.24 Allowed 'General case' 0 C--O 1.202 -1.428 1 O-C-N 131.312 5.383 . . . . 0.0 112.99 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -125.79 4.16 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 O-C-N 128.238 3.461 . . . . 0.0 111.682 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -120.8 31.75 6.28 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 123.182 1.468 . . . . 0.0 108.488 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -41.19 -42.24 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.303 0 CA-C-N 110.739 -2.937 . . . . 0.0 111.242 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.463 ' HG3' ' CB ' ' A' ' 39' ' ' GLN . 7.0 tmm_? 150.26 125.02 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.149 2 CA-C-N 107.472 -4.422 . . . . 0.0 113.07 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.548 HD12 ' CZ ' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -145.14 110.69 5.34 Favored 'General case' 0 N--CA 1.435 -1.178 1 O-C-N 129.428 4.205 . . . . 0.0 107.343 -179.961 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.438 ' HB ' ' HA ' ' A' ' 56' ' ' SER . 1.7 m 75.94 25.43 1.11 Allowed 'General case' 0 CA--C 1.502 -0.9 1 O-C-N 132.991 6.432 . . . . 0.0 112.653 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.463 ' CB ' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -70.12 110.67 5.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.026 2.704 . . . . 0.0 116.23 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.4 m -137.58 101.67 4.55 Favored 'General case' 0 C--O 1.206 -1.189 1 O-C-N 129.178 4.049 . . . . 0.0 113.203 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.417 ' N ' ' O ' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -77.72 139.75 39.44 Favored 'General case' 0 C--O 1.222 -0.372 0 O-C-N 126.671 2.482 . . . . 0.0 108.795 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.43 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 2.3 mp -125.15 161.45 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 126.509 2.38 . . . . 0.0 109.698 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.522 HD12 ' CE2' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -137.12 126.14 35.76 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.528 0 O-C-N 127.504 3.003 . . . . 0.0 110.439 -179.813 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.8 t -129.48 86.67 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 112.443 -2.162 . . . . 0.0 111.128 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.61 140.41 32.07 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 127.107 2.754 . . . . 0.0 112.199 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -151.7 31.95 0.57 Allowed 'General case' 0 CA--C 1.488 -1.408 1 CA-C-N 107.435 -4.438 . . . . 0.0 117.41 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.92 -70.07 1.35 Allowed Glycine 0 C--O 1.205 -1.682 0 O-C-N 119.941 -1.724 . . . . 0.0 111.29 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.61 98.28 3.65 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 129.159 3.505 . . . . 0.0 110.695 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.405 ' ND2' ' HE2' ' A' ' 51' ' ' LYS . 42.1 t30 116.66 79.68 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.604 1 O-C-N 129.577 4.298 . . . . 0.0 108.463 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.522 ' CE2' HD12 ' A' ' 43' ' ' ILE . 7.6 t80 -90.5 125.96 35.76 Favored 'General case' 0 C--N 1.313 -1.004 1 O-C-N 131.974 5.797 . . . . 0.0 110.08 179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.405 ' HE2' ' ND2' ' A' ' 49' ' ' ASN . 2.8 mttt -137.05 80.08 1.79 Allowed 'General case' 0 CA--C 1.492 -1.259 0 O-C-N 128.267 3.479 . . . . 0.0 119.027 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.425 HG21 ' HB2' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -60.3 157.64 13.23 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 128.397 3.561 . . . . 0.0 107.053 179.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -167.64 141.56 3.54 Favored 'General case' 0 CA--C 1.487 -1.454 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.571 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.423 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 0.6 OUTLIER -93.53 161.32 14.41 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.617 1.198 . . . . 0.0 111.258 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -128.59 28.72 5.38 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 116.219 1.933 . . . . 0.0 116.219 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.438 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 91.0 p -64.3 145.83 55.39 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 128.65 3.719 . . . . 0.0 105.102 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.8 m -64.82 -27.35 68.82 Favored 'General case' 0 N--CA 1.469 0.496 1 O-C-N 132.101 5.876 . . . . 0.0 107.46 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.548 ' CZ ' HD12 ' A' ' 37' ' ' LEU . 4.3 m-30 -82.21 -79.02 0.19 Allowed 'General case' 0 C--O 1.239 0.543 0 O-C-N 128.799 3.812 . . . . 0.0 117.615 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -115.8 88.58 2.91 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 127.603 3.064 . . . . 0.0 115.269 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.423 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 14.0 p30 -92.47 63.3 4.1 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.221 4.076 . . . . 0.0 110.636 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -88.57 111.79 22.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 111.772 -2.467 . . . . 0.0 109.394 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -77.64 161.87 27.47 Favored 'General case' 0 C--O 1.204 -1.294 0 O-C-N 127.437 2.961 . . . . 0.0 115.717 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.425 ' HB2' HG21 ' A' ' 52' ' ' THR . 12.4 tp -106.8 45.41 0.98 Allowed 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 112.697 -2.047 . . . . 0.0 111.554 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -71.59 95.0 1.37 Allowed 'General case' 0 C--O 1.203 -1.382 1 O-C-N 129.285 4.116 . . . . 0.0 110.704 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.526 ' CE1' HD23 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -159.57 132.29 6.74 Favored 'General case' 0 CA--C 1.483 -1.606 1 CA-C-O 131.111 5.243 . . . . 0.0 112.912 179.93 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.457 ' CG2' ' N ' ' A' ' 67' ' ' VAL . 0.4 OUTLIER -85.83 172.04 11.07 Favored 'General case' 0 C--O 1.21 -1.012 0 O-C-N 116.835 -3.666 . . . . 0.0 110.32 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.516 ' CG2' ' CD1' ' A' ' 89' ' ' TRP . 10.3 t -82.12 136.02 23.8 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.909 0 O-C-N 127.86 3.225 . . . . 0.0 112.916 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.56 5.85 19.48 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.687 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 8.2 p -60.87 -20.93 22.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.192 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 58.14 72.58 0.51 Allowed 'General case' 0 C--N 1.353 0.718 1 O-C-N 130.344 4.777 . . . . 0.0 109.047 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.428 ' CB ' HG23 ' A' ' 85' ' ' THR . 0.4 OUTLIER -66.88 141.42 57.66 Favored 'General case' 0 CA--C 1.493 -1.24 2 CA-C-N 106.648 -4.796 . . . . 0.0 118.254 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -120.91 63.47 0.87 Allowed 'General case' 0 CA--C 1.485 -1.533 0 CA-C-O 124.21 1.957 . . . . 0.0 113.541 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -55.18 143.13 28.57 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-O 125.081 2.372 . . . . 0.0 108.514 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -111.32 18.69 19.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 112.972 -1.922 . . . . 0.0 115.789 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 16.73 98.77 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.06 0 O-C-N 127.095 2.747 . . . . 0.0 115.956 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.84 146.07 27.79 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 128.116 3.385 . . . . 0.0 115.479 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.16 -32.1 7.98 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-N 110.04 -3.255 . . . . 0.0 110.666 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.2 tp -117.86 -4.23 11.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 129.617 3.775 . . . . 0.0 116.655 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -159.75 -72.43 0.08 Allowed 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 118.296 -1.361 . . . . 0.0 114.361 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.21 84.88 1.79 Allowed Glycine 0 N--CA 1.466 0.688 0 CA-C-O 122.188 0.882 . . . . 0.0 111.273 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.446 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.0 OUTLIER -148.87 -127.32 0.05 Allowed 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.861 -2.17 . . . . 0.0 114.716 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.446 ' ND2' ' O ' ' A' ' 81' ' ' ARG . 3.3 p30 164.43 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 124.533 1.145 . . . . 0.0 110.069 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -146.59 165.92 7.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.798 0 N-CA-C 117.443 2.386 . . . . 0.0 117.443 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.471 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -74.82 167.7 21.33 Favored 'General case' 0 C--O 1.241 0.628 2 O-C-N 132.58 6.175 . . . . 0.0 107.715 179.458 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.428 HG23 ' CB ' ' A' ' 71' ' ' PHE . 1.2 m -173.4 86.69 0.06 Allowed 'General case' 0 C--O 1.194 -1.828 1 O-C-N 130.197 4.685 . . . . 0.0 111.1 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 110.18 21.56 Favored 'General case' 0 N--CA 1.43 -1.444 1 CA-C-N 106.862 -4.699 . . . . 0.0 116.874 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.508 HG23 ' CD2' ' A' ' 65' ' ' PHE . 17.6 t -80.77 150.59 4.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 CA-C-N 111.859 -2.428 . . . . 0.0 108.667 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.287 22.3 m -160.14 145.77 15.28 Favored 'General case' 0 CA--C 1.474 -1.962 0 CA-C-N 112.608 -2.087 . . . . 0.0 109.964 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.689 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 8.9 m95 -85.69 129.09 34.91 Favored 'General case' 0 C--N 1.357 0.899 0 CA-C-O 113.696 -3.05 . . . . 0.0 105.461 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.497 ' CB ' ' CG2' ' A' ' 93' ' ' THR . 0.5 OUTLIER -99.33 -9.53 23.43 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 127.224 3.392 . . . . 0.0 116.243 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 147.34 -78.2 0.24 Allowed Glycine 0 C--O 1.194 -2.363 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -134.75 100.5 4.63 Favored 'General case' 0 C--O 1.195 -1.788 1 O-C-N 131.502 4.884 . . . . 0.0 103.265 179.591 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.497 ' CG2' ' CB ' ' A' ' 90' ' ' GLU . 4.5 t 166.42 -131.87 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 127.478 2.986 . . . . 0.0 113.132 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.526 HD23 ' CE1' ' A' ' 65' ' ' PHE 0.292 1.2 tp 166.19 70.03 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 129.697 3.199 . . . . 0.0 113.925 179.465 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.424 HG22 ' CG ' ' A' ' 90' ' ' GLU 0.36 45.5 t -74.66 132.72 32.9 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 N-CA-C 118.586 2.81 . . . . 0.0 118.586 179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -137.72 129.67 28.78 Favored 'General case' 0 C--O 1.199 -1.56 0 N-CA-C 103.05 -2.944 . . . . 0.0 103.05 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.2 t -104.37 99.62 8.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 C-N-CA 127.254 2.222 . . . . 0.0 116.527 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.84 93.14 5.58 Favored 'General case' 0 C--N 1.36 1.022 0 CA-C-O 125.398 2.523 . . . . 0.0 110.682 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.471 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -75.55 87.35 2.66 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 111.89 -2.413 . . . . 0.0 111.089 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -118.66 165.65 12.94 Favored Glycine 0 C--O 1.209 -1.432 1 CA-C-O 128.566 4.425 . . . . 0.0 113.823 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -129.89 109.48 10.94 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 109.98 -3.11 . . . . 0.0 110.798 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? 125.89 -36.25 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.291 0 O-C-N 127.708 3.13 . . . . 0.0 110.881 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.18 156.24 43.28 Favored 'General case' 0 C--O 1.199 -1.587 1 CA-C-N 107.83 -4.259 . . . . 0.0 113.393 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -115.29 118.53 33.53 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 109.868 -3.333 . . . . 0.0 103.537 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 122' ' ' CYS . 6.5 mmt85 -110.91 11.84 22.27 Favored 'General case' 0 C--O 1.213 -0.835 1 O-C-N 129.746 4.404 . . . . 0.0 109.523 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -51.81 92.85 0.01 OUTLIER Glycine 0 N--CA 1.429 -1.789 2 CA-C-N 106.814 -4.721 . . . . 0.0 111.929 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.44 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.262 0.0 OUTLIER -107.43 143.14 36.19 Favored 'General case' 0 C--O 1.206 -1.214 1 O-C-N 130.786 4.463 . . . . 0.0 109.904 179.662 . . . . . . . . 5 4 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.537 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 2.3 ptpt -158.14 172.22 18.8 Favored 'General case' 0 CA--C 1.507 -0.705 1 O-C-N 132.095 5.872 . . . . 0.0 114.43 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.494 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -122.44 176.69 5.75 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 113.86 -2.971 . . . . 0.0 105.0 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.537 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 20.0 m95 -133.28 -55.64 0.91 Allowed 'General case' 0 C--N 1.311 -1.075 0 O-C-N 125.988 2.055 . . . . 0.0 112.001 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.8 t 87.37 57.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.777 1 CA-C-O 130.222 4.82 . . . . 0.0 110.134 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.95 67.55 1.27 Allowed 'General case' 0 CA--C 1.478 -1.812 1 CA-C-N 107.006 -4.634 . . . . 0.0 117.757 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 87.83 -88.39 1.56 Allowed Glycine 0 C--O 1.202 -1.887 0 N-CA-C 117.527 1.771 . . . . 0.0 117.527 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.437 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 74.5 m-20 -100.94 -23.9 14.45 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 118.962 2.949 . . . . 0.0 118.962 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.437 ' HE2' ' HB2' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -130.72 -168.45 1.99 Allowed 'General case' 0 CA--C 1.499 -0.981 1 O-C-N 130.205 4.691 . . . . 0.0 110.199 179.987 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.439 HD21 ' CZ3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -146.31 94.66 2.49 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 128.123 3.821 . . . . 0.0 111.156 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.14 124.47 20.07 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 109.145 -3.662 . . . . 0.0 110.47 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 2.6 mt -95.2 72.2 3.32 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 127.539 3.024 . . . . 0.0 108.882 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -71.39 91.89 1.04 Allowed 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 128.964 3.915 . . . . 0.0 110.909 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.501 HD12 ' CE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -102.87 160.4 14.64 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 114.26 -1.336 . . . . 0.0 107.55 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.7 m -124.17 168.73 12.53 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.365 1.666 . . . . 0.0 110.799 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.444 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 10.3 t -167.8 50.8 0.06 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 126.347 2.975 . . . . 0.0 110.38 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 103.29 6.91 44.22 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 112.244 -2.253 . . . . 0.0 112.284 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.9 t0 100.57 28.45 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.058 0 O-C-N 128.523 3.131 . . . . 0.0 112.299 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -85.36 -17.27 37.23 Favored 'General case' 0 C--O 1.206 -1.188 0 C-N-CA 114.207 -2.997 . . . . 0.0 105.468 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 33.3 85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 O-C-N 129.051 3.969 . . . . 0.0 113.284 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 77.0 m -59.44 152.48 21.46 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.18 70.95 1.46 Allowed 'General case' 0 CA--C 1.486 -1.501 0 CA-C-O 124.374 2.035 . . . . 0.0 112.604 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -57.49 170.51 0.53 Allowed 'General case' 0 C--N 1.358 0.936 0 C-N-CA 116.611 -2.035 . . . . 0.0 111.695 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 11.5 t -141.62 105.03 1.4 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.295 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.527 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 12.0 m-85 -99.28 162.37 13.09 Favored 'General case' 0 CA--C 1.494 -1.204 1 CA-C-N 108.111 -4.131 . . . . 0.0 117.628 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.418 ' HB2' ' HB2' ' A' ' 12' ' ' GLU 0.384 0.0 OUTLIER -147.82 129.44 15.04 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 110.579 -3.01 . . . . 0.0 104.471 179.989 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.534 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 17.0 tttm -68.53 122.62 18.85 Favored 'General case' 0 C--O 1.198 -1.606 0 O-C-N 127.406 2.941 . . . . 0.0 110.997 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.245 0.861 0 CA-C-O 115.932 -1.985 . . . . 0.0 115.028 -179.906 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.491 -1.3 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.48 136.63 53.51 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.5 -2.778 . . . . 0.0 103.5 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.588 ' N ' HE21 ' A' ' 5' ' ' GLN . 0.0 OUTLIER -178.83 154.14 0.7 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 114.875 -2.488 . . . . 0.0 105.262 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 24.29 108.67 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.712 1 O-C-N 133.398 6.686 . . . . 0.0 116.934 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.437 ' N ' HG23 ' A' ' 43' ' ' ILE . . . -177.22 147.86 8.52 Favored Glycine 0 C--O 1.211 -1.296 0 CA-C-N 113.411 -1.722 . . . . 0.0 113.333 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 62.7 p -124.7 63.39 1.12 Allowed 'General case' 0 C--O 1.201 -1.451 0 O-C-N 127.228 2.369 . . . . 0.0 105.813 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.601 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -62.77 128.1 34.34 Favored 'General case' 0 N--CA 1.451 -0.421 1 O-C-N 130.838 5.086 . . . . 0.0 111.282 -179.672 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -77.41 -12.06 59.91 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.458 ' HE1' ' CZ ' ' A' ' 131' ' ' PHE . 37.6 ttm 54.53 74.97 0.32 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 105.439 -2.059 . . . . 0.0 105.439 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -47.77 -51.9 20.67 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 127.01 2.694 . . . . 0.0 109.883 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.96 154.54 42.03 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 111.511 -2.586 . . . . 0.0 111.356 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.428 ' ND2' ' O ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -134.58 141.12 46.55 Favored 'General case' 0 CA--C 1.483 -1.63 0 O-C-N 128.49 3.619 . . . . 0.0 111.403 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.428 ' O ' ' ND2' ' A' ' 14' ' ' ASN . 3.0 mt-10 -77.21 -169.81 1.5 Allowed 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 112.661 -2.063 . . . . 0.0 114.085 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -30.1 100.42 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.386 0 C-N-CA 127.108 2.163 . . . . 0.0 114.326 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -96.91 -24.8 15.68 Favored 'General case' 0 C--O 1.204 -1.299 0 O-C-N 125.791 1.932 . . . . 0.0 109.547 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -76.67 -37.6 55.93 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 113.45 -1.704 . . . . 0.0 112.762 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.7 -24.62 60.03 Favored Glycine 0 N--CA 1.487 2.048 0 C-N-CA 115.951 -3.023 . . . . 0.0 106.547 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -68.58 -27.77 66.35 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-O 127.236 3.398 . . . . 0.0 108.488 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.497 ' CG ' ' CG2' ' A' ' 26' ' ' ILE . 3.5 ttt -70.22 -33.57 71.83 Favored 'General case' 0 CA--C 1.488 -1.442 0 CA-C-N 112.704 -2.044 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.9 mtmt -77.0 -21.76 54.16 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 109.177 -3.647 . . . . 0.0 115.987 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.01 -46.49 74.34 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 127.637 3.085 . . . . 0.0 113.456 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.77 -9.91 27.86 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 128.593 3.683 . . . . 0.0 108.176 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t0 38.75 93.78 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.436 1 CA-C-O 129.296 4.379 . . . . 0.0 112.078 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.497 ' CG2' ' CG ' ' A' ' 21' ' ' MET . 14.0 tt -105.3 39.38 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 108.684 -3.871 . . . . 0.0 108.525 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.4 t70 81.83 144.77 0.08 Allowed 'General case' 0 C--N 1.352 0.676 0 CA-C-O 116.485 -1.722 . . . . 0.0 108.658 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -96.71 155.57 16.72 Favored 'General case' 0 C--O 1.204 -1.301 1 O-C-N 129.389 4.181 . . . . 0.0 115.746 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.3 77.84 0.29 Allowed 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 111.951 -2.386 . . . . 0.0 105.268 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.6 m -137.62 -61.07 0.64 Allowed 'General case' 0 C--N 1.354 0.791 2 CA-C-N 105.502 -5.317 . . . . 0.0 116.135 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -69.98 -155.05 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.986 0 O-C-N 128.419 3.574 . . . . 0.0 114.423 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.401 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.1 OUTLIER 89.33 -2.77 0.38 Allowed 'General case' 0 C--O 1.204 -1.34 1 O-C-N 130.502 4.876 . . . . 0.0 111.293 -179.722 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -149.92 35.92 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.671 0 CA-C-N 110.436 -3.075 . . . . 0.0 109.033 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.54 ' HB3' ' CE2' ' A' ' 58' ' ' PHE . . . -141.6 35.32 1.63 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 126.025 2.822 . . . . 0.0 108.573 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -53.71 -34.27 24.31 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.457 0 CA-C-N 110.564 -3.017 . . . . 0.0 110.327 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.423 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 16.1 ttp85 158.0 131.52 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.35 1 CA-C-N 107.488 -4.414 . . . . 0.0 111.584 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.632 ' CD2' ' CE2' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -130.44 83.9 2.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.543 -3.026 . . . . 0.0 105.65 -179.253 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 m 70.14 -21.07 0.18 Allowed 'General case' 0 C--N 1.317 -0.814 1 O-C-N 134.123 7.139 . . . . 0.0 117.436 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -13.74 92.18 0.01 OUTLIER 'General case' 0 CA--C 1.492 -1.251 0 O-C-N 127.773 3.171 . . . . 0.0 118.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -99.58 101.81 13.13 Favored 'General case' 0 C--O 1.203 -1.375 1 O-C-N 133.443 6.714 . . . . 0.0 109.182 179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.57 131.64 35.28 Favored 'General case' 0 N--CA 1.485 1.291 1 O-C-N 129.152 4.033 . . . . 0.0 109.6 -179.353 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.441 ' HB ' ' HE2' ' A' ' 53' ' ' LYS . 8.1 mt -117.82 158.67 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 127.19 2.806 . . . . 0.0 109.814 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.437 HG23 ' N ' ' A' ' 7' ' ' GLY 0.28 0.0 OUTLIER -140.17 146.95 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.444 1 O-C-N 129.123 4.014 . . . . 0.0 109.117 -179.752 . . . . . . . . 5 4 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.454 ' N ' ' O ' ' A' ' 51' ' ' LYS . 79.6 t -153.14 85.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.1 0 CA-C-N 113.204 -1.816 . . . . 0.0 108.299 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.411 ' HB3' ' HA ' ' A' ' 5' ' ' GLN . 0.3 OUTLIER -103.18 117.37 34.38 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 126.605 2.441 . . . . 0.0 113.367 -179.282 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -151.48 106.69 3.31 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 111.249 -2.705 . . . . 0.0 116.848 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 33.97 100.79 0.01 OUTLIER Glycine 0 C--O 1.22 -0.768 0 O-C-N 126.951 2.657 . . . . 0.0 117.913 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.7 t0 78.94 -59.04 0.41 Allowed 'General case' 0 N--CA 1.441 -0.888 0 O-C-N 125.951 1.618 . . . . 0.0 115.087 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.08 116.83 29.27 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 125.067 1.347 . . . . 0.0 112.818 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.49 ' CD1' ' C ' ' A' ' 50' ' ' PHE . 8.4 t80 -121.16 119.9 33.69 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 127.271 2.857 . . . . 0.0 117.096 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.472 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -134.32 152.61 51.91 Favored 'General case' 0 C--O 1.193 -1.914 0 O-C-N 128.412 3.57 . . . . 0.0 112.169 179.561 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.451 ' CG2' ' N ' ' A' ' 53' ' ' LYS . 0.3 OUTLIER -133.33 174.09 10.77 Favored 'General case' 0 CA--C 1.508 -0.635 2 O-C-N 129.914 4.509 . . . . 0.0 106.816 179.645 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.451 ' N ' ' CG2' ' A' ' 52' ' ' THR . 0.1 OUTLIER -177.22 142.61 0.36 Allowed 'General case' 0 CA--C 1.482 -1.636 0 O-C-N 128.442 3.589 . . . . 0.0 109.893 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.5 t -92.03 158.97 15.94 Favored 'General case' 0 CA--C 1.51 -0.565 0 O-C-N 127.917 3.26 . . . . 0.0 111.738 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -131.18 33.53 4.12 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 113.834 -1.53 . . . . 0.0 114.521 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.4 t -72.97 159.41 33.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 126.476 2.36 . . . . 0.0 108.2 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.5 m -70.8 -36.09 72.82 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 110.617 -2.992 . . . . 0.0 105.409 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.632 ' CE2' ' CD2' ' A' ' 37' ' ' LEU . 5.4 m-85 -66.8 -62.42 1.45 Allowed 'General case' 0 C--N 1.361 1.082 0 CA-C-N 112.698 -2.046 . . . . 0.0 111.321 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -139.37 174.99 9.95 Favored 'General case' 0 C--N 1.361 1.099 2 CA-C-N 107.049 -4.614 . . . . 0.0 114.625 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -146.11 39.88 1.12 Allowed 'General case' 0 C--O 1.203 -1.381 2 O-C-N 130.596 4.935 . . . . 0.0 111.03 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -64.02 176.95 0.86 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 126.664 2.477 . . . . 0.0 109.089 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -146.19 146.22 30.73 Favored 'General case' 0 C--O 1.199 -1.597 0 O-C-N 128.207 3.442 . . . . 0.0 116.769 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.516 HD13 ' CE1' ' A' ' 65' ' ' PHE . 14.0 tp -92.24 47.44 1.33 Allowed 'General case' 0 C--N 1.361 1.073 0 CA-C-N 111.644 -2.526 . . . . 0.0 111.283 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 -60.92 93.37 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.516 ' CE1' HD13 ' A' ' 63' ' ' LEU . 1.6 m-30 -121.12 -178.09 3.67 Favored 'General case' 0 CA--C 1.491 -1.291 0 CA-C-O 126.962 3.268 . . . . 0.0 110.647 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -164.32 148.83 9.8 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 109.995 -3.275 . . . . 0.0 104.446 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.0 p -68.81 133.16 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.202 0 O-C-N 127.276 2.86 . . . . 0.0 113.698 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.32 40.13 84.29 Favored Glycine 0 N--CA 1.483 1.8 0 CA-C-N 109.984 -3.28 . . . . 0.0 115.789 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.419 HG11 ' N ' ' A' ' 70' ' ' GLU . 0.7 OUTLIER -85.71 -14.97 10.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 C-N-CA 117.761 -1.575 . . . . 0.0 108.873 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.419 ' N ' HG11 ' A' ' 69' ' ' VAL . 15.1 tt0 53.66 64.96 1.65 Allowed 'General case' 0 C--O 1.217 -0.612 1 O-C-N 131.981 5.8 . . . . 0.0 108.463 -179.486 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -54.81 137.86 43.89 Favored 'General case' 0 CA--C 1.499 -1.018 1 O-C-N 129.879 4.487 . . . . 0.0 114.779 -178.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -102.4 71.0 1.19 Allowed 'General case' 0 C--O 1.202 -1.439 0 O-C-N 125.547 1.78 . . . . 0.0 108.032 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -53.64 130.59 36.83 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 125.161 2.41 . . . . 0.0 111.351 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -142.83 38.19 1.46 Allowed 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 110.675 -2.966 . . . . 0.0 112.028 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.442 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -38.61 160.68 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.733 0 CA-C-N 111.232 -2.713 . . . . 0.0 116.315 -179.96 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.442 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.6 135.83 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 126.796 3.189 . . . . 0.0 112.447 179.469 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.85 -12.61 14.92 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 111.252 -2.704 . . . . 0.0 106.84 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.413 ' HA ' HD13 ' A' ' 26' ' ' ILE . 3.5 tp -117.31 -61.36 1.72 Allowed 'General case' 0 C--N 1.352 0.677 0 CA-C-N 108.993 -3.603 . . . . 0.0 116.583 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -123.19 -53.89 1.81 Allowed 'General case' 0 C--O 1.214 -0.801 0 CA-C-O 123.226 1.489 . . . . 0.0 112.793 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.48 79.08 0.79 Allowed Glycine 0 C--O 1.207 -1.591 0 CA-C-O 125.191 2.551 . . . . 0.0 111.425 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.439 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 2.6 tpt180 -144.36 -101.34 0.11 Allowed 'General case' 0 N--CA 1.486 1.372 1 CA-C-N 107.513 -4.344 . . . . 0.0 113.875 -179.877 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.439 ' N ' ' HG3' ' A' ' 81' ' ' ARG . 0.5 OUTLIER 153.76 120.7 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 O-C-N 127.147 2.78 . . . . 0.0 108.368 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 2.1 t -141.97 178.22 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 0 O-C-N 127.717 3.136 . . . . 0.0 113.266 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt -119.87 95.6 4.83 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 127.038 2.711 . . . . 0.0 110.701 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.1 m -91.54 81.06 5.37 Favored 'General case' 0 C--O 1.195 -1.785 0 O-C-N 126.34 2.275 . . . . 0.0 115.244 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.84 148.36 49.17 Favored 'General case' 0 N--CA 1.433 -1.319 2 CA-C-N 106.525 -4.852 . . . . 0.0 110.849 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.506 HG22 ' CD2' ' A' ' 65' ' ' PHE . 38.7 t -131.48 143.95 38.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 124.766 1.226 . . . . 0.0 110.731 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -164.93 174.06 10.95 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.085 -1.871 . . . . 0.0 111.853 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.695 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 68.9 m95 -98.35 150.0 22.05 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 114.625 -2.607 . . . . 0.0 110.317 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.455 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.6 OUTLIER -96.43 -8.28 32.73 Favored 'General case' 0 C--O 1.206 -1.231 1 CA-C-O 131.808 5.575 . . . . 0.0 112.911 179.665 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.32 -18.15 8.89 Favored Glycine 0 C--O 1.211 -1.283 2 CA-C-N 107.7 -4.318 . . . . 0.0 102.846 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -171.27 75.39 0.06 Allowed 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 128.919 2.888 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 90' ' ' GLU . 6.4 t 132.92 154.88 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.716 3.206 . . . . 0.0 118.365 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.419 ' N ' ' OG1' ' A' ' 93' ' ' THR . 1.1 tp -81.65 105.6 12.92 Favored 'General case' 0 CA--C 1.493 -1.23 0 O-C-N 127.315 2.885 . . . . 0.0 114.868 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.296 88.8 t -107.43 110.62 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 111.589 -2.55 . . . . 0.0 111.771 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.506 ' HB2' ' CH2' ' A' ' 107' ' ' TRP . 33.0 m -130.41 144.34 51.33 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.74 118.18 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.069 0 CA-C-N 112.333 -2.212 . . . . 0.0 116.765 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.481 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 1.4 mt-30 -84.78 93.1 8.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 125.651 2.643 . . . . 0.0 109.009 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -86.33 123.11 31.21 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-N 107.485 -4.416 . . . . 0.0 109.016 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -131.83 -85.6 0.32 Allowed Glycine 0 C--O 1.202 -1.885 0 CA-C-O 126.415 3.23 . . . . 0.0 108.271 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.413 ' HG2' ' N ' ' A' ' 102' ' ' LYS . 43.7 tt0 -149.97 -78.42 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 1 CA-C-N 107.752 -4.224 . . . . 0.0 112.951 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.413 ' N ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -94.71 -9.22 35.44 Favored 'General case' 0 C--O 1.206 -1.224 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -97.51 152.99 18.44 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -140.64 83.35 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 2 O-C-N 132.437 6.085 . . . . 0.0 101.906 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.481 ' HB2' ' CG ' ' A' ' 98' ' ' GLN . 16.7 mmm-85 -88.69 12.33 15.13 Favored 'General case' 0 C--O 1.22 -0.492 0 O-C-N 126.947 2.655 . . . . 0.0 115.284 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.53 109.37 1.74 Allowed Glycine 0 CA--C 1.541 1.702 1 O-C-N 130.533 4.895 . . . . 0.0 116.38 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.506 ' CH2' ' HB2' ' A' ' 96' ' ' CYS . 6.9 p90 -95.65 3.44 53.98 Favored 'General case' 0 N--CA 1.427 -1.623 2 O-C-N 134.858 6.858 . . . . 0.0 114.285 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -20.9 141.21 0.0 OUTLIER 'General case' 0 C--N 1.363 1.154 1 O-C-N 130.483 4.865 . . . . 0.0 115.886 -178.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -107.46 167.96 9.57 Favored 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.566 -2.561 . . . . 0.0 110.531 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.43 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.7 OUTLIER -173.94 61.9 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.02 1 O-C-N 130.736 5.022 . . . . 0.0 116.889 179.04 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 99.9 t -22.53 94.1 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.634 0 O-C-N 126.672 2.483 . . . . 0.0 114.335 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -90.19 16.25 8.88 Favored 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 124.71 2.195 . . . . 0.0 115.341 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.74 122.6 4.02 Favored Glycine 0 C--O 1.197 -2.175 0 CA-C-N 113.908 -1.496 . . . . 0.0 114.378 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 63.23 6.09 2.23 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 119.216 3.043 . . . . 0.0 119.216 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.488 ' HE2' ' CE1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -167.97 -153.95 0.14 Allowed 'General case' 0 CA--C 1.496 -1.106 1 O-C-N 129.539 4.274 . . . . 0.0 110.977 179.931 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.402 ' O ' ' N ' ' A' ' 118' ' ' LEU . 0.0 OUTLIER -162.78 110.48 1.28 Allowed 'General case' 0 CA--C 1.478 -1.805 0 C-N-CA 113.556 -3.258 . . . . 0.0 112.886 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.488 ' CE1' ' HE2' ' A' ' 115' ' ' LYS . 83.0 m-85 -66.48 80.52 0.1 Allowed 'General case' 0 C--N 1.351 0.66 1 CA-C-N 108.023 -4.171 . . . . 0.0 117.227 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 116' ' ' LEU . 1.3 tt -67.04 105.58 1.7 Allowed 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 111.716 -2.493 . . . . 0.0 104.82 178.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.43 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 0.6 OUTLIER -109.92 115.72 30.32 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 116.416 -1.754 . . . . 0.0 109.15 -178.006 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.89 138.77 54.27 Favored 'General case' 0 CA--C 1.504 -0.816 1 O-C-N 130.386 4.804 . . . . 0.0 113.912 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 80.5 m -110.63 162.53 14.64 Favored 'General case' 0 C--O 1.2 -1.55 0 CA-C-N 108.642 -3.89 . . . . 0.0 105.651 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.92 54.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 127.051 3.31 . . . . 0.0 112.394 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 94.88 -43.56 2.27 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 109.813 -3.358 . . . . 0.0 114.156 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -141.28 -52.7 0.45 Allowed 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 113.412 -1.394 . . . . 0.0 110.279 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -67.01 148.19 52.26 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 126.919 2.637 . . . . 0.0 107.136 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.1 m -132.7 77.05 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.875 1 O-C-N 129.321 4.138 . . . . 0.0 111.973 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.76 142.81 58.27 Favored 'General case' 0 CA--C 1.497 -1.074 0 CA-C-N 114.59 -1.187 . . . . 0.0 112.133 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -125.47 115.14 19.78 Favored 'General case' 0 CA--C 1.506 -0.724 0 O-C-N 125.515 1.759 . . . . 0.0 115.107 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -99.46 167.42 10.63 Favored 'General case' 0 N--CA 1.487 1.379 1 O-C-N 129.118 4.012 . . . . 0.0 110.416 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.3 -46.14 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 119.595 1.089 . . . . 0.0 111.776 -178.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.458 ' CZ ' ' HE1' ' A' ' 11' ' ' MET . 7.3 m-85 66.3 174.68 0.24 Allowed 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 128.955 2.902 . . . . 0.0 116.549 -179.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -157.11 118.34 3.68 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.601 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 21.2 ttpt -61.6 125.82 25.18 Favored 'General case' 0 C--O 1.207 -1.16 0 CA-C-O 116.231 -1.843 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt . . . . . 0 C--O 1.265 1.901 0 O-C-N 128.931 3.894 . . . . 0.0 118.864 -179.461 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.529 ' HB3' ' CH2' ' A' ' 89' ' ' TRP . 5.7 mttt . . . . . 0 CA--C 1.497 -1.082 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.55 120.96 32.08 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -134.8 30.49 3.4 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 113.506 -3.14 . . . . 0.0 108.742 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.5 115.81 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 129.024 3.952 . . . . 0.0 112.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -153.38 -123.5 0.95 Allowed Glycine 0 C--O 1.203 -1.807 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.885 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.491 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER 179.53 148.95 0.28 Allowed 'General case' 0 N--CA 1.475 0.806 1 O-C-N 132.616 5.539 . . . . 0.0 107.686 -179.907 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.552 ' CZ3' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -156.93 106.2 2.22 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 128.932 3.895 . . . . 0.0 116.463 -179.726 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -38.74 -39.14 0.47 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 85.53 34.64 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 113.946 -2.93 . . . . 0.0 107.099 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 20.4 -75.94 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.973 1 O-C-N 130.845 5.091 . . . . 0.0 110.552 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -149.74 160.77 43.27 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 111.649 -2.523 . . . . 0.0 110.662 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -116.47 114.02 23.64 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 110.844 -2.889 . . . . 0.0 117.051 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -47.0 83.87 Favored 'General case' 0 CA--C 1.504 -0.806 1 O-C-N 130.085 4.616 . . . . 0.0 113.269 -179.766 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -128.76 95.93 4.24 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 112.362 -2.199 . . . . 0.0 114.739 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.475 ' CD2' ' N ' ' A' ' 18' ' ' GLU . 2.2 t80 -100.31 -57.1 2.19 Favored 'General case' 0 CA--C 1.489 -1.383 0 CA-C-O 127.12 3.343 . . . . 0.0 108.395 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.475 ' N ' ' CD2' ' A' ' 17' ' ' PHE . 0.2 OUTLIER -65.05 -52.9 53.17 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 118.966 -2.333 . . . . 0.0 114.717 179.814 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.459 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -62.33 -25.14 66.36 Favored Glycine 0 N--CA 1.48 1.607 1 O-C-N 130.09 4.619 . . . . 0.0 111.63 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.406 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -66.98 -43.74 82.27 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-O 125.148 2.404 . . . . 0.0 108.221 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 mtp -72.05 -23.85 61.44 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-N 113.673 -1.603 . . . . 0.0 112.877 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.459 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 2.2 ttpt -76.21 -27.61 56.91 Favored 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 109.568 -3.469 . . . . 0.0 111.819 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.35 66.73 Favored 'General case' 0 C--N 1.318 -0.804 1 O-C-N 130.099 4.624 . . . . 0.0 112.089 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.79 -11.07 49.07 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 127.421 2.951 . . . . 0.0 104.372 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.3 t0 45.71 80.63 0.04 OUTLIER 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.137 3.827 . . . . 0.0 109.128 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 14.1 tt -82.7 -15.8 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 1 CA-C-N 108.065 -4.152 . . . . 0.0 109.772 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.442 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 1.3 t0 -173.38 -179.26 1.86 Allowed 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 117.523 -1.671 . . . . 0.0 112.289 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -119.25 86.5 2.56 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 62.5 49.88 3.85 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 126.959 2.662 . . . . 0.0 109.297 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.442 ' HB ' ' HB3' ' A' ' 27' ' ' ASP . 1.7 t -88.67 -26.59 21.76 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 108.571 -3.922 . . . . 0.0 113.186 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.413 ' N ' HG21 ' A' ' 30' ' ' THR . 0.1 OUTLIER -68.84 -138.24 0.01 OUTLIER 'General case' 0 C--O 1.242 0.697 1 O-C-N 130.127 4.642 . . . . 0.0 108.435 179.953 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 84.35 4.38 0.71 Allowed 'General case' 0 CA--C 1.497 -1.077 0 O-C-N 128.82 3.825 . . . . 0.0 113.291 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.43 -21.92 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.928 0 CA-C-N 110.111 -3.222 . . . . 0.0 114.426 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.507 ' HA ' ' CD2' ' A' ' 37' ' ' LEU . . . -90.49 11.34 22.04 Favored 'General case' 0 C--O 1.206 -1.217 0 CA-C-O 123.386 1.565 . . . . 0.0 112.365 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.5 t -44.73 -40.04 1.93 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-O 123.758 1.742 . . . . 0.0 109.931 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 169.34 117.78 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 109.337 -3.574 . . . . 0.0 115.399 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.507 ' CD2' ' HA ' ' A' ' 34' ' ' ALA . 0.4 OUTLIER -147.86 53.76 1.04 Allowed 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 110.704 -2.953 . . . . 0.0 104.972 179.53 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.1 m 68.87 139.94 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.243 1 O-C-N 135.106 7.754 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -125.78 -65.89 0.97 Allowed 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 117.296 2.332 . . . . 0.0 117.296 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.9 m 56.48 108.49 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.622 1 O-C-N 131.971 5.795 . . . . 0.0 111.628 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.7 149.05 23.23 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 127.988 3.305 . . . . 0.0 103.373 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.434 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 5.1 mt -137.43 156.24 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 1 O-C-N 129.189 4.056 . . . . 0.0 110.29 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.434 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.32 6.6 tt -130.36 131.51 65.35 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 O-C-N 126.905 2.628 . . . . 0.0 108.257 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.271 72.4 t -137.58 125.98 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 113.412 -1.722 . . . . 0.0 110.312 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -132.67 88.66 2.55 Favored 'General case' 0 CA--C 1.489 -1.371 0 N-CA-C 118.979 2.955 . . . . 0.0 118.979 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -68.0 -54.78 15.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 C-N-CA 114.266 -2.973 . . . . 0.0 115.018 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.54 105.47 0.2 Allowed Glycine 0 C--O 1.205 -1.719 0 O-C-N 121.169 -0.957 . . . . 0.0 112.489 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 63.41 19.27 11.59 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 119.011 -1.075 . . . . 0.0 110.52 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -130.48 154.3 47.9 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 128.144 3.403 . . . . 0.0 108.399 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.527 ' CD1' HD12 ' A' ' 94' ' ' LEU . 51.1 t80 -155.02 99.92 2.15 Favored 'General case' 0 CA--C 1.484 -1.593 1 O-C-N 129.983 4.552 . . . . 0.0 112.932 -179.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -120.12 75.72 1.12 Allowed 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 126.508 2.38 . . . . 0.0 112.546 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.472 ' O ' ' N ' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -57.68 145.65 33.55 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 128.857 3.848 . . . . 0.0 106.04 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.446 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 4.2 ptmm? -145.26 152.57 40.17 Favored 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 115.396 -2.522 . . . . 0.0 111.397 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.469 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 4.1 t -106.43 155.16 19.85 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 124.934 2.302 . . . . 0.0 112.153 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -130.15 52.21 2.03 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 111.543 -2.571 . . . . 0.0 110.302 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.401 ' HB2' ' CD1' ' A' ' 58' ' ' PHE . 10.5 p -69.12 -99.69 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.078 1 O-C-N 129.332 4.145 . . . . 0.0 112.33 -179.813 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 153.81 -34.05 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 O-C-N 127.281 2.863 . . . . 0.0 104.27 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.487 ' CD2' ' HB3' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -82.39 -60.88 2.05 Favored 'General case' 0 C--N 1.368 1.37 0 O-C-N 128.579 3.674 . . . . 0.0 112.111 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.3 98.41 3.43 Favored 'General case' 0 C--O 1.216 -0.704 2 CA-C-N 107.479 -4.418 . . . . 0.0 113.869 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.469 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 54.3 m-20 -82.99 65.95 8.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 109.556 -3.475 . . . . 0.0 110.507 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -96.72 80.68 3.09 Favored 'General case' 0 CA--C 1.503 -0.862 0 O-C-N 127.058 2.724 . . . . 0.0 109.052 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 5.7 p-10 -79.72 132.63 36.24 Favored 'General case' 0 C--O 1.2 -1.507 1 O-C-N 129.685 4.366 . . . . 0.0 116.423 -179.605 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.538 ' HG ' ' CZ ' ' A' ' 65' ' ' PHE . 3.2 tp -52.86 118.05 3.4 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 128.537 3.648 . . . . 0.0 109.563 177.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -135.46 84.69 2.11 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 116.766 -1.974 . . . . 0.0 111.639 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.538 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 6.5 p90 -171.62 145.07 1.96 Allowed 'General case' 0 N--CA 1.474 0.749 1 CA-C-O 128.939 4.209 . . . . 0.0 111.228 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.406 HG21 ' N ' ' A' ' 67' ' ' VAL . 0.7 OUTLIER -76.86 163.34 26.86 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 110.867 -2.879 . . . . 0.0 106.468 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.522 HG22 ' CD1' ' A' ' 89' ' ' TRP . 9.3 p -77.75 142.28 14.39 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.787 0 O-C-N 128.652 3.72 . . . . 0.0 112.127 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 59.17 14.58 26.11 Favored Glycine 0 N--CA 1.484 1.894 0 C-N-CA 116.217 -2.897 . . . . 0.0 117.323 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -83.63 -18.62 10.04 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.351 0 C-N-CA 118.062 -1.455 . . . . 0.0 107.819 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 74.33 130.72 0.04 OUTLIER 'General case' 0 C--N 1.349 0.584 1 O-C-N 131.488 5.493 . . . . 0.0 109.536 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.423 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.5 t80 -107.74 29.12 7.52 Favored 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.647 3.092 . . . . 0.0 110.62 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -14.23 84.41 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.976 0 O-C-N 127.34 2.9 . . . . 0.0 115.585 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.433 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 3.0 mp0 59.62 173.23 0.08 Allowed 'General case' 0 C--O 1.209 -1.04 1 CA-C-O 129.128 4.299 . . . . 0.0 111.965 -179.345 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.509 ' N ' ' ND1' ' A' ' 74' ' ' HIS . 1.6 m-70 69.98 78.18 0.2 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-N 110.035 -3.257 . . . . 0.0 114.284 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 76.3 p -85.1 -82.32 0.18 Allowed 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 112.868 -1.969 . . . . 0.0 112.015 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.0 mtmt 60.96 168.98 0.09 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 126.215 2.912 . . . . 0.0 115.542 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.18 19.72 77.55 Favored Glycine 0 C--O 1.207 -1.565 0 CA-C-N 111.239 -2.709 . . . . 0.0 109.921 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.1 tp -172.1 -44.39 0.02 OUTLIER 'General case' 0 CA--C 1.505 -0.756 1 O-C-N 130.74 4.435 . . . . 0.0 113.399 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.18 -70.21 0.57 Allowed 'General case' 0 CA--C 1.5 -0.948 0 CA-C-O 124.119 1.914 . . . . 0.0 113.011 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.76 87.88 1.21 Allowed Glycine 0 N--CA 1.476 1.332 0 CA-C-N 113.722 -1.581 . . . . 0.0 111.114 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.4 mmt-85 -144.44 178.96 7.57 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 127.084 2.284 . . . . 0.0 109.5 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 63.6 m-20 -120.47 75.07 1.09 Allowed 'General case' 0 CA--C 1.501 -0.934 0 O-C-N 124.901 1.376 . . . . 0.0 110.714 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.4 HG11 ' N ' ' A' ' 99' ' ' LYS . 17.5 t -113.47 139.15 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 O-C-N 128.815 3.822 . . . . 0.0 111.421 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.442 ' HE3' ' HE3' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -32.35 -69.34 0.08 Allowed 'General case' 0 CA--C 1.504 -0.794 1 O-C-N 131.864 5.727 . . . . 0.0 112.87 -179.856 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 62.4 m 62.65 68.47 0.65 Allowed 'General case' 0 C--O 1.199 -1.573 0 C-N-CA 127.432 2.293 . . . . 0.0 110.585 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.401 HD21 HG21 ' A' ' 97' ' ' VAL . 4.0 tt -91.3 112.82 24.89 Favored 'General case' 0 N--CA 1.429 -1.514 2 O-C-N 131.502 5.501 . . . . 0.0 116.425 -179.429 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.52 HG22 ' CD1' ' A' ' 65' ' ' PHE . 38.4 t -92.88 151.25 3.65 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 CA-C-O 122.764 1.268 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.451 ' HA ' ' CG2' ' A' ' 67' ' ' VAL . 4.0 t -164.3 159.08 19.49 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 112.203 -2.271 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.682 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.252 18.1 m95 -86.49 149.56 24.89 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 114.083 -2.865 . . . . 0.0 105.171 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.492 ' CB ' HG23 ' A' ' 93' ' ' THR . 2.8 tm-20 -96.82 -47.06 6.01 Favored 'General case' 0 C--O 1.195 -1.786 1 CA-C-O 128.949 4.214 . . . . 0.0 111.974 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -179.76 -49.72 0.08 OUTLIER Glycine 0 C--O 1.197 -2.179 1 CA-C-N 107.669 -4.332 . . . . 0.0 103.899 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -141.54 29.03 1.78 Allowed 'General case' 0 N--CA 1.447 -0.613 1 O-C-N 133.118 5.834 . . . . 0.0 111.344 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.492 HG23 ' CB ' ' A' ' 90' ' ' GLU . 1.5 t -162.42 160.91 26.94 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.527 HD12 ' CD1' ' A' ' 50' ' ' PHE . 3.4 tt -93.51 112.48 24.38 Favored 'General case' 0 CA--C 1.487 -1.479 0 O-C-N 127.951 3.282 . . . . 0.0 114.679 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.352 52.9 t -116.83 134.91 58.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 111.726 -2.488 . . . . 0.0 114.552 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 34.4 t -137.18 140.92 42.1 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.401 HG21 HD21 ' A' ' 86' ' ' LEU . 6.1 m -128.93 101.34 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 1 CA-C-O 128.635 4.064 . . . . 0.0 118.949 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . 0.302 4.0 mm100 -71.9 111.01 6.8 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-N 110.185 -3.189 . . . . 0.0 107.464 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.442 ' HE3' ' HE3' ' A' ' 84' ' ' LYS . 3.3 ttmt -37.3 -46.03 0.72 Allowed 'General case' 0 C--O 1.195 -1.81 1 O-C-N 129.579 4.299 . . . . 0.0 111.014 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.89 -86.63 0.42 Allowed Glycine 0 C--O 1.203 -1.833 0 CA-C-O 125.925 2.958 . . . . 0.0 113.37 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.78 16.18 7.88 Favored 'General case' 0 CA--C 1.497 -1.095 1 CA-C-N 106.421 -4.889 . . . . 0.0 109.423 -179.633 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 155.53 -33.83 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 125.852 2.739 . . . . 0.0 113.516 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.404 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 2.7 mt-10 -104.99 178.73 4.48 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 110.037 -3.256 . . . . 0.0 117.301 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.425 ' HB3' HG23 ' A' ' 121' ' ' THR 0.251 7.7 m-20 -144.94 79.9 1.61 Allowed 'General case' 0 N--CA 1.489 1.49 2 CA-C-N 106.535 -4.848 . . . . 0.0 101.732 179.447 . . . . . . . . 4 3 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 2.5 tpt180 -101.21 -3.3 29.3 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 126.376 2.989 . . . . 0.0 114.172 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -52.15 103.53 0.12 Allowed Glycine 0 N--CA 1.426 -1.968 1 CA-C-N 107.271 -4.513 . . . . 0.0 118.724 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.41 ' CD1' ' C ' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -97.16 146.46 25.04 Favored 'General case' 0 C--O 1.214 -0.778 0 O-C-N 129.299 3.588 . . . . 0.0 110.283 178.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.525 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -163.08 177.19 9.35 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 128.747 3.779 . . . . 0.0 113.097 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -143.12 173.37 11.63 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 116.26 -2.176 . . . . 0.0 108.324 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.525 ' CH2' ' HG3' ' A' ' 108' ' ' LYS 0.29 0.0 OUTLIER -159.23 24.77 0.2 Allowed 'General case' 0 CA--C 1.501 -0.912 1 O-C-N 129.623 4.327 . . . . 0.0 117.542 179.551 . . . . . . . . 5 4 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 32.0 t 23.68 78.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 CA-C-O 127.973 3.749 . . . . 0.0 117.432 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -90.13 57.73 3.86 Favored 'General case' 0 CA--C 1.484 -1.562 0 O-C-N 118.753 -2.467 . . . . 0.0 112.441 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.09 -126.23 7.37 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 111.685 -2.507 . . . . 0.0 111.424 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -106.69 39.49 1.83 Allowed 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 113.875 -1.162 . . . . 0.0 113.139 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.404 ' HB2' ' C ' ' A' ' 131' ' ' PHE . 13.9 pttt -170.48 142.3 2.08 Favored 'General case' 0 C--N 1.316 -0.867 1 O-C-N 130.104 4.627 . . . . 0.0 105.836 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.408 ' O ' ' CD1' ' A' ' 131' ' ' PHE . 3.7 pp -115.49 133.89 55.6 Favored 'General case' 0 C--O 1.194 -1.855 0 O-C-N 128.093 3.371 . . . . 0.0 111.202 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.428 ' O ' ' N ' ' A' ' 119' ' ' GLU . 2.9 m-85 -77.7 92.81 4.18 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 109.441 -3.527 . . . . 0.0 114.364 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.491 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -74.73 76.88 2.07 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 109.096 -3.684 . . . . 0.0 106.197 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 117' ' ' TYR . 40.8 mt-10 -85.29 101.86 12.89 Favored 'General case' 0 CA--C 1.485 -1.539 0 O-C-N 129.094 3.996 . . . . 0.0 110.682 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.44 154.67 33.35 Favored 'General case' 0 CA--C 1.487 -1.472 1 O-C-N 129.311 4.132 . . . . 0.0 111.686 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.425 HG23 ' HB3' ' A' ' 104' ' ' ASN . 4.0 m -111.89 160.01 17.81 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 110.458 -3.065 . . . . 0.0 105.738 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 3.3 m -151.85 33.85 0.54 Allowed 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.541 1.064 . . . . 0.0 111.647 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.71 -41.26 2.25 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 22.6 t70 172.12 91.45 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.295 0 C-N-CA 125.941 1.697 . . . . 0.0 108.609 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -167.78 -53.47 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 111.067 -2.788 . . . . 0.0 105.435 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.1 t 58.26 54.22 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.686 1 O-C-N 130.14 4.65 . . . . 0.0 113.716 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 49.6 t -42.11 124.69 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 124.663 1.227 . . . . 0.0 110.193 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.48 92.89 4.31 Favored 'General case' 0 CA--C 1.486 -1.506 0 CA-C-N 113.732 -1.576 . . . . 0.0 114.043 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -74.17 157.21 36.35 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 114.919 -2.712 . . . . 0.0 113.658 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 52.0 t -142.51 86.97 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 CA-C-O 125.066 2.365 . . . . 0.0 108.068 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.526 ' CE2' ' HB2' ' A' ' 9' ' ' TRP 0.266 6.2 m-85 -72.2 -179.33 2.8 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 109.583 -3.462 . . . . 0.0 116.335 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.67 120.95 0.93 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 109.118 -3.673 . . . . 0.0 103.607 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.552 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 3.2 ttpm? -70.72 90.37 0.77 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 112.111 -2.313 . . . . 0.0 115.048 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt . . . . . 0 CA--C 1.482 -1.664 0 CA-C-O 114.149 -2.834 . . . . 0.0 118.186 179.615 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 116.196 1.924 . . . . 0.0 116.196 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -106.82 97.94 7.66 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -92.76 -124.42 0.09 Allowed 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 115.354 -2.26 . . . . 0.0 107.261 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 71.52 100.02 0.07 Allowed 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 130.329 3.452 . . . . 0.0 112.542 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.27 -130.44 1.18 Allowed Glycine 0 CA--C 1.534 1.242 0 CA-C-O 114.789 -3.228 . . . . 0.0 113.759 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.534 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -169.6 147.35 3.5 Favored 'General case' 0 C--O 1.214 -0.811 1 O-C-N 133.59 6.112 . . . . 0.0 104.519 -179.892 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.534 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -148.24 109.42 4.32 Favored 'General case' 0 CA--C 1.494 -1.176 1 O-C-N 130.941 5.151 . . . . 0.0 114.78 -179.894 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -78.41 119.99 22.51 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 127.4 2.937 . . . . 0.0 111.576 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.477 ' CE ' ' HB3' ' A' ' 14' ' ' ASN . 3.4 ttp -57.54 96.05 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 O-C-N 126.243 2.215 . . . . 0.0 106.53 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.59 -14.23 40.3 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 130.207 3.403 . . . . 0.0 111.688 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.8 158.29 3.22 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.609 -1.632 . . . . 0.0 113.262 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.477 ' HB3' ' CE ' ' A' ' 11' ' ' MET . 14.1 p-10 -133.86 129.47 36.48 Favored 'General case' 0 CA--C 1.493 -1.228 0 O-C-N 127.947 3.28 . . . . 0.0 111.337 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -101.25 -71.31 0.71 Allowed 'General case' 0 CA--C 1.477 -1.833 1 O-C-N 129.779 4.425 . . . . 0.0 115.247 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.98 -71.07 0.51 Allowed 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 118.845 -2.409 . . . . 0.0 115.697 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 71.73 -72.58 0.11 Allowed 'General case' 0 C--O 1.198 -1.609 0 O-C-N 126.546 2.403 . . . . 0.0 112.156 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.466 ' CB ' ' HB3' ' A' ' 31' ' ' ARG . 0.1 OUTLIER -76.49 -30.44 57.25 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.987 -179.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.47 -22.97 77.89 Favored Glycine 0 N--CA 1.484 1.843 1 O-C-N 130.345 4.778 . . . . 0.0 108.404 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.58 -46.65 53.3 Favored 'General case' 0 C--O 1.194 -1.837 0 CA-C-O 126.006 2.813 . . . . 0.0 108.933 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.429 ' HA ' HD22 ' A' ' 24' ' ' LEU . 1.7 mtt -59.93 -29.5 68.43 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 110.451 -3.068 . . . . 0.0 112.928 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -79.72 -23.93 42.01 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 127.757 3.16 . . . . 0.0 112.008 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.37 -29.09 64.55 Favored 'General case' 0 C--O 1.205 -1.243 1 O-C-N 132.211 5.944 . . . . 0.0 114.419 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.445 HD13 HD11 ' A' ' 26' ' ' ILE . 0.9 OUTLIER -111.06 20.06 17.82 Favored 'General case' 0 CA--C 1.539 0.538 1 O-C-N 129.807 4.442 . . . . 0.0 108.529 179.975 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 20.45 86.75 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.571 1 O-C-N 130.053 4.596 . . . . 0.0 110.279 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.445 HD11 HD13 ' A' ' 24' ' ' LEU . 6.4 tp -98.77 -39.78 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 CA-C-O 127.045 3.307 . . . . 0.0 112.017 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.422 ' N ' HG21 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -171.61 -158.61 0.13 Allowed 'General case' 0 C--N 1.359 0.994 0 O-C-N 119.241 -2.162 . . . . 0.0 109.183 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -143.84 49.14 1.39 Allowed 'General case' 0 C--O 1.207 -1.152 0 O-C-N 121.441 -0.787 . . . . 0.0 112.335 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 152.19 78.98 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.792 0 O-C-N 127.942 3.277 . . . . 0.0 107.699 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.5 m -139.17 22.42 2.59 Favored 'General case' 0 CA--C 1.504 -0.798 2 CA-C-N 106.282 -4.963 . . . . 0.0 113.357 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.466 ' HB3' ' CB ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.44 24.05 10.89 Favored 'General case' 0 CA--C 1.509 -0.603 0 O-C-N 128.186 3.429 . . . . 0.0 113.945 179.744 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.45 15.19 17.93 Favored 'General case' 0 CA--C 1.488 -1.441 0 O-C-N 127.284 2.865 . . . . 0.0 112.464 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -170.04 74.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.362 1.132 1 CA-C-N 107.931 -4.213 . . . . 0.0 109.493 -179.791 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.403 ' O ' ' N ' ' A' ' 36' ' ' ARG . . . 172.32 -38.25 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.182 0 O-C-N 120.367 -1.458 . . . . 0.0 109.079 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 51.1 t -17.95 -47.85 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 O-C-N 128.935 3.897 . . . . 0.0 112.717 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' ALA . 0.0 OUTLIER 159.42 114.68 0.0 OUTLIER 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 108.955 -3.748 . . . . 0.0 113.333 179.515 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.47 ' CD1' ' HB3' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -145.53 85.94 1.73 Allowed 'General case' 0 C--O 1.212 -0.905 1 CA-C-N 108.249 -4.069 . . . . 0.0 107.138 179.722 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.5 m 72.91 47.35 0.21 Allowed 'General case' 0 N--CA 1.485 1.318 1 O-C-N 133.973 7.046 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.418 ' HG2' ' CB ' ' A' ' 11' ' ' MET . 4.0 tt0 -79.52 135.36 36.61 Favored 'General case' 0 CA--C 1.492 -1.257 0 C-N-CA 118.393 -1.323 . . . . 0.0 113.277 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.4 m -152.52 120.47 6.17 Favored 'General case' 0 C--O 1.212 -0.905 0 C-N-CA 130.26 3.424 . . . . 0.0 111.5 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.402 ' HD3' ' C ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -103.62 152.97 21.13 Favored 'General case' 0 N--CA 1.48 1.048 1 O-C-N 129.169 4.043 . . . . 0.0 103.486 179.853 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.459 ' N ' ' O ' ' A' ' 53' ' ' LYS . 3.2 mp -140.0 156.64 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 O-C-N 126.886 2.616 . . . . 0.0 109.71 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.443 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.295 1.4 tt -127.38 138.08 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.495 0 O-C-N 128.217 3.448 . . . . 0.0 109.45 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.8 t -137.14 87.69 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.274 0 CA-C-N 112.038 -2.346 . . . . 0.0 109.704 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -99.61 102.99 14.66 Favored 'General case' 0 C--O 1.21 -0.982 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.86 -14.27 23.32 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 128.012 3.32 . . . . 0.0 112.477 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.69 -96.23 0.18 Allowed Glycine 0 C--O 1.203 -1.795 0 CA-C-O 122.955 1.308 . . . . 0.0 111.208 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -86.36 -13.6 45.98 Favored 'General case' 0 C--O 1.21 -1.002 0 CA-C-N 110.872 -2.664 . . . . 0.0 110.661 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.523 HD21 ' N ' ' A' ' 49' ' ' ASN . 2.4 m-80 -109.69 93.34 4.45 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 128.438 3.586 . . . . 0.0 109.57 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.465 ' CD2' HD11 ' A' ' 94' ' ' LEU . 91.3 t80 -108.15 101.04 10.3 Favored 'General case' 0 CA--C 1.501 -0.926 1 O-C-N 129.66 4.35 . . . . 0.0 115.446 -179.968 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.424 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 30.4 mttt -112.35 85.98 2.26 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 119.022 2.971 . . . . 0.0 119.022 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.413 ' O ' ' N ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -65.25 120.47 12.8 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 128.255 3.472 . . . . 0.0 106.222 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -125.43 150.82 46.94 Favored 'General case' 0 CA--C 1.493 -1.232 0 O-C-N 126.513 2.383 . . . . 0.0 112.31 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -98.14 175.3 6.14 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 125.407 1.692 . . . . 0.0 110.457 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -148.65 35.75 0.78 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.827 -1.988 . . . . 0.0 115.483 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.549 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 9.6 p -73.04 167.86 20.25 Favored 'General case' 0 C--N 1.323 -0.549 1 O-C-N 130.66 4.975 . . . . 0.0 111.927 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.3 m -101.56 -1.84 31.98 Favored 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 128.738 3.774 . . . . 0.0 110.746 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.549 ' CE1' ' HB2' ' A' ' 56' ' ' SER . 0.5 OUTLIER -108.93 -58.95 1.95 Allowed 'General case' 0 C--O 1.218 -0.597 0 O-C-N 123.962 0.789 . . . . 0.0 110.864 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.7 mtt85 -137.8 122.59 18.78 Favored 'General case' 0 C--N 1.357 0.899 1 O-C-N 130.183 4.677 . . . . 0.0 116.186 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.4 99.38 5.81 Favored 'General case' 0 N--CA 1.439 -0.988 1 O-C-N 129.168 4.042 . . . . 0.0 111.209 -179.894 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.58 -67.78 0.92 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 110.177 -3.192 . . . . 0.0 107.653 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.422 ' HB2' ' CB ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER 98.02 176.81 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.364 5.415 . . . . 0.0 110.692 179.963 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.468 HD23 ' CZ2' ' A' ' 107' ' ' TRP . 8.6 tp -113.92 49.91 0.96 Allowed 'General case' 0 N--CA 1.436 -1.155 0 O-C-N 127.183 2.802 . . . . 0.0 112.643 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.424 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 14.9 t70 -59.59 89.37 0.01 OUTLIER 'General case' 0 C--O 1.211 -0.958 0 O-C-N 128.742 3.776 . . . . 0.0 105.923 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.441 ' N ' ' O ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -125.81 -174.1 3.0 Favored 'General case' 0 CA--C 1.495 -1.165 1 CA-C-O 128.994 4.235 . . . . 0.0 110.141 -179.763 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -167.12 122.15 1.07 Allowed 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 109.856 -3.338 . . . . 0.0 106.374 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.522 HG23 ' CD1' ' A' ' 89' ' ' TRP . 3.7 t -36.92 119.9 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.202 -1.412 1 O-C-N 129.638 4.336 . . . . 0.0 115.769 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.32 23.8 70.03 Favored Glycine 0 N--CA 1.487 2.05 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.3 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.09 -32.39 53.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.508 0 CA-C-N 112.162 -2.019 . . . . 0.0 109.939 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 57.03 73.99 0.43 Allowed 'General case' 0 C--N 1.356 0.867 1 O-C-N 130.555 4.909 . . . . 0.0 108.697 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.443 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 2.2 t80 -84.29 122.97 29.65 Favored 'General case' 0 CA--C 1.498 -1.042 1 O-C-N 129.352 4.157 . . . . 0.0 119.225 -179.363 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -91.49 54.71 2.58 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.091 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -21.94 109.01 0.02 OUTLIER 'General case' 0 CA--C 1.483 -1.617 0 CA-C-O 126.051 2.834 . . . . 0.0 113.257 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.82 54.73 0.86 Allowed 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 110.3 -3.137 . . . . 0.0 112.044 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.16 169.95 0.1 Allowed 'General case' 0 C--O 1.201 -1.471 0 CA-C-N 110.809 -2.905 . . . . 0.0 112.316 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 158.89 -32.19 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.807 1 O-C-N 130.036 4.585 . . . . 0.0 115.807 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.59 -21.49 57.89 Favored Glycine 0 C--O 1.218 -0.868 0 CA-C-N 108.441 -3.981 . . . . 0.0 112.843 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . 0.311 5.6 tp -171.32 36.47 0.02 OUTLIER 'General case' 0 CA--C 1.503 -0.849 1 O-C-N 132.977 5.751 . . . . 0.0 113.477 -179.844 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -170.65 -58.47 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.66 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 67.36 58.33 8.06 Favored Glycine 0 C--O 1.204 -1.734 0 C-N-CA 125.976 1.75 . . . . 0.0 111.463 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.28 -170.24 1.6 Allowed 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 129.707 3.828 . . . . 0.0 115.255 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -163.43 81.62 0.46 Allowed 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 113.445 -1.707 . . . . 0.0 109.411 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 3.6 t -125.02 155.37 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 0 O-C-N 127.528 3.017 . . . . 0.0 117.511 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.25 86.08 7.24 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 109.686 -3.416 . . . . 0.0 111.22 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.443 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 14.4 m -90.52 85.64 6.19 Favored 'General case' 0 C--O 1.206 -1.201 0 O-C-N 127.202 2.814 . . . . 0.0 111.2 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.7 tt -79.85 146.97 31.93 Favored 'General case' 0 CA--C 1.511 -0.534 2 CA-C-N 106.521 -4.854 . . . . 0.0 112.019 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 1.4 p -134.9 143.4 37.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 125.792 1.637 . . . . 0.0 112.126 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.445 ' CG2' ' HB ' ' A' ' 95' ' ' VAL . 5.8 t -166.98 169.48 12.95 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-O 126.75 3.166 . . . . 0.0 112.209 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.675 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.8 m95 -91.83 145.01 24.9 Favored 'General case' 0 CA--C 1.509 -0.628 0 O-C-N 117.579 -3.201 . . . . 0.0 105.732 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.506 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 1.1 tm-20 -85.9 -59.54 2.27 Favored 'General case' 0 C--O 1.203 -1.374 0 CA-C-O 127.813 3.673 . . . . 0.0 111.077 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.71 59.52 0.01 OUTLIER Glycine 0 C--O 1.195 -2.33 2 N-CA-C 100.818 -4.913 . . . . 0.0 100.818 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.6 t30 99.2 93.06 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 2 O-C-N 131.929 5.135 . . . . 0.0 104.142 -178.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.2 t 127.04 152.47 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.389 0 C-N-CA 130.291 3.436 . . . . 0.0 118.352 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.465 HD11 ' CD2' ' A' ' 50' ' ' PHE 0.268 0.6 OUTLIER -93.64 97.69 10.64 Favored 'General case' 0 CA--C 1.486 -1.495 0 CA-C-N 110.209 -3.178 . . . . 0.0 117.585 -179.407 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.506 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.418 42.3 t -92.65 151.1 3.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 CA-C-N 112.803 -1.999 . . . . 0.0 113.883 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.652 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 0.8 OUTLIER -165.84 157.23 13.9 Favored 'General case' 0 C--O 1.204 -1.328 0 O-C-N 126.977 2.673 . . . . 0.0 105.041 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . 0.286 0.0 OUTLIER -150.93 115.33 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.741 2 O-C-N 129.746 4.404 . . . . 0.0 115.259 -179.869 . . . . . . . . 4 3 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.459 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -78.25 98.14 5.79 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 126.329 2.966 . . . . 0.0 109.444 -179.873 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -85.27 84.62 7.61 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 109.595 -3.457 . . . . 0.0 110.898 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -94.4 -155.95 31.96 Favored Glycine 0 C--O 1.2 -2.016 0 CA-C-O 125.53 2.739 . . . . 0.0 108.058 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -93.02 -47.42 7.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 110.528 -2.836 . . . . 0.0 113.066 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.458 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -111.29 -61.32 1.71 Allowed 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -75.31 167.19 22.38 Favored 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 111.391 -2.641 . . . . 0.0 117.385 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -121.6 86.71 2.62 Favored 'General case' 0 CA--C 1.537 0.471 1 CA-C-N 107.353 -4.476 . . . . 0.0 103.592 179.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.459 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 28.4 mmm-85 -87.8 175.03 8.02 Favored 'General case' 0 N--CA 1.48 1.066 1 O-C-N 129.672 4.357 . . . . 0.0 107.374 179.549 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.23 -167.39 33.9 Favored Glycine 0 C--O 1.207 -1.554 1 O-C-N 130.705 5.003 . . . . 0.0 115.693 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.652 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 1.6 p90 -175.52 16.44 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.76 1 O-C-N 131.977 5.163 . . . . 0.0 121.15 178.964 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.539 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -45.24 133.33 7.03 Favored 'General case' 0 C--O 1.208 -1.126 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 -176.83 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.418 ' HG2' HD21 ' A' ' 94' ' ' LEU . 24.5 mm-40 -93.06 168.09 11.36 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 113.975 -2.916 . . . . 0.0 109.525 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.539 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 10.8 m95 -125.07 -38.58 2.31 Favored 'General case' 0 C--O 1.211 -0.956 1 O-C-N 130.226 4.704 . . . . 0.0 114.231 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.5 t 67.3 51.99 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.81 1 CA-C-O 129.721 4.581 . . . . 0.0 109.048 -175.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -98.97 122.72 42.59 Favored 'General case' 0 CA--C 1.475 -1.916 1 CA-C-N 107.043 -4.617 . . . . 0.0 119.009 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 35.35 74.2 0.09 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 118.147 2.019 . . . . 0.0 118.147 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 73.57 -30.85 0.21 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 129.398 3.079 . . . . 0.0 119.257 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.4 ' HG3' ' CE1' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -106.12 174.65 5.79 Favored 'General case' 0 CA--C 1.498 -1.034 1 O-C-N 130.272 4.733 . . . . 0.0 109.756 -179.784 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.4 tt -121.04 94.97 4.51 Favored 'General case' 0 C--O 1.197 -1.708 1 O-C-N 129.951 4.532 . . . . 0.0 112.269 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.4 ' CE1' ' HG3' ' A' ' 115' ' ' LYS . 5.9 m-30 -66.39 131.26 45.68 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 109.938 -3.301 . . . . 0.0 111.123 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.542 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -109.21 102.98 11.88 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 111.171 -2.74 . . . . 0.0 107.947 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -107.44 139.08 42.49 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -137.29 149.91 47.42 Favored 'General case' 0 CA--C 1.485 -1.546 1 O-C-N 129.941 4.525 . . . . 0.0 108.487 -179.568 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.0 m -111.23 156.48 21.4 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.21 -2.144 . . . . 0.0 105.21 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.24 88.66 0.67 Allowed 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 119.13 -1.028 . . . . 0.0 110.959 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 46.24 39.93 10.05 Favored Glycine 0 CA--C 1.508 -0.399 0 CA-C-O 122.725 1.18 . . . . 0.0 114.776 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 t70 71.21 92.31 0.09 Allowed 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 126.275 1.83 . . . . 0.0 110.432 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.22 -53.1 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.374 1 O-C-N 130.275 4.734 . . . . 0.0 105.467 179.813 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.8 t 61.78 78.02 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 CA-C-N 108.834 -3.803 . . . . 0.0 117.953 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.5 t -58.89 125.99 25.82 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 113.436 -1.711 . . . . 0.0 108.671 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -110.72 100.41 9.18 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 125.606 1.816 . . . . 0.0 110.615 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -93.6 163.93 13.36 Favored 'General case' 0 CA--C 1.489 -1.398 0 O-C-N 124.691 1.244 . . . . 0.0 112.258 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -136.46 137.34 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-O 126.288 2.947 . . . . 0.0 106.996 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.542 ' CE1' ' CB ' ' A' ' 118' ' ' LEU 0.273 64.1 m-85 -124.56 177.41 5.95 Favored 'General case' 0 CA--C 1.497 -1.09 1 CA-C-N 108.055 -4.157 . . . . 0.0 116.612 179.855 . . . . . . . . 4 3 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.77 139.31 19.61 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 110.622 -2.99 . . . . 0.0 103.774 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.516 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 4.9 ttmm -79.17 119.62 22.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-O 116.654 -1.641 . . . . 0.0 111.939 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt . . . . . 0 CA--C 1.49 -1.348 0 O-C-N 128.885 3.865 . . . . 0.0 118.863 -179.724 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.415 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 1.2 ptmm? . . . . . 0 N--CA 1.435 -1.176 0 N-CA-C 117.988 2.588 . . . . 0.0 117.988 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -148.63 71.98 1.17 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -133.2 160.28 37.71 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.402 ' HA ' ' CG2' ' A' ' 43' ' ' ILE . 3.4 m120 -147.25 165.66 29.41 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.632 3.708 . . . . 0.0 112.614 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.3 -149.53 9.89 Favored Glycine 0 C--O 1.203 -1.802 0 CA-C-O 116.619 -2.212 . . . . 0.0 112.693 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.7 t -163.65 41.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 129.236 3.551 . . . . 0.0 105.155 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.594 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.307 0.1 OUTLIER -36.69 103.43 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.816 1 O-C-N 131.45 5.469 . . . . 0.0 112.179 -179.208 . . . . . . . . 5 4 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.41 -51.17 60.49 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.689 2.493 . . . . 0.0 114.884 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.2 ttt 93.41 86.85 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.669 1 O-C-N 129.904 4.503 . . . . 0.0 103.591 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -43.9 -47.54 8.37 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 129.059 3.974 . . . . 0.0 110.802 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -158.33 -179.77 8.41 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 111.214 -2.721 . . . . 0.0 112.111 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -156.22 151.8 27.01 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 17' ' ' PHE . 3.1 mm-40 -93.82 -164.07 1.13 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 108.628 -3.896 . . . . 0.0 110.769 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.412 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 11.3 p30 -30.21 83.69 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 C-N-CA 127.401 2.28 . . . . 0.0 111.85 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.4 ' N ' ' O ' ' A' ' 15' ' ' GLU . 13.3 t80 -69.7 -31.12 68.96 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.342 3.925 . . . . 0.0 107.898 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.514 ' CG ' ' HG3' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -73.69 -49.17 27.11 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 110.649 -2.978 . . . . 0.0 111.48 179.659 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.468 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.57 -22.44 16.98 Favored Glycine 0 CA--C 1.487 -1.7 1 O-C-N 130.425 4.828 . . . . 0.0 113.506 179.784 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -79.72 -38.02 34.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -77.25 -20.59 54.94 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 113.046 -1.888 . . . . 0.0 112.055 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.468 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 2.3 ttmt -73.48 -39.99 64.47 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 110.468 -3.06 . . . . 0.0 111.659 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.53 -40.18 85.05 Favored 'General case' 0 C--O 1.211 -0.933 1 O-C-N 130.429 4.831 . . . . 0.0 111.383 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.442 ' CB ' ' HB ' ' A' ' 26' ' ' ILE 0.322 15.1 mt -70.53 -29.74 66.3 Favored 'General case' 0 C--O 1.208 -1.107 2 O-C-N 130.002 4.564 . . . . 0.0 104.861 -179.885 . . . . . . . . 4 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t0 56.55 43.97 24.83 Favored 'General case' 0 C--O 1.202 -1.425 3 O-C-N 131.696 5.622 . . . . 0.0 103.806 -177.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.48 ' CD1' ' C ' ' A' ' 78' ' ' LEU . 0.5 OUTLIER -70.9 -9.91 13.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 1 CA-C-N 105.665 -5.243 . . . . 0.0 112.592 -178.403 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 50.2 -157.45 0.09 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 109.015 -3.721 . . . . 0.0 114.133 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 1.9 m-30 79.98 -20.38 0.39 Allowed 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 127.956 3.285 . . . . 0.0 115.741 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.449 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . . . 58.25 60.62 2.58 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 103.721 -2.696 . . . . 0.0 103.721 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 34.2 m -127.87 42.76 3.26 Favored 'General case' 0 N--CA 1.475 0.786 2 CA-C-N 105.369 -5.378 . . . . 0.0 115.294 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.514 ' HG3' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.06 -34.69 3.81 Favored 'General case' 0 CA--C 1.499 -1.017 1 O-C-N 129.457 4.223 . . . . 0.0 113.536 -179.629 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.462 ' N ' ' HG2' ' A' ' 31' ' ' ARG 0.258 19.7 tttm -99.11 55.6 1.01 Allowed 'General case' 0 C--N 1.309 -1.158 0 O-C-N 125.762 1.914 . . . . 0.0 107.7 179.809 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.73 -49.77 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.293 2 O-C-N 132.67 6.231 . . . . 0.0 109.732 -179.703 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.551 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -89.57 11.71 18.81 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.511 179.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.2 t -37.15 -46.22 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 O-C-N 125.897 1.998 . . . . 0.0 111.167 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HD2' ' CB ' ' A' ' 39' ' ' GLN . 0.8 OUTLIER 169.13 100.6 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.63 1 O-C-N 130.103 4.627 . . . . 0.0 115.351 -179.991 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.578 ' CD2' ' CD2' ' A' ' 58' ' ' PHE . 1.4 pp -96.71 -8.72 30.69 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 128.329 3.518 . . . . 0.0 107.314 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 m 143.94 112.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.128 1 O-C-N 133.109 6.506 . . . . 0.0 110.282 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.442 ' CB ' ' HD2' ' A' ' 36' ' ' ARG . 61.8 tt0 -127.47 148.2 50.3 Favored 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.619 3.074 . . . . 0.0 115.301 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.417 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 41.7 m -144.46 119.37 9.95 Favored 'General case' 0 C--N 1.318 -0.769 1 O-C-N 131.469 5.481 . . . . 0.0 111.147 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -103.7 107.91 18.97 Favored 'General case' 0 C--N 1.351 0.631 0 O-C-N 127.471 2.982 . . . . 0.0 103.761 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.468 ' CD1' ' HB2' ' A' ' 55' ' ' ASN . 3.9 mp -98.02 158.26 3.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 O-C-N 127.252 2.845 . . . . 0.0 110.699 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.441 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 0.1 OUTLIER -134.77 144.83 33.65 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 110.188 -3.187 . . . . 0.0 109.005 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 56.9 t -149.1 78.85 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.33 0 CA-C-N 111.82 -2.446 . . . . 0.0 111.951 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' A' ' 3' ' ' LYS . 0.8 OUTLIER -77.75 150.48 34.39 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -166.64 91.18 0.42 Allowed 'General case' 0 CA--C 1.498 -1.036 1 O-C-N 129.42 4.2 . . . . 0.0 111.747 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 54.55 -89.48 0.01 OUTLIER Glycine 0 C--N 1.345 1.066 0 CA-C-O 119.833 -0.426 . . . . 0.0 112.523 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -99.55 -39.71 8.19 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 126.796 2.115 . . . . 0.0 116.458 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -85.84 112.98 21.62 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 126.086 2.116 . . . . 0.0 111.975 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.408 ' CE1' HG12 ' A' ' 43' ' ' ILE . 76.8 t80 -112.8 97.98 6.91 Favored 'General case' 0 C--N 1.316 -0.89 1 O-C-N 129.707 4.379 . . . . 0.0 112.315 -179.915 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -117.21 89.36 3.1 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 119.282 3.068 . . . . 0.0 119.282 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.409 HG23 ' HB2' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -76.86 158.42 30.8 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 127.443 2.964 . . . . 0.0 106.691 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.408 ' N ' HG21 ' A' ' 52' ' ' THR . 0.0 OUTLIER -155.31 148.94 25.25 Favored 'General case' 0 CA--C 1.486 -1.482 0 O-C-N 127.654 3.096 . . . . 0.0 109.575 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.2 t -105.4 116.87 32.67 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.652 2.781 . . . . 0.0 107.196 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.468 ' HB2' ' CD1' ' A' ' 42' ' ' ILE . 0.1 OUTLIER -82.31 15.75 2.32 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 117.037 2.236 . . . . 0.0 117.037 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.403 ' O ' ' ND2' ' A' ' 60' ' ' ASN . 0.5 OUTLIER -56.81 155.81 7.35 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 127.356 2.91 . . . . 0.0 109.248 -179.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 p -89.77 -34.2 16.26 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 128.977 3.923 . . . . 0.0 104.01 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.578 ' CD2' ' CD2' ' A' ' 37' ' ' LEU . 1.3 m-85 -57.97 -65.15 0.69 Allowed 'General case' 0 C--O 1.24 0.562 0 O-C-N 126.922 2.639 . . . . 0.0 111.223 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -151.56 110.2 3.82 Favored 'General case' 0 C--N 1.362 1.151 1 CA-C-N 108.24 -4.073 . . . . 0.0 116.726 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.403 ' ND2' ' O ' ' A' ' 56' ' ' SER . 0.0 OUTLIER -111.64 87.75 2.63 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 127.316 2.885 . . . . 0.0 108.934 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.57 -56.46 4.0 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 128.708 3.755 . . . . 0.0 107.377 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 89.6 154.35 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.646 1 O-C-N 132.924 6.39 . . . . 0.0 115.697 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.519 HD12 ' CZ2' ' A' ' 107' ' ' TRP . 11.6 tp -99.34 47.25 0.96 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 111.536 -2.574 . . . . 0.0 112.376 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.83 94.75 1.44 Allowed 'General case' 0 C--O 1.206 -1.205 0 O-C-N 123.903 0.752 . . . . 0.0 109.054 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.499 ' CD2' HG22 ' A' ' 87' ' ' VAL . 0.5 OUTLIER -127.15 178.54 5.96 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-O 127.116 3.341 . . . . 0.0 108.558 -179.681 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -151.53 143.47 23.84 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 112.583 -2.099 . . . . 0.0 105.44 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.488 HG23 ' CD1' ' A' ' 89' ' ' TRP . 1.6 t -70.07 152.12 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 0 O-C-N 127.223 2.827 . . . . 0.0 114.194 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 47.37 37.49 12.07 Favored Glycine 0 N--CA 1.469 0.883 0 CA-C-N 111.238 -2.71 . . . . 0.0 114.373 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.404 HG11 ' N ' ' A' ' 70' ' ' GLU 0.262 9.9 p -98.16 -14.37 7.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.042 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.404 ' N ' HG11 ' A' ' 69' ' ' VAL . 1.3 tt0 55.68 74.14 0.39 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 128.665 3.728 . . . . 0.0 110.884 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.437 ' CD1' ' CE1' ' A' ' 65' ' ' PHE . 6.4 t80 -64.35 70.63 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.903 1 O-C-N 129.745 4.403 . . . . 0.0 113.67 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -51.83 87.59 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.32 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.523 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 40.11 -160.72 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 O-C-N 126.934 2.646 . . . . 0.0 112.924 179.54 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 91.62 90.98 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.341 -2.209 . . . . 0.0 116.436 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.413 ' C ' ' HG2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -148.01 153.66 39.27 Favored 'General case' 0 C--O 1.201 -1.492 0 CA-C-N 111.251 -2.704 . . . . 0.0 112.0 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.413 ' HG2' ' C ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 178.99 136.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.795 1 O-C-N 129.111 4.007 . . . . 0.0 111.271 -179.887 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.47 7.41 42.74 Favored Glycine 0 C--O 1.204 -1.725 0 CA-C-N 111.232 -2.713 . . . . 0.0 109.993 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.48 ' C ' ' CD1' ' A' ' 26' ' ' ILE . 4.0 tp -165.6 36.38 0.06 Allowed 'General case' 0 C--N 1.351 0.648 0 O-C-N 128.439 3.082 . . . . 0.0 116.36 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.465 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 7.6 t0 159.3 -66.54 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.044 2.715 . . . . 0.0 113.189 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.67 78.61 0.82 Allowed Glycine 0 C--O 1.204 -1.719 0 O-C-N 126.097 2.123 . . . . 0.0 110.144 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.27 -146.53 0.15 Allowed 'General case' 0 CA--C 1.494 -1.182 0 O-C-N 129.44 3.671 . . . . 0.0 113.193 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.523 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 15.2 m-20 -163.38 112.91 1.31 Allowed 'General case' 0 C--O 1.202 -1.431 0 CA-C-O 117.471 -1.252 . . . . 0.0 108.934 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.45 ' N ' ' HB2' ' A' ' 73' ' ' GLU . 71.1 t -146.95 131.83 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 N-CA-C 117.833 2.531 . . . . 0.0 117.833 -178.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -60.48 115.56 3.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 110.657 -2.974 . . . . 0.0 107.701 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.418 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 40.8 m -122.4 74.31 1.17 Allowed 'General case' 0 C--O 1.198 -1.656 0 O-C-N 127.915 3.26 . . . . 0.0 115.633 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.438 ' HB3' ' CG2' ' A' ' 97' ' ' VAL . 5.3 tp -67.33 143.44 56.38 Favored 'General case' 0 N--CA 1.437 -1.079 2 CA-C-N 106.037 -5.074 . . . . 0.0 108.908 -179.684 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.499 HG22 ' CD2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -123.34 131.09 73.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 O-C-N 126.402 2.314 . . . . 0.0 107.415 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.333 1.7 m -151.3 159.42 44.33 Favored 'General case' 0 CA--C 1.479 -1.782 0 CA-C-N 113.027 -1.897 . . . . 0.0 109.585 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.667 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 58.8 m95 -87.07 143.66 27.22 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 114.509 -2.662 . . . . 0.0 106.503 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.491 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 11.0 tp10 -90.28 -35.45 15.27 Favored 'General case' 0 CA--C 1.479 -1.752 1 CA-C-O 133.074 6.178 . . . . 0.0 112.469 179.798 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.18 -41.75 0.27 Allowed Glycine 0 C--O 1.206 -1.602 1 CA-C-N 107.009 -4.632 . . . . 0.0 103.2 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.508 ' ND2' ' N ' ' A' ' 92' ' ' ASN . 0.0 OUTLIER -155.65 67.64 0.63 Allowed 'General case' 0 C--O 1.197 -1.69 1 O-C-N 131.267 4.745 . . . . 0.0 107.897 -179.787 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.493 ' C ' ' CZ3' ' A' ' 89' ' ' TRP . 14.6 t 159.18 147.19 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 118.051 2.611 . . . . 0.0 118.051 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.447 ' HB3' ' CG ' ' A' ' 109' ' ' GLN . 0.7 OUTLIER -85.97 82.66 8.04 Favored 'General case' 0 CA--C 1.495 -1.165 1 O-C-N 132.679 6.237 . . . . 0.0 116.816 179.491 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.491 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.343 54.5 t -84.12 135.71 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 CA-C-O 115.558 -2.163 . . . . 0.0 112.663 179.492 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.11 137.77 29.38 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.438 ' CG2' ' HB3' ' A' ' 86' ' ' LEU . 16.4 m -113.14 118.49 58.19 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.996 1 O-C-N 130.098 4.624 . . . . 0.0 117.15 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.416 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 3.7 mm-40 -94.95 99.02 11.12 Favored 'General case' 0 C--O 1.221 -0.416 0 O-C-N 119.373 -2.079 . . . . 0.0 108.766 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.74 77.6 4.26 Favored 'General case' 0 C--O 1.201 -1.47 0 CA-C-N 111.059 -2.791 . . . . 0.0 108.324 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -81.65 -117.98 0.46 Allowed Glycine 0 C--O 1.207 -1.573 0 CA-C-N 112.286 -2.234 . . . . 0.0 112.082 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 174.03 94.62 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.984 -2.108 . . . . 0.0 111.731 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? 128.19 -28.62 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 129.159 2.984 . . . . 0.0 111.772 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.35 174.33 10.73 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 110.091 -3.231 . . . . 0.0 116.552 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -125.38 97.36 5.17 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 113.579 -3.105 . . . . 0.0 105.888 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 122' ' ' CYS 0.285 17.9 mmt180 -91.47 6.76 44.28 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 128.844 3.84 . . . . 0.0 113.809 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.416 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -49.0 97.14 0.01 OUTLIER Glycine 0 CA--C 1.533 1.194 2 O-C-N 133.166 6.541 . . . . 0.0 111.48 179.992 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.519 ' CZ2' HD12 ' A' ' 63' ' ' LEU 0.263 0.0 OUTLIER -104.16 137.92 41.4 Favored 'General case' 0 C--N 1.317 -0.815 1 O-C-N 130.97 4.571 . . . . 0.0 108.55 178.541 . . . . . . . . 5 4 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.65 -179.46 7.63 Favored 'General case' 0 C--O 1.204 -1.302 1 O-C-N 131.853 5.721 . . . . 0.0 115.101 -178.047 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.447 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -139.77 177.37 8.0 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 109.147 -3.661 . . . . 0.0 107.747 -179.835 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.489 ' CD1' ' HB3' ' A' ' 117' ' ' TYR 0.27 0.5 OUTLIER 177.93 100.45 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.642 1 O-C-N 132.694 6.246 . . . . 0.0 115.713 178.637 . . . . . . . . 5 4 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.4 t -46.62 96.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.486 -1.491 0 CA-C-O 126.416 3.008 . . . . 0.0 115.63 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.91 96.7 6.41 Favored 'General case' 0 CA--C 1.484 -1.595 0 CA-C-O 125.221 2.439 . . . . 0.0 115.945 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.76 72.78 0.47 Allowed Glycine 0 N--CA 1.439 -1.141 0 CA-C-N 112.049 -2.341 . . . . 0.0 117.101 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 49.48 63.08 2.3 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 126.587 1.992 . . . . 0.0 116.057 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.518 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.6 OUTLIER 160.63 148.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.667 1 O-C-N 130.003 4.564 . . . . 0.0 109.419 -179.93 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.505 HD22 ' CZ2' ' A' ' 9' ' ' TRP . 1.2 mm? -83.19 -174.82 5.51 Favored 'General case' 0 CA--C 1.495 -1.149 0 O-C-N 127.156 2.785 . . . . 0.0 111.679 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.489 ' HB3' ' CD1' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -155.81 69.53 0.67 Allowed 'General case' 0 C--O 1.203 -1.355 0 O-C-N 128.053 3.346 . . . . 0.0 110.751 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.83 87.24 0.06 Allowed 'General case' 0 CA--C 1.505 -0.767 1 CA-C-N 107.512 -4.404 . . . . 0.0 109.022 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -105.78 97.64 7.44 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 125.644 1.84 . . . . 0.0 111.081 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.74 162.66 12.74 Favored 'General case' 0 C--N 1.365 1.24 0 O-C-N 126.645 2.466 . . . . 0.0 108.406 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.53 160.84 38.91 Favored 'General case' 0 C--O 1.2 -1.518 0 O-C-N 128.372 3.545 . . . . 0.0 105.541 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.44 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -159.11 59.66 0.41 Allowed 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 126.795 3.188 . . . . 0.0 110.185 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.97 -69.97 0.5 Allowed Glycine 0 N--CA 1.435 -1.397 0 CA-C-N 110.282 -3.145 . . . . 0.0 111.075 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -162.45 64.13 0.22 Allowed 'General case' 0 C--O 1.206 -1.228 0 CA-C-N 110.646 -2.777 . . . . 0.0 109.197 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -158.09 36.96 0.25 Allowed 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 111.336 -2.665 . . . . 0.0 105.562 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 7.9 p -35.06 111.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 O-C-N 128.847 3.842 . . . . 0.0 113.792 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.6 t -89.71 119.44 30.12 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 119.352 -2.092 . . . . 0.0 107.577 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -106.55 111.46 24.02 Favored 'General case' 0 N--CA 1.477 0.913 1 O-C-N 129.3 4.125 . . . . 0.0 110.678 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -108.76 164.89 11.98 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 126.175 2.172 . . . . 0.0 112.763 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -127.1 157.19 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 N-CA-C 103.24 -2.874 . . . . 0.0 103.24 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -136.22 173.51 11.63 Favored 'General case' 0 CA--C 1.477 -1.863 0 CA-C-N 108.712 -3.858 . . . . 0.0 117.84 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.321 0.5 OUTLIER -162.17 97.02 1.01 Allowed 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 110.575 -3.011 . . . . 0.0 103.827 -179.621 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.594 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 12.2 pttt -33.39 -44.42 0.14 Allowed 'General case' 0 C--O 1.198 -1.607 1 O-C-N 131.168 5.293 . . . . 0.0 117.521 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.447 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 30.0 ttmt . . . . . 0 CA--C 1.481 -1.698 0 CA-C-O 114.745 -2.55 . . . . 0.0 111.817 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.469 ' HB2' ' CH2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.508 -0.669 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -63.07 104.35 0.56 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 103.443 -2.799 . . . . 0.0 103.443 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -138.4 -177.59 4.92 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 111.684 -2.507 . . . . 0.0 104.96 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -178.54 145.72 0.33 Allowed 'General case' 0 C--O 1.22 -0.482 1 O-C-N 129.499 4.249 . . . . 0.0 111.554 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -176.23 -151.56 8.92 Favored Glycine 0 C--O 1.201 -1.923 0 CA-C-O 115.652 -2.749 . . . . 0.0 115.066 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.438 HG21 ' CB ' ' A' ' 134' ' ' LYS . 5.5 t -167.05 42.73 0.05 OUTLIER 'General case' 0 C--O 1.204 -1.32 1 O-C-N 134.444 6.614 . . . . 0.0 107.791 179.727 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.541 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.2 OUTLIER -34.42 136.74 0.13 Allowed 'General case' 0 C--O 1.242 0.673 1 O-C-N 132.073 5.858 . . . . 0.0 112.024 179.926 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.494 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.4 mt-10 -103.84 53.36 0.75 Allowed 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 117.715 -1.594 . . . . 0.0 110.934 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.421 ' O ' ' N ' ' A' ' 13' ' ' SER . 15.8 ttp -4.92 67.28 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 O-C-N 128.978 3.924 . . . . 0.0 108.957 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.494 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.6 tt0 -12.82 -45.09 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.803 1 O-C-N 133.182 6.551 . . . . 0.0 112.427 -178.518 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 11' ' ' MET . 1.2 t -173.7 161.69 3.95 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 109.524 -3.489 . . . . 0.0 109.886 -179.734 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.414 ' CB ' ' HE2' ' A' ' 11' ' ' MET . 0.4 OUTLIER -116.08 156.61 26.09 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 109.686 -3.416 . . . . 0.0 112.735 -179.827 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -117.77 -56.66 2.18 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 127.067 2.729 . . . . 0.0 110.609 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -116.68 113.41 22.6 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 119.8 -1.812 . . . . 0.0 107.822 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . 0.296 25.0 t80 -115.29 -47.41 2.85 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 127.659 3.6 . . . . 0.0 112.524 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -76.38 -48.75 18.78 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 110.969 -2.832 . . . . 0.0 114.274 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.427 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.4 -21.84 14.09 Favored Glycine 0 CA--C 1.484 -1.869 0 O-C-N 124.982 1.426 . . . . 0.0 113.465 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.465 ' N ' HE21 ' A' ' 125' ' ' GLN . 0.1 OUTLIER -69.14 -48.0 63.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.206 -1.775 . . . . 0.0 106.206 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.7 mtm -70.42 -32.28 69.82 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 111.807 -2.451 . . . . 0.0 112.472 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.427 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -75.68 -23.39 56.21 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 128.569 2.748 . . . . 0.0 114.998 179.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.0 -32.13 50.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 110.226 -3.17 . . . . 0.0 108.804 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . 0.291 3.3 mt -74.03 -23.99 59.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 111.229 -2.714 . . . . 0.0 104.464 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 t70 63.24 58.86 1.35 Allowed 'General case' 0 C--O 1.216 -0.705 1 CA-C-O 128.514 4.006 . . . . 0.0 106.416 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.506 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 1.3 tt -71.72 -47.44 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.983 1 CA-C-N 106.73 -4.759 . . . . 0.0 110.594 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 178.59 123.25 0.05 OUTLIER 'General case' 0 C--N 1.361 1.102 0 CA-C-N 113.981 -1.463 . . . . 0.0 109.231 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -72.65 121.71 20.23 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 117.093 -1.843 . . . . 0.0 114.512 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 78.93 51.65 0.03 OUTLIER 'General case' 0 C--O 1.209 -1.054 0 C-N-CA 126.995 2.118 . . . . 0.0 110.527 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 31' ' ' ARG . 0.4 OUTLIER -87.67 -52.64 5.21 Favored 'General case' 0 C--N 1.355 0.848 2 O-C-N 130.018 4.574 . . . . 0.0 112.001 -179.921 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.25 -138.42 0.01 OUTLIER 'General case' 0 C--O 1.244 0.777 0 CA-C-O 112.437 -3.649 . . . . 0.0 111.92 -179.734 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.453 ' CB ' ' O ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER 98.18 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 O-C-N 128.633 3.708 . . . . 0.0 111.071 -179.864 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -117.44 8.42 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 1 O-C-N 131.057 5.223 . . . . 0.0 110.383 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -116.28 22.04 13.17 Favored 'General case' 0 C--N 1.346 0.429 0 O-C-N 124.735 1.272 . . . . 0.0 107.779 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.4 t -49.77 -36.37 11.15 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.344 0 CA-C-O 123.881 1.801 . . . . 0.0 111.483 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 171.36 128.7 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.828 1 CA-C-N 108.22 -4.082 . . . . 0.0 110.858 179.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.559 ' CD2' ' CE2' ' A' ' 58' ' ' PHE . 1.4 mt -97.74 -50.24 4.53 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 129.038 3.961 . . . . 0.0 104.049 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.3 m -170.23 142.96 2.31 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.727 5.642 . . . . 0.0 112.008 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.469 ' HG2' ' N ' ' A' ' 40' ' ' THR . 0.1 OUTLIER -125.03 150.43 46.76 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 126.074 2.109 . . . . 0.0 114.853 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.469 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 66.2 m 178.23 109.11 0.03 OUTLIER 'General case' 0 N--CA 1.433 -1.287 1 O-C-N 129.478 4.237 . . . . 0.0 111.904 178.815 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.89 152.56 19.63 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 127.928 3.267 . . . . 0.0 105.272 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.425 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 5.1 mp -137.48 157.81 34.3 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.369 0 C-N-CA 117.635 -1.626 . . . . 0.0 110.467 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.47 HG12 ' CE1' ' A' ' 50' ' ' PHE 0.251 3.4 tt -136.43 125.71 38.14 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 2 O-C-N 131.646 5.591 . . . . 0.0 109.07 -179.685 . . . . . . . . 4 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 59.7 t -124.94 102.97 11.61 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 CA-C-N 111.837 -2.438 . . . . 0.0 111.988 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.554 ' CG ' ' CD1' ' A' ' 50' ' ' PHE . 9.6 mt-30 -121.83 89.47 3.13 Favored 'General case' 0 CA--C 1.488 -1.429 0 CA-C-O 125.137 2.399 . . . . 0.0 114.743 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -78.64 -8.41 58.63 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-N 108.788 -3.824 . . . . 0.0 113.006 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.51 -106.8 0.25 Allowed Glycine 0 C--O 1.203 -1.841 0 CA-C-O 123.504 1.613 . . . . 0.0 113.741 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -98.62 -1.19 41.47 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 112.728 -1.736 . . . . 0.0 113.059 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.88 90.25 3.3 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 127.793 3.183 . . . . 0.0 108.907 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.554 ' CD1' ' CG ' ' A' ' 45' ' ' GLN . 6.4 t80 -96.44 103.66 15.58 Favored 'General case' 0 CA--C 1.496 -1.108 0 O-C-N 128.278 3.486 . . . . 0.0 113.305 -179.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.0 73.25 1.01 Allowed 'General case' 0 CA--C 1.496 -1.124 0 O-C-N 128.169 3.418 . . . . 0.0 118.202 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.479 ' CG2' ' N ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -52.28 165.55 0.23 Allowed 'General case' 0 C--N 1.358 0.95 0 CA-C-N 112.221 -2.263 . . . . 0.0 108.87 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.479 ' N ' ' CG2' ' A' ' 52' ' ' THR . 0.0 OUTLIER -170.91 153.31 3.84 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 114.843 -2.743 . . . . 0.0 106.653 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.11 152.34 24.66 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 127.382 2.927 . . . . 0.0 107.847 178.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -104.84 10.44 34.44 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 125.562 1.789 . . . . 0.0 115.258 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.527 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 54.4 m -44.35 152.2 0.21 Allowed 'General case' 0 N--CA 1.477 0.924 1 O-C-N 129.199 4.062 . . . . 0.0 105.513 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.41 HG21 ' HB2' ' A' ' 37' ' ' LEU 0.266 7.3 t -83.51 -35.24 25.0 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-N 111.752 -2.476 . . . . 0.0 110.719 -179.049 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.559 ' CE2' ' CD2' ' A' ' 37' ' ' LEU 0.251 0.0 OUTLIER -60.2 -38.34 83.02 Favored 'General case' 0 C--N 1.366 1.301 0 O-C-N 126.811 2.57 . . . . 0.0 111.524 -179.475 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 168.57 162.43 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.516 1 O-C-N 130.723 5.014 . . . . 0.0 112.05 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -113.38 127.65 56.2 Favored 'General case' 0 C--O 1.209 -1.074 1 O-C-N 130.366 4.791 . . . . 0.0 107.903 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.501 ' CE1' HD21 ' A' ' 78' ' ' LEU . 53.6 t80 -106.38 28.42 7.79 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 126.331 2.269 . . . . 0.0 108.39 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -13.62 112.52 0.02 OUTLIER 'General case' 0 C--O 1.205 -1.257 1 O-C-N 130.287 4.742 . . . . 0.0 117.502 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.533 HD22 ' CE2' ' A' ' 65' ' ' PHE . 9.9 tt -68.16 121.82 16.99 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 127.503 3.002 . . . . 0.0 108.796 177.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -141.02 83.08 1.87 Allowed 'General case' 0 CA--C 1.485 -1.549 0 C-N-CA 113.956 -3.098 . . . . 0.0 112.237 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.533 ' CE2' HD22 ' A' ' 63' ' ' LEU . 5.3 p90 -142.49 167.42 22.14 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 126.076 2.846 . . . . 0.0 110.926 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -119.88 157.3 29.02 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 112.647 -2.069 . . . . 0.0 108.115 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 1.9 t -51.67 141.74 4.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.119 0 O-C-N 127.027 2.705 . . . . 0.0 115.085 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 23.37 47.55 0.01 OUTLIER Glycine 0 CA--C 1.5 -0.875 1 O-C-N 131.501 5.5 . . . . 0.0 117.857 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -97.84 0.12 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 59.03 73.59 0.48 Allowed 'General case' 0 C--N 1.357 0.892 0 O-C-N 128.947 3.904 . . . . 0.0 109.254 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.417 ' HB3' HG23 ' A' ' 85' ' ' THR . 5.3 t80 -67.59 138.14 56.21 Favored 'General case' 0 N--CA 1.451 -0.405 2 O-C-N 129.602 4.314 . . . . 0.0 116.652 -179.801 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -112.79 93.63 4.52 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 113.171 -1.832 . . . . 0.0 110.62 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -72.39 154.21 41.02 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-O 126.517 3.056 . . . . 0.0 109.796 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.509 ' ND1' HD22 ' A' ' 82' ' ' ASN . 0.1 OUTLIER -131.78 74.15 1.57 Allowed 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 108.984 -3.735 . . . . 0.0 109.764 179.911 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 70.3 p -49.85 -79.49 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 114.265 -2.779 . . . . 0.0 116.19 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 13.0 97.32 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.816 1 O-C-N 129.656 4.347 . . . . 0.0 115.782 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 142.01 -29.14 2.22 Favored Glycine 0 C--O 1.213 -1.212 0 CA-C-N 110.345 -3.116 . . . . 0.0 107.666 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.506 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 12.6 tp -141.13 50.01 1.63 Allowed 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 108.481 -3.86 . . . . 0.0 115.395 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.413 ' N ' HD11 ' A' ' 26' ' ' ILE . 5.6 t70 151.73 -67.78 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.893 1.996 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.03 65.28 1.18 Allowed Glycine 0 C--O 1.229 -0.217 0 O-C-N 126.235 2.21 . . . . 0.0 112.818 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.46 ' CG ' ' N ' ' A' ' 82' ' ' ASN 0.267 3.3 tpt180 -139.97 -122.05 0.12 Allowed 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 113.836 -2.983 . . . . 0.0 112.936 -179.721 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.509 HD22 ' ND1' ' A' ' 74' ' ' HIS . 0.3 OUTLIER 156.15 101.81 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 O-C-N 128.299 3.499 . . . . 0.0 108.665 -179.275 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.478 ' CG1' ' HA2' ' A' ' 100' ' ' GLY . 1.9 t -134.33 165.18 32.29 Favored 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 127.043 2.714 . . . . 0.0 117.684 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.24 163.88 27.05 Favored 'General case' 0 C--O 1.218 -0.56 2 O-C-N 133.426 6.704 . . . . 0.0 107.503 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.417 HG23 ' HB3' ' A' ' 71' ' ' PHE . 1.1 m -168.76 98.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.983 1 O-C-N 130.799 5.062 . . . . 0.0 110.152 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.06 93.55 7.44 Favored 'General case' 0 C--O 1.209 -1.043 2 O-C-N 130.911 5.132 . . . . 0.0 116.626 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.502 ' CG2' ' CD1' ' A' ' 65' ' ' PHE . 26.1 t -68.4 131.66 33.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.197 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -157.95 160.77 37.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 124.188 1.947 . . . . 0.0 111.711 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.674 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 70.3 m95 -88.8 142.5 27.61 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 114.649 -2.596 . . . . 0.0 106.708 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -92.76 -60.37 1.83 Allowed 'General case' 0 CA--C 1.48 -1.718 1 CA-C-O 132.477 5.894 . . . . 0.0 113.456 179.552 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.02 61.72 0.03 OUTLIER Glycine 0 CA--C 1.542 1.778 1 CA-C-N 107.84 -4.255 . . . . 0.0 104.428 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.1 m120 92.39 66.08 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.038 1 O-C-N 132.388 5.405 . . . . 0.0 105.701 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.474 HG21 ' CB ' ' A' ' 90' ' ' GLU . 1.9 t 166.21 141.95 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.512 HD23 ' CE2' ' A' ' 50' ' ' PHE . 4.8 tp -86.05 106.5 17.25 Favored 'General case' 0 CA--C 1.487 -1.458 1 O-C-N 131.239 5.337 . . . . 0.0 114.161 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.48 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.376 40.8 t -109.87 148.68 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.014 0 CA-C-N 109.385 -3.552 . . . . 0.0 114.418 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.478 ' SG ' ' CZ3' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -149.22 133.07 17.0 Favored 'General case' 0 C--O 1.219 -0.532 0 O-C-N 125.739 1.899 . . . . 0.0 106.544 179.656 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.8 t -103.11 73.46 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.598 0 CA-C-N 110.133 -3.212 . . . . 0.0 115.256 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.455 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -53.36 101.4 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 122.383 1.087 . . . . 0.0 109.084 179.664 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -95.98 98.23 10.22 Favored 'General case' 0 C--O 1.205 -1.254 0 CA-C-N 109.315 -3.584 . . . . 0.0 112.358 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.478 ' HA2' ' CG1' ' A' ' 83' ' ' VAL . . . -94.19 -136.72 8.32 Favored Glycine 0 C--O 1.212 -1.239 0 O-C-N 127.94 3.275 . . . . 0.0 111.063 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -154.66 -47.39 0.09 Allowed 'General case' 0 CA--C 1.502 -0.891 1 CA-C-N 107.695 -4.252 . . . . 0.0 109.631 179.675 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.412 ' HD3' ' C ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -101.86 3.6 39.4 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 123.408 1.575 . . . . 0.0 115.033 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.78 174.62 13.64 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 110.222 -3.172 . . . . 0.0 117.307 -179.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.2 96.59 5.15 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 108.838 -3.801 . . . . 0.0 101.637 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 12.2 mmm-85 -87.68 -2.41 58.59 Favored 'General case' 0 C--O 1.208 -1.122 1 O-C-N 129.506 4.254 . . . . 0.0 111.593 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.455 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.66 95.52 0.01 OUTLIER Glycine 0 C--O 1.208 -1.501 2 O-C-N 133.719 6.887 . . . . 0.0 115.551 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.517 ' CD1' ' C ' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -110.46 137.69 47.83 Favored 'General case' 0 C--N 1.319 -0.754 1 O-C-N 130.997 4.586 . . . . 0.0 108.242 178.04 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -163.19 177.84 8.72 Favored 'General case' 0 CA--C 1.506 -0.717 1 O-C-N 130.454 4.846 . . . . 0.0 111.403 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.503 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 1.1 mp0 -139.71 -174.33 3.87 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 113.849 -2.977 . . . . 0.0 108.133 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.431 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.2 OUTLIER 179.4 89.17 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.235 1 O-C-N 130.377 4.798 . . . . 0.0 117.683 178.961 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . 0.25 70.3 t -34.71 104.57 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-O 125.051 2.358 . . . . 0.0 112.187 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.572 ' HG2' ' CD2' ' A' ' 117' ' ' TYR . 0.7 OUTLIER -107.29 28.87 7.66 Favored 'General case' 0 CA--C 1.478 -1.811 0 CA-C-N 111.534 -2.575 . . . . 0.0 117.81 -179.633 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.42 95.36 0.84 Allowed Glycine 0 C--O 1.21 -1.392 0 O-C-N 119.576 -1.952 . . . . 0.0 117.944 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 61.83 35.03 16.77 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 165.19 154.91 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.153 1 O-C-N 130.729 5.018 . . . . 0.0 110.015 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.503 ' CD2' ' HB3' ' A' ' 109' ' ' GLN . 1.1 mt -91.69 -172.75 3.32 Favored 'General case' 0 CA--C 1.484 -1.575 0 O-C-N 127.378 2.924 . . . . 0.0 112.399 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.572 ' CD2' ' HG2' ' A' ' 112' ' ' GLU . 0.0 OUTLIER -150.46 83.86 1.36 Allowed 'General case' 0 C--N 1.362 1.142 0 CA-C-N 111.659 -2.519 . . . . 0.0 113.182 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.515 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -73.33 88.14 1.54 Allowed 'General case' 0 N--CA 1.475 0.778 2 CA-C-N 107.989 -4.187 . . . . 0.0 109.562 -179.894 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -100.47 102.34 13.5 Favored 'General case' 0 CA--C 1.499 -0.985 0 O-C-N 128.863 3.852 . . . . 0.0 109.803 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.417 ' HB2' ' CB ' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -121.52 155.27 35.33 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 128.136 3.397 . . . . 0.0 109.347 -179.847 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.1 t -133.59 154.76 50.63 Favored 'General case' 0 C--N 1.311 -1.103 1 O-C-N 129.56 4.288 . . . . 0.0 104.759 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . 0.273 2.8 m -139.43 39.78 2.06 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.887 1.327 . . . . 0.0 110.962 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 132.93 -57.51 0.71 Allowed Glycine 0 CA--C 1.526 0.781 0 CA-C-N 111.696 -2.502 . . . . 0.0 108.526 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -172.77 49.64 0.02 OUTLIER 'General case' 0 CA--C 1.491 -1.294 0 CA-C-N 109.845 -3.177 . . . . 0.0 106.955 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.465 HE21 ' N ' ' A' ' 20' ' ' TYR . 1.4 tm0? -103.38 -22.93 13.6 Favored 'General case' 0 C--O 1.208 -1.122 0 C-N-CA 116.666 -2.014 . . . . 0.0 110.369 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 11.8 p 27.1 63.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 CA-C-O 125.297 2.475 . . . . 0.0 117.11 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.412 ' N ' ' O ' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -57.71 149.29 22.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 118.923 -2.361 . . . . 0.0 108.191 -179.691 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -135.09 87.71 2.36 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 128.181 3.426 . . . . 0.0 111.002 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -83.02 164.52 20.3 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.42 139.45 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 123.963 1.839 . . . . 0.0 106.078 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.515 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 39.6 m-85 -123.02 179.66 4.59 Favored 'General case' 0 CA--C 1.492 -1.263 0 CA-C-O 126.716 3.15 . . . . 0.0 117.42 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.415 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.297 0.0 OUTLIER -165.76 122.41 1.39 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 109.903 -3.317 . . . . 0.0 104.473 -179.936 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.541 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 19.7 ttpt -71.6 57.35 0.28 Allowed 'General case' 0 C--O 1.202 -1.445 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.438 ' CB ' HG21 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.796 0 N-CA-C 117.976 2.584 . . . . 0.0 117.976 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.493 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 17.0 mttt . . . . . 0 N--CA 1.446 -0.664 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.71 104.53 5.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 104.006 -2.59 . . . . 0.0 104.006 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . 0.262 7.7 mt-30 -139.39 145.75 39.33 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 103.616 -2.735 . . . . 0.0 103.616 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 156.7 126.16 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.919 1 O-C-N 131.571 5.545 . . . . 0.0 112.108 179.944 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 150.48 -169.91 30.39 Favored Glycine 0 C--O 1.2 -1.97 0 O-C-N 127.054 2.721 . . . . 0.0 110.224 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.45 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -129.57 145.08 51.51 Favored 'General case' 0 C--N 1.318 -0.8 1 O-C-N 131.963 5.155 . . . . 0.0 107.664 -179.962 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.573 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -138.04 109.2 6.82 Favored 'General case' 0 CA--C 1.498 -1.028 1 O-C-N 131.199 5.312 . . . . 0.0 112.177 -179.773 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -56.02 -15.25 3.28 Favored 'General case' 0 C--N 1.316 -0.863 0 O-C-N 126.828 2.58 . . . . 0.0 115.415 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.9 ttp 59.02 81.49 0.16 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -35.27 -43.95 0.25 Allowed 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 128.879 3.862 . . . . 0.0 110.993 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.268 4.8 p -157.97 162.76 38.23 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 112.046 -2.343 . . . . 0.0 111.535 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -132.3 124.8 29.56 Favored 'General case' 0 CA--C 1.482 -1.664 1 CA-C-N 107.898 -4.228 . . . . 0.0 112.223 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.33 -149.42 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 128.173 3.42 . . . . 0.0 107.65 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -44.61 139.47 2.86 Favored 'General case' 0 C--O 1.2 -1.514 0 CA-C-N 119.551 1.069 . . . . 0.0 112.815 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -126.75 -44.27 1.67 Allowed 'General case' 0 C--O 1.197 -1.669 0 CA-C-O 125.695 2.664 . . . . 0.0 111.648 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.66 -22.17 47.2 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-N 111.348 -2.66 . . . . 0.0 115.542 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.81 -31.03 62.84 Favored Glycine 0 N--CA 1.474 1.21 0 O-C-N 128.129 3.393 . . . . 0.0 108.29 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.404 ' CD1' ' C ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -70.12 -34.32 72.95 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-O 124.7 2.191 . . . . 0.0 108.958 -179.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.442 ' HE2' ' CG2' ' A' ' 30' ' ' THR . 2.1 mtm -73.16 -24.09 60.52 Favored 'General case' 0 CA--C 1.484 -1.568 0 C-N-CA 114.749 -2.78 . . . . 0.0 113.765 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -78.33 -24.33 46.61 Favored 'General case' 0 CA--C 1.538 0.512 1 O-C-N 132.184 5.928 . . . . 0.0 110.585 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.38 -32.18 73.69 Favored 'General case' 0 C--O 1.202 -1.406 1 O-C-N 130.664 4.978 . . . . 0.0 112.857 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.419 ' CD1' ' HB ' ' A' ' 26' ' ' ILE . 0.7 OUTLIER -118.56 19.93 13.13 Favored 'General case' 0 N--CA 1.472 0.634 1 O-C-N 129.411 4.194 . . . . 0.0 107.42 179.648 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.35 -64.03 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 128.37 3.544 . . . . 0.0 112.675 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.419 ' HB ' ' CD1' ' A' ' 24' ' ' LEU . 8.3 tt 36.65 34.42 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.828 1 CA-C-O 129.095 4.283 . . . . 0.0 113.768 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.88 175.08 0.13 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 109.415 -3.539 . . . . 0.0 111.786 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -112.65 168.78 9.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 113.703 -1.589 . . . . 0.0 113.476 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 83.71 103.37 0.05 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.442 ' CG2' ' HE2' ' A' ' 21' ' ' MET . 0.8 OUTLIER 176.81 -45.63 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.394 2.934 . . . . 0.0 112.625 -179.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.25 -9.37 0.16 Allowed 'General case' 0 CA--C 1.497 -1.074 0 C-N-CA 129.698 3.199 . . . . 0.0 114.458 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -31.47 27.36 Favored 'General case' 0 CA--C 1.482 -1.668 0 C-N-CA 117.212 -1.795 . . . . 0.0 114.365 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.441 ' CD1' ' N ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -135.11 15.26 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.913 1 O-C-N 129.45 4.219 . . . . 0.0 114.877 -179.925 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -114.94 12.47 16.82 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 118.919 -1.113 . . . . 0.0 112.469 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.4 t -52.7 -39.18 29.58 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.527 0 CA-C-O 122.888 1.328 . . . . 0.0 111.983 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.43 ' HD3' ' HB3' ' A' ' 39' ' ' GLN . 1.0 OUTLIER 173.93 131.74 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 108.493 -3.958 . . . . 0.0 111.178 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.547 ' CD2' ' N ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -101.68 -60.56 1.51 Allowed 'General case' 0 N--CA 1.435 -1.194 1 O-C-N 129.676 4.36 . . . . 0.0 105.798 -179.523 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.1 m -153.23 36.63 0.47 Allowed 'General case' 0 CA--C 1.489 -1.399 1 O-C-N 131.102 5.251 . . . . 0.0 112.032 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.43 ' HB3' ' HD3' ' A' ' 36' ' ' ARG . 6.7 tt0 -63.59 118.22 7.9 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 116.355 1.983 . . . . 0.0 116.355 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 m -121.99 132.61 54.62 Favored 'General case' 0 C--O 1.204 -1.306 1 O-C-N 129.246 4.091 . . . . 0.0 110.183 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -107.87 141.4 39.52 Favored 'General case' 0 N--CA 1.475 0.811 1 O-C-N 129.372 4.17 . . . . 0.0 107.497 -179.84 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.479 HD12 ' CD ' ' A' ' 53' ' ' LYS . 2.9 mp -132.46 155.44 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 O-C-N 126.788 2.555 . . . . 0.0 110.776 179.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.47 HG13 ' CE1' ' A' ' 50' ' ' PHE . 13.4 tt -132.94 129.02 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.543 0 CA-C-O 126.139 2.876 . . . . 0.0 109.46 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.0 t -124.56 48.46 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.372 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -55.97 108.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.563 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -123.64 14.29 9.42 Favored 'General case' 0 CA--C 1.476 -1.877 1 O-C-N 129.532 4.27 . . . . 0.0 117.751 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.32 103.28 2.71 Favored Glycine 0 C--O 1.214 -1.156 0 C-N-CA 119.282 -1.437 . . . . 0.0 112.153 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 73.09 -65.47 0.35 Allowed 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 127.821 2.719 . . . . 0.0 112.072 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -96.81 86.72 4.11 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 129.054 3.971 . . . . 0.0 109.818 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 1.7 t80 -98.1 109.91 22.59 Favored 'General case' 0 N--CA 1.475 0.8 1 O-C-N 130.39 4.806 . . . . 0.0 110.999 -179.869 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.452 ' CB ' ' HA ' ' A' ' 64' ' ' ASP . 6.0 mttm -120.25 99.46 6.6 Favored 'General case' 0 CA--C 1.487 -1.477 1 O-C-N 129.885 4.49 . . . . 0.0 119.933 -179.227 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.465 ' CG2' ' N ' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -72.71 173.62 8.78 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 126.921 2.638 . . . . 0.0 106.506 178.224 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.479 ' CD ' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -172.53 145.64 1.62 Allowed 'General case' 0 CA--C 1.488 -1.423 0 C-N-CA 115.975 -2.29 . . . . 0.0 111.515 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.403 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 1.3 t -98.13 126.82 43.75 Favored 'General case' 0 CA--C 1.496 -1.104 0 O-C-N 128.209 3.443 . . . . 0.0 109.68 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -96.76 35.11 1.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.88 110.11 14.94 Favored 'General case' 0 N--CA 1.473 0.687 1 O-C-N 130.187 4.68 . . . . 0.0 105.176 179.642 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.47 -36.97 46.58 Favored 'General case' 0 C--O 1.209 -1.027 1 O-C-N 129.759 4.412 . . . . 0.0 108.407 -179.638 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.49 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 1.2 p90 -74.63 -23.83 58.75 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -173.77 100.76 0.11 Allowed 'General case' 0 C--O 1.21 -0.993 1 O-C-N 131.417 5.448 . . . . 0.0 116.389 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.403 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 0.0 OUTLIER -107.52 89.79 3.1 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 108.802 -3.817 . . . . 0.0 105.718 -179.771 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -77.36 -29.08 53.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.37 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 t0 69.16 131.5 0.03 OUTLIER 'General case' 0 CA--C 1.499 -0.993 0 O-C-N 127.435 2.959 . . . . 0.0 112.902 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.463 ' HB3' ' CB ' ' A' ' 52' ' ' THR . 3.9 tp -100.32 58.93 0.98 Allowed 'General case' 0 C--O 1.214 -0.805 0 O-C-N 125.102 1.501 . . . . 0.0 109.868 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.452 ' HA ' ' CB ' ' A' ' 51' ' ' LYS . 15.8 p-10 -99.43 98.66 9.55 Favored 'General case' 0 C--O 1.203 -1.388 0 O-C-N 126.911 2.632 . . . . 0.0 112.89 -178.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.527 ' CE2' ' CZ2' ' A' ' 107' ' ' TRP . 6.8 p90 -132.73 -179.16 5.29 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 124.031 1.872 . . . . 0.0 106.396 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.469 ' CB ' HG22 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -129.87 155.72 45.54 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 104.165 -2.532 . . . . 0.0 104.165 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 p -78.77 135.12 26.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.072 0 O-C-N 126.775 2.547 . . . . 0.0 114.344 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 23.59 75.97 Favored Glycine 0 N--CA 1.488 2.129 0 C-N-CA 116.372 -2.823 . . . . 0.0 116.103 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.469 HG22 ' CB ' ' A' ' 66' ' ' THR . 3.0 t -73.28 -25.16 21.11 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.89 74.59 0.4 Allowed 'General case' 0 C--N 1.364 1.203 1 O-C-N 130.458 4.848 . . . . 0.0 109.509 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.443 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 4.4 m-85 -43.83 147.47 0.46 Allowed 'General case' 0 CA--C 1.503 -0.865 0 O-C-N 128.277 3.485 . . . . 0.0 118.324 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -107.63 56.31 0.64 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 115.995 -1.955 . . . . 0.0 112.491 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.604 ' CB ' ' CA ' ' A' ' 83' ' ' VAL . 0.6 OUTLIER 19.16 84.47 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.813 1 CA-C-O 129.267 4.365 . . . . 0.0 114.544 179.765 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.405 ' C ' ' HB2' ' A' ' 82' ' ' ASN . 47.1 t60 -169.7 125.69 0.85 Allowed 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 109.518 -3.492 . . . . 0.0 118.057 178.131 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.484 ' CG2' ' ND2' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -161.64 168.82 22.73 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.143 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.46 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -152.91 161.89 41.98 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 125.652 2.644 . . . . 0.0 114.514 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.83 -7.1 82.33 Favored Glycine 0 C--O 1.217 -0.91 0 CA-C-N 111.155 -2.748 . . . . 0.0 113.475 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 tp -123.67 -63.88 1.19 Allowed 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -118.78 -58.15 1.98 Allowed 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 113.762 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.58 64.26 0.59 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 127.715 2.578 . . . . 0.0 110.949 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ttm105 151.64 146.38 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 O-C-N 128.556 3.151 . . . . 0.0 109.142 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.484 ' ND2' ' CG2' ' A' ' 75' ' ' THR . 1.1 t-20 -132.45 5.89 4.08 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.676 -178.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.604 ' CA ' ' CB ' ' A' ' 73' ' ' GLU 0.32 16.2 t 49.49 178.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 1 O-C-N 130.199 4.687 . . . . 0.0 116.177 -178.936 . . . . . . . . 4 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.418 ' N ' ' CG1' ' A' ' 83' ' ' VAL . 0.0 OUTLIER -76.85 82.2 3.43 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 124.193 1.949 . . . . 0.0 106.71 177.929 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.443 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 83.6 m -93.09 69.14 4.41 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 109.305 -3.589 . . . . 0.0 117.209 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.6 150.89 43.1 Favored 'General case' 0 N--CA 1.432 -1.366 2 CA-C-N 106.631 -4.804 . . . . 0.0 110.338 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.7 t -130.58 143.02 42.19 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.108 0 C-N-CA 124.374 1.07 . . . . 0.0 109.308 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.1 173.47 14.3 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-O 125.854 2.74 . . . . 0.0 111.848 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.661 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 60.1 m95 -92.78 154.02 18.54 Favored 'General case' 0 CA--C 1.508 -0.672 0 C-N-CA 128.537 2.735 . . . . 0.0 106.473 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.477 ' HG3' ' CG2' ' A' ' 95' ' ' VAL . 0.3 OUTLIER -111.13 -52.23 2.8 Favored 'General case' 0 CA--C 1.485 -1.533 1 CA-C-O 129.735 4.588 . . . . 0.0 115.976 179.588 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 156.91 84.82 0.05 OUTLIER Glycine 0 C--O 1.196 -2.248 2 N-CA-C 101.829 -4.508 . . . . 0.0 101.829 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.4 p30 67.37 46.15 1.48 Allowed 'General case' 0 C--O 1.216 -0.67 1 O-C-N 136.371 7.748 . . . . 0.0 110.211 -179.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.473 HG21 ' CB ' ' A' ' 90' ' ' GLU . 0.5 OUTLIER -179.19 157.36 0.82 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 179.379 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.506 ' HB3' ' CG ' ' A' ' 109' ' ' GLN . 1.6 tp -87.68 136.57 32.9 Favored 'General case' 0 CA--C 1.477 -1.863 1 O-C-N 130.898 5.124 . . . . 0.0 114.044 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.477 ' CG2' ' HG3' ' A' ' 90' ' ' GLU 0.361 54.8 t -144.64 134.49 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.114 0 CA-C-N 112.387 -2.188 . . . . 0.0 116.737 179.738 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -136.67 148.94 47.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.844 2.59 . . . . 0.0 104.394 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.3 t -125.93 83.23 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.937 0 N-CA-C 118.224 2.675 . . . . 0.0 118.224 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.401 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 2.6 mt-30 -58.3 105.17 0.26 Allowed 'General case' 0 C--N 1.359 0.987 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.421 ' N ' HG13 ' A' ' 83' ' ' VAL . 2.4 tptt -139.08 86.83 2.16 Favored 'General case' 0 C--O 1.203 -1.392 0 O-C-N 128.775 3.797 . . . . 0.0 114.669 -177.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.437 ' N ' HG11 ' A' ' 83' ' ' VAL . . . -149.7 -66.63 0.01 OUTLIER Glycine 0 C--N 1.342 0.892 0 CA-C-O 125.827 2.904 . . . . 0.0 109.367 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.81 169.8 9.61 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 108.682 -3.759 . . . . 0.0 112.222 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.43 -63.84 0.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 127.551 3.032 . . . . 0.0 114.868 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -59.7 145.56 44.52 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 111.21 -2.723 . . . . 0.0 117.714 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -111.24 87.74 2.62 Favored 'General case' 0 N--CA 1.49 1.56 1 CA-C-N 107.869 -4.241 . . . . 0.0 101.756 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.42 ' HD3' ' HA ' ' A' ' 122' ' ' CYS . 1.3 mmm180 -104.91 3.72 31.15 Favored 'General case' 0 C--O 1.199 -1.591 1 O-C-N 132.227 5.955 . . . . 0.0 113.198 -179.117 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.401 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -55.13 107.91 0.86 Allowed Glycine 0 N--CA 1.426 -2.002 2 CA-C-N 106.192 -5.004 . . . . 0.0 114.896 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.527 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE 0.262 0.0 OUTLIER -96.56 148.55 22.72 Favored 'General case' 0 C--O 1.207 -1.172 0 O-C-N 128.266 2.98 . . . . 0.0 110.38 179.344 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.453 ' N ' ' CD1' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -163.51 176.91 9.28 Favored 'General case' 0 C--O 1.2 -1.509 1 O-C-N 129.106 4.004 . . . . 0.0 113.423 -178.82 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.506 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -147.2 175.6 10.62 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.845 -2.434 . . . . 0.0 108.95 -179.48 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.462 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.1 OUTLIER -172.28 39.5 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.01 1 O-C-N 129.172 4.045 . . . . 0.0 117.816 179.863 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . 0.255 12.8 t 6.92 82.66 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.227 0 C-N-CA 127.55 2.34 . . . . 0.0 115.009 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -84.03 32.14 0.49 Allowed 'General case' 0 CA--C 1.488 -1.419 0 N-CA-C 117.205 2.298 . . . . 0.0 117.205 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 93.56 105.52 1.77 Allowed Glycine 0 C--O 1.21 -1.399 0 N-CA-C 117.409 1.724 . . . . 0.0 117.409 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 1.4 m-20 58.04 15.93 3.48 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 118.66 2.837 . . . . 0.0 118.66 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.447 ' HE2' ' CE1' ' A' ' 117' ' ' TYR . 0.0 OUTLIER -167.58 156.35 9.66 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 129.04 3.963 . . . . 0.0 110.13 -179.634 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.97 106.32 14.98 Favored 'General case' 0 CA--C 1.482 -1.646 0 O-C-N 128.254 3.471 . . . . 0.0 117.574 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.447 ' CE1' ' HE2' ' A' ' 115' ' ' LYS . 1.2 m-85 -66.34 99.54 0.56 Allowed 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 116.238 -2.185 . . . . 0.0 115.985 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.08 70.8 8.44 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 114.881 -2.727 . . . . 0.0 106.498 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -83.93 111.86 19.63 Favored 'General case' 0 CA--C 1.502 -0.901 0 O-C-N 127.488 2.993 . . . . 0.0 111.268 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.75 156.21 43.9 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 128.651 3.72 . . . . 0.0 110.952 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 59.4 m -112.24 160.26 17.79 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 126.951 2.657 . . . . 0.0 105.438 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 1.9 m -146.18 25.52 1.25 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 120.411 1.46 . . . . 0.0 112.799 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 106.68 29.37 4.72 Favored Glycine 0 N--CA 1.437 -1.235 0 O-C-N 125.834 1.959 . . . . 0.0 114.49 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 126.39 -31.18 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 130.169 3.387 . . . . 0.0 110.996 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -79.15 81.97 5.36 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 128.132 3.395 . . . . 0.0 111.653 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 39.1 t -68.34 94.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-N 110.068 -3.242 . . . . 0.0 111.489 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.1 m -72.75 106.12 4.6 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 116.289 -1.815 . . . . 0.0 109.884 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.9 75.98 4.19 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 128.309 3.505 . . . . 0.0 112.917 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -56.54 146.7 24.14 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 115.573 -2.156 . . . . 0.0 110.442 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.2 t -122.63 100.63 8.49 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.403 ' CD2' ' HB2' ' A' ' 9' ' ' TRP . 6.0 m-85 -75.93 176.18 8.11 Favored 'General case' 0 CA--C 1.48 -1.748 0 CA-C-N 109.753 -3.385 . . . . 0.0 116.878 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.419 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.411 0.0 OUTLIER -171.05 110.14 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 110.393 -3.094 . . . . 0.0 103.747 179.795 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.552 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 32.3 ttpt -49.58 127.78 16.28 Favored 'General case' 0 C--O 1.218 -0.576 1 O-C-N 130.149 4.655 . . . . 0.0 110.588 179.476 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 37.7 pttt . . . . . 0 CA--C 1.491 -1.322 0 O-C-N 126.903 2.627 . . . . 0.0 117.545 -179.561 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.501 ' HD3' ' CH2' ' A' ' 89' ' ' TRP . 1.1 ptpt . . . . . 0 CA--C 1.496 -1.112 0 N-CA-C 117.84 2.533 . . . . 0.0 117.84 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.27 116.43 31.93 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 102.848 -3.019 . . . . 0.0 102.848 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -133.13 -102.41 0.26 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 115.229 -2.32 . . . . 0.0 109.331 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 m120 35.38 41.4 0.09 Allowed 'General case' 0 C--N 1.307 -1.272 0 O-C-N 127.957 3.286 . . . . 0.0 114.427 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -101.43 -120.09 4.61 Favored Glycine 0 C--O 1.204 -1.766 0 CA-C-O 115.524 -2.82 . . . . 0.0 112.174 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.42 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 2.2 m 170.13 147.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.664 1 O-C-N 131.14 4.67 . . . . 0.0 104.132 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.593 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -142.68 91.68 2.33 Favored 'General case' 0 C--N 1.323 -0.577 1 O-C-N 133.422 6.701 . . . . 0.0 116.937 179.935 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.405 ' HB2' ' HE2' ' A' ' 132' ' ' LYS . 10.6 mt-10 -61.66 111.87 2.01 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 116.321 -2.151 . . . . 0.0 107.945 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 37.0 ttp -61.4 74.24 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.715 0 O-C-N 127.096 2.748 . . . . 0.0 106.733 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.402 ' N ' ' O ' ' A' ' 10' ' ' GLU . 1.7 tt0 -23.67 -47.28 0.01 OUTLIER 'General case' 0 C--O 1.2 -1.502 0 O-C-N 128.285 3.491 . . . . 0.0 111.749 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.262 0.3 OUTLIER -145.08 152.2 39.72 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 109.013 -3.721 . . . . 0.0 111.573 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -116.31 104.46 11.51 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-N 109.716 -3.402 . . . . 0.0 112.976 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -50.85 31.82 Favored 'General case' 0 CA--C 1.503 -0.846 1 O-C-N 130.107 4.629 . . . . 0.0 112.364 179.892 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.465 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -161.05 150.34 16.78 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-O 125.239 2.447 . . . . 0.0 110.421 -179.797 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.51 ' CD1' ' N ' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -121.77 -58.15 1.76 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 124.926 2.298 . . . . 0.0 110.02 179.706 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 19' ' ' GLY . 9.2 pt-20 -71.32 -28.55 64.17 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 113.756 -1.566 . . . . 0.0 114.537 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.465 ' N ' ' OD1' ' A' ' 16' ' ' ASN . . . -70.71 -23.27 77.95 Favored Glycine 0 N--CA 1.488 2.148 0 O-C-N 128.549 3.656 . . . . 0.0 109.374 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -75.38 -28.28 59.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 119.049 1.425 . . . . 0.0 108.751 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.425 ' HG2' HG23 ' A' ' 26' ' ' ILE . 21.9 mtt -76.95 -33.3 57.69 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-N 113.245 -1.798 . . . . 0.0 107.838 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.475 ' HA ' ' CE ' ' A' ' 22' ' ' LYS . 4.7 mmpt? -68.59 -30.04 68.7 Favored 'General case' 0 C--O 1.203 -1.363 0 O-C-N 128.558 3.661 . . . . 0.0 114.159 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.48 -39.17 65.1 Favored 'General case' 0 C--O 1.208 -1.114 2 O-C-N 130.994 5.184 . . . . 0.0 114.773 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.7 0.24 30.33 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 127.627 3.079 . . . . 0.0 108.314 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 40.06 98.53 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.251 1 CA-C-O 129.32 4.39 . . . . 0.0 109.804 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.425 HG23 ' HG2' ' A' ' 21' ' ' MET . 6.4 tp -127.09 -45.01 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.108 0 CA-C-N 109.637 -3.438 . . . . 0.0 113.137 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.432 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 0.5 OUTLIER -151.07 142.91 23.83 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 119.119 -2.238 . . . . 0.0 108.849 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -80.95 65.33 6.05 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 72.19 73.47 0.16 Allowed 'General case' 0 C--O 1.203 -1.35 0 O-C-N 127.331 2.894 . . . . 0.0 107.848 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.432 ' HB ' ' HB3' ' A' ' 27' ' ' ASP . 0.4 OUTLIER -73.15 -40.96 64.44 Favored 'General case' 0 N--CA 1.479 1.023 1 CA-C-N 106.658 -4.792 . . . . 0.0 114.141 179.874 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -120.55 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.019 1 O-C-N 130.317 4.76 . . . . 0.0 112.636 -179.827 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.23 9.5 2.14 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 129.021 3.951 . . . . 0.0 108.335 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.7 mp -142.17 -49.51 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 111.415 -2.63 . . . . 0.0 108.175 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.53 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -93.2 35.29 1.08 Allowed 'General case' 0 C--O 1.205 -1.264 0 CA-C-O 122.228 1.013 . . . . 0.0 111.877 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.457 HG11 ' CZ ' ' A' ' 17' ' ' PHE . 55.0 t -50.47 -34.95 12.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.705 0 C-N-CA 127.48 2.312 . . . . 0.0 115.897 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 153.74 122.82 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 1 O-C-N 129.394 4.184 . . . . 0.0 111.487 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.548 ' HG ' ' CD2' ' A' ' 58' ' ' PHE . 1.3 pp -106.27 -11.52 16.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 113.937 -2.935 . . . . 0.0 110.87 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.3 m 145.96 98.85 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.082 1 O-C-N 134.132 7.145 . . . . 0.0 111.039 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.96 114.78 26.99 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 127.089 2.743 . . . . 0.0 117.562 -179.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 m -106.43 112.14 25.02 Favored 'General case' 0 C--O 1.209 -1.061 1 O-C-N 130.522 4.889 . . . . 0.0 110.824 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.432 ' HG3' HD11 ' A' ' 118' ' ' LEU . 2.4 tmtt? -105.55 119.94 40.38 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 127.908 3.255 . . . . 0.0 107.593 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.459 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 2.7 mp -109.86 159.93 9.18 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 128.645 3.715 . . . . 0.0 111.625 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.459 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.307 1.0 OUTLIER -132.37 146.83 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-N 109.443 -3.526 . . . . 0.0 106.898 179.668 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 55.8 t -156.88 113.66 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.34 0 O-C-N 126.389 2.305 . . . . 0.0 110.428 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.513 ' HG2' ' CD2' ' A' ' 50' ' ' PHE . 1.1 mt-30 -114.73 134.37 55.15 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-O 125.159 2.409 . . . . 0.0 112.88 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -130.04 40.84 3.5 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 108.445 -3.979 . . . . 0.0 110.741 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.0 114.76 0.02 OUTLIER Glycine 0 C--N 1.349 1.304 0 CA-C-N 112.525 -2.125 . . . . 0.0 110.646 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 73.5 -68.9 0.2 Allowed 'General case' 0 C--O 1.217 -0.612 0 O-C-N 126.796 2.115 . . . . 0.0 111.735 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -78.85 92.96 4.92 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.754 1.622 . . . . 0.0 109.934 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.528 ' CE1' HD21 ' A' ' 94' ' ' LEU . 44.8 t80 -98.18 117.59 32.89 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.006 5.191 . . . . 0.0 111.259 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -130.35 86.76 2.42 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 128.236 3.46 . . . . 0.0 117.713 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.77 153.19 44.22 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 128.181 3.426 . . . . 0.0 106.725 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.447 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -156.33 147.1 21.89 Favored 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 128.007 3.317 . . . . 0.0 108.294 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.407 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 1.0 OUTLIER -108.83 151.9 25.61 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 127.001 2.688 . . . . 0.0 107.756 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -134.79 52.51 2.04 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.62 -92.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 1 O-C-N 131.859 5.724 . . . . 0.0 110.315 179.845 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 m 148.15 -53.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.448 1 O-C-N 130.795 5.06 . . . . 0.0 102.288 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.548 ' CD2' ' HG ' ' A' ' 37' ' ' LEU . 3.0 m-85 -51.42 -58.77 5.34 Favored 'General case' 0 N--CA 1.474 0.771 1 O-C-N 130.725 5.016 . . . . 0.0 108.231 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -154.47 111.12 3.3 Favored 'General case' 0 C--N 1.364 1.232 1 CA-C-N 106.952 -4.658 . . . . 0.0 113.823 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.407 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 0.0 OUTLIER -105.39 97.84 7.62 Favored 'General case' 0 C--O 1.218 -0.566 1 O-C-N 130.565 4.916 . . . . 0.0 110.329 179.89 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.0 89.91 3.21 Favored 'General case' 0 C--N 1.318 -0.763 1 O-C-N 129.36 4.163 . . . . 0.0 105.899 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.447 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 21.8 p30 -84.11 165.19 18.7 Favored 'General case' 0 C--O 1.199 -1.579 1 O-C-N 130.688 4.993 . . . . 0.0 115.987 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.529 ' HG ' ' CZ ' ' A' ' 65' ' ' PHE . 10.8 tp -100.58 54.06 0.87 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 111.43 -2.623 . . . . 0.0 112.268 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.41 100.12 12.79 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 124.266 1.984 . . . . 0.0 112.771 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.529 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -151.0 -137.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 112.774 -2.012 . . . . 0.0 110.47 179.478 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.401 HG21 ' N ' ' A' ' 67' ' ' VAL . 1.6 m -156.14 153.44 29.31 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.401 ' N ' HG21 ' A' ' 66' ' ' THR . 3.4 t -76.32 151.91 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.313 0 O-C-N 125.194 1.559 . . . . 0.0 113.81 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 43.64 30.21 1.44 Allowed Glycine 0 C--O 1.215 -1.08 1 O-C-N 130.663 4.977 . . . . 0.0 115.241 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.266 0.8 OUTLIER -102.54 -5.52 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 112.679 -1.761 . . . . 0.0 109.829 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 66.37 99.45 0.05 OUTLIER 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 127.138 2.774 . . . . 0.0 111.78 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -83.38 95.48 8.23 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 127.417 2.948 . . . . 0.0 118.591 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 36.3 p-10 -74.21 76.33 1.8 Allowed 'General case' 0 C--O 1.202 -1.437 0 CA-C-O 123.991 1.853 . . . . 0.0 109.238 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -48.4 128.71 15.02 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 125.044 2.354 . . . . 0.0 113.747 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.32 49.66 2.28 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 127.067 3.318 . . . . 0.0 110.522 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.403 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 8.5 t -70.97 -172.99 0.74 Allowed 'General case' 0 C--O 1.203 -1.372 0 CA-C-N 111.161 -2.745 . . . . 0.0 110.893 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.403 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -165.77 -51.05 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 126.459 3.028 . . . . 0.0 114.262 179.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -90.72 61.56 3.09 Favored Glycine 0 N--CA 1.473 1.141 0 CA-C-N 109.352 -3.567 . . . . 0.0 112.792 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . 0.268 8.4 tp 176.27 -32.43 0.0 OUTLIER 'General case' 0 C--O 1.241 0.612 0 CA-C-N 109.822 -3.189 . . . . 0.0 115.487 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -141.16 -53.68 0.47 Allowed 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.23 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 62.83 65.88 2.88 Favored Glycine 0 C--O 1.206 -1.623 0 CA-C-O 125.481 2.712 . . . . 0.0 111.519 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -127.65 -86.82 0.58 Allowed 'General case' 0 C--N 1.364 1.211 1 CA-C-N 107.043 -4.578 . . . . 0.0 114.372 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 132.36 73.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.117 1 O-C-N 129.271 4.107 . . . . 0.0 108.646 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.67 178.17 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 128.281 3.488 . . . . 0.0 115.929 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -108.85 158.06 18.02 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 133.401 6.688 . . . . 0.0 107.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.7 m -156.1 75.47 0.89 Allowed 'General case' 0 C--O 1.199 -1.602 0 O-C-N 128.267 3.479 . . . . 0.0 111.547 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.06 146.05 44.31 Favored 'General case' 0 N--CA 1.429 -1.507 1 CA-C-N 107.243 -4.526 . . . . 0.0 109.644 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.432 HG23 ' CZ ' ' A' ' 65' ' ' PHE . 3.3 t -131.28 148.98 32.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 C-N-CA 127.08 2.152 . . . . 0.0 107.648 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.44 ' CG2' ' N ' ' A' ' 89' ' ' TRP 0.345 0.9 OUTLIER -166.88 165.89 15.84 Favored 'General case' 0 CA--C 1.473 -2.007 0 CA-C-O 125.893 2.759 . . . . 0.0 112.414 -179.712 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.683 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 38.4 m95 -96.3 113.73 25.34 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-O 113.472 -3.156 . . . . 0.0 109.284 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.49 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 4.9 tp10 -73.74 -45.87 49.37 Favored 'General case' 0 CA--C 1.477 -1.858 1 CA-C-O 131.861 5.601 . . . . 0.0 112.784 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.78 -46.36 0.15 Allowed Glycine 0 CA--C 1.542 1.775 0 CA-C-N 108.692 -3.867 . . . . 0.0 104.94 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -144.16 57.44 1.33 Allowed 'General case' 0 N--CA 1.427 -1.622 0 O-C-N 128.121 2.895 . . . . 0.0 111.268 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.411 HG22 ' CB ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER 170.83 151.93 0.05 OUTLIER 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 108.537 -3.938 . . . . 0.0 117.688 179.475 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.546 ' HB3' ' CG ' ' A' ' 109' ' ' GLN . 0.4 OUTLIER -85.21 3.9 37.14 Favored 'General case' 0 CA--C 1.476 -1.873 1 O-C-N 131.548 5.53 . . . . 0.0 119.637 -178.941 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.49 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.435 27.4 t -3.45 117.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.413 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -131.14 149.11 52.74 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-O 123.538 1.637 . . . . 0.0 109.019 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.6 122.35 54.96 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.597 0 CA-C-N 111.854 -2.43 . . . . 0.0 117.369 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.497 ' CG ' ' HB3' ' A' ' 105' ' ' ARG . 1.2 tt0 -90.22 117.54 29.04 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 120.821 -1.174 . . . . 0.0 108.295 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.0 tppt? -47.94 -36.19 12.01 Favored 'General case' 0 N--CA 1.486 1.341 1 O-C-N 129.476 4.235 . . . . 0.0 108.659 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 65.91 -83.22 0.09 OUTLIER Glycine 0 C--O 1.199 -2.063 0 CA-C-N 112.543 -2.117 . . . . 0.0 113.269 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 91.31 35.32 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.052 1 CA-C-N 107.177 -4.511 . . . . 0.0 110.477 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.471 ' CD ' ' HG2' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 169.69 -42.79 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 110.952 -2.84 . . . . 0.0 113.556 -179.881 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.483 ' HB2' ' CA ' ' A' ' 123' ' ' GLY . 0.2 OUTLIER -129.38 151.56 49.88 Favored 'General case' 0 N--CA 1.433 -1.321 0 O-C-N 127.096 2.747 . . . . 0.0 115.236 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.441 ' HB2' HG23 ' A' ' 121' ' ' THR . 76.5 m-20 -82.82 103.06 12.02 Favored 'General case' 0 N--CA 1.491 1.59 1 O-C-N 132.271 5.982 . . . . 0.0 101.888 179.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.497 ' HB3' ' CG ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -118.96 28.02 8.53 Favored 'General case' 0 C--N 1.31 -1.126 1 O-C-N 130.57 4.919 . . . . 0.0 110.562 -178.88 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -93.7 131.05 10.58 Favored Glycine 0 N--CA 1.427 -1.936 1 CA-C-N 106.583 -4.826 . . . . 0.0 112.703 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.618 ' NE1' ' NE2' ' A' ' 109' ' ' GLN . 0.1 OUTLIER -111.78 147.01 36.58 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 129.133 3.49 . . . . 0.0 107.047 177.383 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.452 ' HD3' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -138.97 -176.16 4.4 Favored 'General case' 0 C--O 1.215 -0.721 1 O-C-N 129.724 4.39 . . . . 0.0 111.111 -179.102 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.641 ' N ' ' CD ' ' A' ' 109' ' ' GLN . 0.1 OUTLIER -156.18 115.61 3.54 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 115.308 -2.557 . . . . 0.0 111.119 -176.168 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.516 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -132.7 124.26 27.85 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 117.422 2.379 . . . . 0.0 117.422 179.506 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 42.3 t -59.5 103.98 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.819 0 CA-C-O 123.718 1.723 . . . . 0.0 112.497 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -101.21 40.34 1.3 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 112.239 -2.255 . . . . 0.0 114.406 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.85 -112.7 3.7 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-N 111.789 -2.46 . . . . 0.0 115.036 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -68.15 -49.51 60.51 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -98.27 -179.08 4.25 Favored 'General case' 0 C--O 1.22 -0.48 0 O-C-N 128.963 3.915 . . . . 0.0 107.568 -179.712 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.406 ' HG ' ' N ' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -143.73 136.72 27.54 Favored 'General case' 0 C--O 1.202 -1.41 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.503 179.722 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.516 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 10.1 m-85 -81.76 163.77 22.17 Favored 'General case' 0 C--O 1.208 -1.115 0 C-N-CA 115.538 -2.465 . . . . 0.0 114.133 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 2.2 tt -130.34 21.0 5.23 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 128.264 3.477 . . . . 0.0 106.804 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.401 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 19.6 mt-10 -28.58 125.55 0.1 Allowed 'General case' 0 N--CA 1.48 1.053 1 O-C-N 131.372 5.42 . . . . 0.0 109.922 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.481 ' HB2' ' CB ' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -143.78 155.8 44.28 Favored 'General case' 0 CA--C 1.488 -1.406 0 C-N-CA 116.012 -2.275 . . . . 0.0 110.518 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.441 HG23 ' HB2' ' A' ' 104' ' ' ASN . 23.5 m -114.82 158.8 21.42 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.358 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.404 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -157.66 49.6 0.42 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 126.379 2.99 . . . . 0.0 113.612 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.483 ' CA ' ' HB2' ' A' ' 103' ' ' GLU . . . 93.09 -100.95 2.72 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 112.968 -1.923 . . . . 0.0 108.699 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.92 -59.93 2.49 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 111.665 -2.267 . . . . 0.0 112.236 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -73.59 174.87 7.68 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 128.031 3.332 . . . . 0.0 108.963 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.1 t -150.35 71.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.821 2 O-C-N 131.307 5.38 . . . . 0.0 113.219 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 114.63 1.45 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 116.337 -1.792 . . . . 0.0 110.696 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.12 79.89 1.66 Allowed 'General case' 0 CA--C 1.497 -1.063 0 O-C-N 128.608 3.693 . . . . 0.0 114.171 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -56.13 129.59 40.7 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.277 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.25 0.4 OUTLIER -110.12 136.92 44.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 123.905 1.812 . . . . 0.0 108.753 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.464 ' N ' ' CD1' ' A' ' 131' ' ' PHE . 67.4 m-85 -128.09 168.23 15.65 Favored 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 111.111 -2.768 . . . . 0.0 116.92 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.405 ' HE2' ' HB2' ' A' ' 10' ' ' GLU 0.354 0.0 OUTLIER -143.61 30.13 1.37 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 116.234 -1.841 . . . . 0.0 108.813 179.881 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.593 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 62.2 176.65 0.13 Allowed 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 117.449 -1.7 . . . . 0.0 111.42 -179.43 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.448 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.259 1.594 0 CA-C-O 116.224 -1.846 . . . . 0.0 114.963 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.497 -1.083 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 63.5 t0 67.53 84.54 0.15 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 102.709 -3.071 . . . . 0.0 102.709 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -116.31 46.36 1.6 Allowed 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 44' ' ' VAL . 5.1 t-20 -34.13 137.5 0.11 Allowed 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 126.172 2.17 . . . . 0.0 113.976 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 160.26 -163.53 33.94 Favored Glycine 0 C--O 1.218 -0.887 0 CA-C-O 115.271 -2.961 . . . . 0.0 112.463 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.477 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -136.91 144.47 43.5 Favored 'General case' 0 C--O 1.202 -1.434 1 O-C-N 132.725 5.603 . . . . 0.0 103.688 -179.828 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.517 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.283 0.0 OUTLIER -141.56 137.16 31.77 Favored 'General case' 0 CA--C 1.496 -1.119 1 O-C-N 131.832 5.708 . . . . 0.0 112.891 -179.191 . . . . . . . . 5 4 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.5 mm-40 -81.5 5.12 18.82 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 125.52 1.763 . . . . 0.0 115.551 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.0 ttp 58.61 -91.01 0.03 OUTLIER 'General case' 0 C--O 1.246 0.919 0 CA-C-O 111.955 -3.879 . . . . 0.0 104.134 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.8 tt0 119.54 -45.56 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.985 1 O-C-N 129.495 4.247 . . . . 0.0 110.106 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.96 155.84 5.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.479 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.84 169.89 12.77 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 110.563 -3.017 . . . . 0.0 111.882 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -121.93 124.96 45.3 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 128.812 3.82 . . . . 0.0 113.118 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 t30 46.35 84.5 0.03 OUTLIER 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 124.051 1.881 . . . . 0.0 112.645 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -92.12 -30.56 15.91 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-N 112.769 -2.014 . . . . 0.0 112.871 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.46 ' HA ' ' CG ' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -71.24 -56.78 5.35 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.064 -2.398 . . . . 0.0 112.608 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.4 ' HA2' ' HB2' ' A' ' 22' ' ' LYS . . . -53.87 -23.59 23.25 Favored Glycine 0 CA--C 1.489 -1.57 1 O-C-N 132.276 5.985 . . . . 0.0 113.252 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.87 -49.58 19.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 126.843 3.211 . . . . 0.0 108.128 179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.404 ' HB2' ' HB2' ' A' ' 31' ' ' ARG . 19.7 mmm -68.77 -20.54 64.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 119.73 -1.856 . . . . 0.0 112.345 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.4 ' HB2' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.8 -22.77 42.69 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.55 3.031 . . . . 0.0 110.341 179.754 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -37.33 63.71 Favored 'General case' 0 C--O 1.207 -1.177 1 O-C-N 131.745 5.653 . . . . 0.0 112.806 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.84 9.36 40.78 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 128.446 3.591 . . . . 0.0 108.802 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 32.53 66.94 0.17 Allowed 'General case' 0 CA--C 1.482 -1.647 0 CA-C-O 127.008 3.29 . . . . 0.0 113.348 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.4 HG23 ' HE2' ' A' ' 21' ' ' MET . 10.7 tt -87.5 -31.48 5.91 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-O 126.685 3.136 . . . . 0.0 112.355 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.05 -176.55 0.25 Allowed 'General case' 0 C--N 1.36 1.044 0 CA-C-N 112.72 -2.036 . . . . 0.0 112.832 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.445 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 26.4 m-85 -125.0 35.73 4.73 Favored 'General case' 0 CA--C 1.501 -0.915 0 O-C-N 126.517 2.386 . . . . 0.0 111.127 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.52 177.36 6.71 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.258 3.474 . . . . 0.0 106.736 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 76.97 -62.46 0.4 Allowed 'General case' 0 C--O 1.214 -0.807 0 O-C-N 128.747 3.78 . . . . 0.0 111.423 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' CG ' ' HA ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -38.4 -19.74 0.01 OUTLIER 'General case' 0 C--O 1.243 0.755 1 O-C-N 130.735 5.022 . . . . 0.0 113.079 -179.86 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -86.81 -32.4 20.34 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 127.668 3.105 . . . . 0.0 111.906 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -111.42 36.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 128.665 3.728 . . . . 0.0 115.071 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.26 23.25 11.95 Favored 'General case' 0 C--O 1.201 -1.491 0 CA-C-O 126.081 2.848 . . . . 0.0 108.568 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.431 ' O ' ' CE1' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -62.96 178.74 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 108.785 -3.825 . . . . 0.0 106.65 176.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HD3' ' N ' ' A' ' 36' ' ' ARG . 4.2 mpt_? -49.04 -30.39 6.19 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 127.584 3.052 . . . . 0.0 112.254 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.512 HD22 ' CG ' ' A' ' 58' ' ' PHE . 3.8 pp 29.84 108.48 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 2 O-C-N 134.822 7.576 . . . . 0.0 113.479 177.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.6 m 57.17 42.95 24.77 Favored 'General case' 0 CA--C 1.479 -1.767 0 CA-C-N 110.793 -2.912 . . . . 0.0 118.333 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.512 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.3 OUTLIER -159.34 -97.59 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.517 ' CG2' ' N ' ' A' ' 41' ' ' LYS . 1.3 m 172.56 159.15 0.11 Allowed 'General case' 0 C--O 1.199 -1.566 0 O-C-N 128.842 3.839 . . . . 0.0 112.387 -175.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.517 ' N ' ' CG2' ' A' ' 40' ' ' THR . 0.0 OUTLIER -111.98 158.21 19.79 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 101.708 -3.441 . . . . 0.0 101.708 178.43 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.476 ' N ' ' O ' ' A' ' 53' ' ' LYS . 2.1 mp -134.32 156.85 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 119.912 1.233 . . . . 0.0 111.587 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.415 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 5.3 tt -132.31 135.74 57.49 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 0 CA-C-N 111.248 -2.705 . . . . 0.0 107.828 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.463 ' CG1' ' N ' ' A' ' 45' ' ' GLN . 2.3 t -110.49 -64.97 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 N-CA-C 116.323 1.971 . . . . 0.0 116.323 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.463 ' N ' ' CG1' ' A' ' 44' ' ' VAL . 1.7 tm0? 65.32 140.24 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 125.851 2.739 . . . . 0.0 112.071 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -165.6 71.93 0.16 Allowed 'General case' 0 C--N 1.363 1.189 0 CA-C-N 110.244 -3.162 . . . . 0.0 114.007 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.06 -89.07 1.5 Allowed Glycine 0 C--O 1.216 -1.025 0 CA-C-O 122.893 1.274 . . . . 0.0 110.793 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -108.76 -44.47 4.02 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 109.586 -3.307 . . . . 0.0 110.788 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.16 95.49 0.13 Allowed 'General case' 0 C--N 1.357 0.904 0 O-C-N 127.269 2.856 . . . . 0.0 109.172 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.494 ' CE2' HD21 ' A' ' 94' ' ' LEU . 42.5 t80 -95.91 95.75 8.46 Favored 'General case' 0 CA--C 1.496 -1.134 1 O-C-N 129.539 4.274 . . . . 0.0 113.021 -179.933 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.44 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 43.7 mttt -105.65 165.63 11.03 Favored 'General case' 0 CA--C 1.491 -1.297 0 O-C-N 128.789 3.806 . . . . 0.0 113.84 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -148.61 111.35 4.79 Favored 'General case' 0 CA--C 1.499 -0.997 1 O-C-N 131.047 5.217 . . . . 0.0 107.797 179.713 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.57 153.17 42.55 Favored 'General case' 0 C--O 1.208 -1.128 0 C-N-CA 117.666 -1.614 . . . . 0.0 111.289 -179.468 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.6 157.67 17.02 Favored 'General case' 0 C--N 1.313 -0.979 0 O-C-N 125.878 1.986 . . . . 0.0 111.073 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -107.82 -18.58 13.78 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-O 113.824 -2.989 . . . . 0.0 115.233 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.434 ' HB2' ' CD1' ' A' ' 58' ' ' PHE . 16.5 p -16.85 152.22 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.181 1 O-C-N 135.703 8.127 . . . . 0.0 113.566 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.84 -33.19 57.94 Favored 'General case' 0 CA--C 1.504 -0.819 1 CA-C-N 107.588 -4.369 . . . . 0.0 109.038 179.519 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.512 ' CG ' HD22 ' A' ' 37' ' ' LEU . 5.8 p90 -68.14 -53.31 26.1 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 126.938 2.648 . . . . 0.0 114.438 -179.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -172.47 130.81 0.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 O-C-N 127.985 3.303 . . . . 0.0 110.183 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 90.64 5.81 Favored 'General case' 0 C--O 1.204 -1.318 0 O-C-N 127.604 3.065 . . . . 0.0 113.409 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.58 141.68 37.46 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 109.083 -3.689 . . . . 0.0 109.047 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.91 161.52 14.38 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 126.877 2.611 . . . . 0.0 116.095 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.1 tp -109.99 62.22 0.6 Allowed 'General case' 0 C--O 1.214 -0.781 0 O-C-N 129.096 3.997 . . . . 0.0 110.753 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.44 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 7.2 p-10 -71.11 93.99 1.09 Allowed 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 112.568 -2.106 . . . . 0.0 111.141 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.675 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -127.85 169.36 13.99 Favored 'General case' 0 CA--C 1.494 -1.181 0 CA-C-O 126.686 3.136 . . . . 0.0 109.31 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.41 ' CG2' ' N ' ' A' ' 67' ' ' VAL . 0.6 OUTLIER -147.97 172.82 13.61 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 110.302 -3.135 . . . . 0.0 106.972 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.41 ' N ' ' CG2' ' A' ' 66' ' ' THR . 21.3 t -87.59 142.82 12.44 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.463 0 O-C-N 126.459 2.35 . . . . 0.0 115.664 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 37.78 33.55 0.14 Allowed Glycine 0 C--N 1.342 0.894 1 O-C-N 129.806 4.441 . . . . 0.0 116.721 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 13.4 p -81.24 -14.22 12.6 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.941 0 C-N-CA 117.797 -1.561 . . . . 0.0 108.459 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 72' ' ' ASP . 24.6 tt0 58.31 75.77 0.37 Allowed 'General case' 0 C--N 1.355 0.815 0 O-C-N 128.692 3.745 . . . . 0.0 109.361 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.11 81.13 0.02 OUTLIER 'General case' 0 C--N 1.345 0.409 1 O-C-N 131.983 5.802 . . . . 0.0 111.039 179.769 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 70' ' ' GLU . 24.3 t70 -60.27 76.74 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.465 ' HG2' ' CA ' ' A' ' 83' ' ' VAL 0.272 32.6 mt-10 57.45 111.48 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.207 0 O-C-N 125.823 1.952 . . . . 0.0 113.698 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.524 ' CE1' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER 176.2 69.17 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 108.667 -3.879 . . . . 0.0 111.923 179.558 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 82.4 p -99.26 -27.97 13.54 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 110.318 -3.128 . . . . 0.0 115.675 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.524 ' HE2' ' CE1' ' A' ' 74' ' ' HIS . 0.1 OUTLIER -35.92 153.94 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 1 O-C-N 130.049 4.593 . . . . 0.0 114.772 -179.819 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.6 24.12 Favored Glycine 0 C--O 1.218 -0.89 0 CA-C-N 111.218 -2.719 . . . . 0.0 110.664 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 10.8 tp -163.73 -47.75 0.03 OUTLIER 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 126.963 3.268 . . . . 0.0 112.505 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.79 -67.04 1.03 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 110.562 -3.017 . . . . 0.0 113.24 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.98 69.93 1.16 Allowed Glycine 0 C--O 1.209 -1.44 0 CA-C-O 125.727 2.848 . . . . 0.0 110.842 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.412 ' NE ' ' HA ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -114.47 -156.04 0.59 Allowed 'General case' 0 N--CA 1.49 1.567 1 CA-C-N 107.399 -4.4 . . . . 0.0 107.944 -179.585 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.464 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.3 OUTLIER -174.52 82.21 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 127.544 3.027 . . . . 0.0 108.118 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.465 ' CA ' ' HG2' ' A' ' 73' ' ' GLU . 2.3 t -138.09 153.54 27.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 N-CA-C 118.17 2.655 . . . . 0.0 118.17 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.97 147.05 20.59 Favored 'General case' 0 C--O 1.239 0.524 1 O-C-N 129.592 4.307 . . . . 0.0 106.334 179.448 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 m -152.83 70.79 0.9 Allowed 'General case' 0 C--O 1.199 -1.553 1 O-C-N 130.589 4.931 . . . . 0.0 112.066 -179.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.0 tp -70.65 140.88 51.67 Favored 'General case' 0 C--O 1.209 -1.039 1 CA-C-N 107.114 -4.585 . . . . 0.0 115.298 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.403 ' CG1' HD12 ' A' ' 94' ' ' LEU . 2.2 t -116.79 142.31 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 111.728 -2.487 . . . . 0.0 107.012 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.253 16.4 m -159.1 161.82 36.45 Favored 'General case' 0 CA--C 1.48 -1.75 0 O-C-N 126.175 2.172 . . . . 0.0 111.499 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.677 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 33.5 m95 -98.87 143.97 28.6 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 128.309 2.644 . . . . 0.0 107.957 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 93' ' ' THR . 9.7 tp10 -99.46 -30.78 11.98 Favored 'General case' 0 C--O 1.195 -1.794 1 CA-C-O 128.521 4.01 . . . . 0.0 112.09 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.44 -40.25 0.51 Allowed Glycine 0 C--O 1.21 -1.371 1 N-CA-C 102.751 -4.14 . . . . 0.0 102.751 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -149.54 31.04 0.74 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.767 5.04 . . . . 0.0 111.579 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' GLU . 5.5 t -167.74 149.67 5.59 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 117.672 2.471 . . . . 0.0 117.672 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.494 HD21 ' CE2' ' A' ' 50' ' ' PHE . 1.6 tp -85.81 87.24 7.38 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 118.036 2.606 . . . . 0.0 118.036 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.335 53.4 t -81.79 120.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.361 1.101 0 O-C-N 128.006 3.317 . . . . 0.0 112.451 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.532 ' HB2' ' CZ3' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -143.07 143.69 31.96 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 126.79 3.185 . . . . 0.0 108.916 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.9 m -133.55 144.08 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 108.459 -3.973 . . . . 0.0 117.813 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.406 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -96.57 101.03 12.58 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 110.692 -2.958 . . . . 0.0 106.959 178.784 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -92.31 96.11 10.09 Favored 'General case' 0 CA--C 1.496 -1.101 0 C-N-CA 114.449 -2.9 . . . . 0.0 114.229 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 138.86 160.49 8.4 Favored Glycine 0 C--N 1.348 1.218 1 CA-C-O 128.055 4.142 . . . . 0.0 114.267 179.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.16 178.19 0.06 Allowed 'General case' 0 CA--C 1.499 -1.016 1 CA-C-N 106.631 -4.785 . . . . 0.0 108.553 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.86 -68.35 0.2 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 117.218 2.303 . . . . 0.0 117.218 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -56.31 158.87 3.9 Favored 'General case' 0 C--O 1.2 -1.511 0 CA-C-N 111.253 -2.703 . . . . 0.0 116.671 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.82 105.98 11.23 Favored 'General case' 0 N--CA 1.492 1.637 2 O-C-N 130.094 4.621 . . . . 0.0 102.493 179.719 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.421 ' HD2' ' HA ' ' A' ' 105' ' ' ARG . 19.5 mmm-85 -108.05 31.78 5.26 Favored 'General case' 0 C--N 1.32 -0.68 1 O-C-N 130.308 4.755 . . . . 0.0 112.272 -179.68 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -62.77 83.78 0.04 OUTLIER Glycine 0 N--CA 1.428 -1.848 2 O-C-N 131.209 5.318 . . . . 0.0 113.564 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.675 ' CH2' ' CE2' ' A' ' 65' ' ' PHE 0.283 0.0 OUTLIER -99.44 128.38 45.55 Favored 'General case' 0 C--N 1.319 -0.728 1 O-C-N 131.817 5.069 . . . . 0.0 109.962 179.721 . . . . . . . . 5 4 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.556 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.8 OUTLIER -160.92 150.13 16.83 Favored 'General case' 0 CA--C 1.508 -0.647 1 O-C-N 130.074 4.609 . . . . 0.0 117.052 -177.007 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -106.42 179.01 4.39 Favored 'General case' 0 C--N 1.359 0.984 0 CA-C-O 113.497 -3.144 . . . . 0.0 109.648 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.556 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 0.7 OUTLIER 173.37 82.69 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.279 1 O-C-N 131.726 5.641 . . . . 0.0 117.71 178.526 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 80.6 t -45.57 102.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.761 0 CA-C-O 127.973 3.749 . . . . 0.0 116.239 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.442 ' HG3' ' CD1' ' A' ' 117' ' ' TYR . 4.8 mt-10 -85.31 20.28 2.04 Favored 'General case' 0 N--CA 1.484 1.238 1 CA-C-N 108.345 -4.025 . . . . 0.0 116.042 -179.642 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.49 -101.28 0.33 Allowed Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.148 1.219 . . . . 0.0 116.148 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.53 12.69 25.88 Favored 'General case' 0 C--O 1.207 -1.137 0 N-CA-C 118.302 2.705 . . . . 0.0 118.302 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.427 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.7 OUTLIER -143.7 172.89 12.2 Favored 'General case' 0 C--N 1.32 -0.705 2 O-C-N 132.192 5.933 . . . . 0.0 109.388 179.837 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.409 ' O ' ' CG ' ' A' ' 131' ' ' PHE . 0.6 OUTLIER -138.78 121.05 15.88 Favored 'General case' 0 CA--C 1.48 -1.74 1 O-C-N 129.88 4.487 . . . . 0.0 111.713 179.942 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.45 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 4.7 m-85 -76.83 158.51 30.77 Favored 'General case' 0 C--O 1.213 -0.857 0 C-N-CA 115.888 -2.325 . . . . 0.0 116.097 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.51 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -137.95 46.49 2.07 Favored 'General case' 0 C--N 1.349 0.572 2 O-C-N 130.039 4.587 . . . . 0.0 108.261 179.789 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -62.03 157.32 19.07 Favored 'General case' 0 CA--C 1.506 -0.739 0 C-N-CA 127.067 2.147 . . . . 0.0 109.338 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.81 177.08 5.93 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 116.735 -1.986 . . . . 0.0 111.305 179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 47.7 m -135.8 155.71 49.93 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.412 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.2 OUTLIER -159.05 72.28 0.55 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 126.01 2.814 . . . . 0.0 114.155 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.27 58.15 9.24 Favored Glycine 0 CA--C 1.532 1.131 0 CA-C-N 112.039 -2.346 . . . . 0.0 111.273 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 62.98 52.6 2.55 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 126.523 1.929 . . . . 0.0 109.594 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -137.46 26.23 2.86 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-N 111.684 -2.507 . . . . 0.0 109.191 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 89.6 t -18.63 86.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.963 1 O-C-N 129.688 4.367 . . . . 0.0 111.653 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.42 150.78 31.2 Favored 'General case' 0 CA--C 1.49 -1.357 0 CA-C-N 111.936 -2.393 . . . . 0.0 112.843 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -124.71 151.13 45.41 Favored 'General case' 0 C--N 1.353 0.749 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.333 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -136.95 166.31 23.95 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 127.015 2.697 . . . . 0.0 114.862 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.3 t -150.94 143.26 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-O 128.117 3.818 . . . . 0.0 105.99 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.51 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 29.6 m-85 -137.34 -175.83 4.19 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-N 108.988 -3.733 . . . . 0.0 114.48 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.427 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -168.77 122.74 0.85 Allowed 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 178.767 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.474 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 35.7 ttpt -50.54 95.55 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 112.467 -2.152 . . . . 0.0 116.013 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt . . . . . 0 C--O 1.259 1.556 0 O-C-N 126.789 2.556 . . . . 0.0 116.499 179.604 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm . . . . . 0 CA--C 1.493 -1.22 0 N-CA-C 118.654 2.835 . . . . 0.0 118.654 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.477 ' HA ' ' CG2' ' A' ' 111' ' ' VAL . 22.9 m-20 53.1 -104.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -170.22 -146.96 0.05 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 114.96 -2.447 . . . . 0.0 105.888 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -170.77 104.94 0.25 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 130.513 3.525 . . . . 0.0 113.242 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -179.81 -117.43 0.55 Allowed Glycine 0 C--O 1.201 -1.953 0 CA-C-O 116.844 -2.087 . . . . 0.0 113.725 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 40' ' ' THR . 30.8 m -167.69 145.61 4.55 Favored 'General case' 0 C--O 1.216 -0.664 1 O-C-N 130.26 4.153 . . . . 0.0 108.439 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.554 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.287 0.0 OUTLIER -132.65 125.27 29.97 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 128.441 3.588 . . . . 0.0 112.489 -179.785 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -75.37 -4.06 37.2 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 127.16 2.787 . . . . 0.0 115.004 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.544 ' HG3' ' CE1' ' A' ' 131' ' ' PHE 0.27 16.0 ttm 57.86 62.0 2.22 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 116.209 -1.853 . . . . 0.0 107.266 179.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -34.91 -34.7 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 127.766 3.166 . . . . 0.0 111.842 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.29 0.2 OUTLIER -151.39 154.67 37.11 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-O 124.889 2.281 . . . . 0.0 112.254 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -129.92 125.2 34.95 Favored 'General case' 0 CA--C 1.503 -0.864 1 CA-C-N 107.629 -4.351 . . . . 0.0 116.695 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.443 ' CB ' ' HB3' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -112.34 122.88 48.98 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 132.042 5.839 . . . . 0.0 113.892 179.934 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.5 t30 49.99 84.64 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 124.024 1.868 . . . . 0.0 114.323 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.62 -37.58 9.08 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-O 125.725 2.679 . . . . 0.0 111.88 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.255 28.9 tt0 -79.24 -36.25 40.25 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 110.708 -2.951 . . . . 0.0 113.032 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.05 -22.92 76.15 Favored Glycine 0 CA--C 1.486 -1.775 0 O-C-N 128.914 3.884 . . . . 0.0 112.286 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -29.75 65.94 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 123.274 1.511 . . . . 0.0 108.899 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.43 -29.99 57.23 Favored 'General case' 0 CA--C 1.49 -1.338 0 C-N-CA 116.616 -2.034 . . . . 0.0 110.648 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -75.6 -29.76 59.37 Favored 'General case' 0 C--N 1.313 -0.981 0 O-C-N 128.089 3.368 . . . . 0.0 111.25 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.19 -48.71 79.47 Favored 'General case' 0 C--N 1.315 -0.91 1 O-C-N 129.979 4.549 . . . . 0.0 114.485 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -90.15 -12.33 38.54 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 110.262 -3.154 . . . . 0.0 108.789 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 53.27 104.83 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 O-C-N 128.279 3.487 . . . . 0.0 107.387 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 9.6 tt -112.17 -43.05 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 CA-C-N 110.656 -2.975 . . . . 0.0 109.18 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -170.09 33.69 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 118.489 -2.632 . . . . 0.0 112.844 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.463 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.2 OUTLIER 36.16 76.44 0.05 OUTLIER 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 76.83 63.06 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 124.96 2.314 . . . . 0.0 106.29 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -63.69 -43.28 97.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 108.531 -3.941 . . . . 0.0 109.763 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . 0.272 0.0 OUTLIER -74.69 -105.19 0.01 OUTLIER 'General case' 0 C--O 1.246 0.874 2 O-C-N 130.655 4.972 . . . . 0.0 110.527 179.88 . . . . . . . . 4 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.9 tttm 86.77 -3.19 0.67 Allowed 'General case' 0 C--O 1.203 -1.376 0 O-C-N 128.223 3.452 . . . . 0.0 110.07 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.459 ' CD1' ' N ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -155.42 31.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 O-C-N 127.059 2.725 . . . . 0.0 108.588 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -138.86 24.09 2.6 Favored 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 112.864 -1.971 . . . . 0.0 110.151 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 t -44.85 -37.37 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.168 0 CA-C-O 125.276 2.465 . . . . 0.0 109.497 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.507 ' C ' ' CD1' ' A' ' 37' ' ' LEU . 0.0 OUTLIER 177.89 168.85 0.72 Allowed 'General case' 0 C--O 1.216 -0.702 1 CA-C-N 106.568 -4.833 . . . . 0.0 111.081 178.814 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.578 ' CD2' ' N ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -150.64 -103.98 0.06 Allowed 'General case' 0 C--N 1.316 -0.89 2 O-C-N 132.1 5.875 . . . . 0.0 107.662 -176.922 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.458 ' N ' HD21 ' A' ' 37' ' ' LEU . 35.0 m -130.15 38.65 3.76 Favored 'General case' 0 CA--C 1.488 -1.429 0 O-C-N 127.633 3.083 . . . . 0.0 111.991 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -47.2 150.28 0.86 Allowed 'General case' 0 N--CA 1.481 1.076 0 O-C-N 120.236 -1.54 . . . . 0.0 115.066 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 8' ' ' THR . 22.1 m -168.88 108.09 0.46 Allowed 'General case' 0 C--O 1.216 -0.702 1 O-C-N 130.904 5.128 . . . . 0.0 114.33 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.424 ' C ' ' CD ' ' A' ' 41' ' ' LYS . 3.7 tmtt? -94.13 144.34 25.58 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 127.482 2.989 . . . . 0.0 107.166 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.445 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 4.2 mt -124.9 161.67 28.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.327 0 O-C-N 126.449 2.343 . . . . 0.0 110.622 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.445 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 12.7 tt -139.26 130.61 34.37 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.508 0 CA-C-N 110.419 -3.082 . . . . 0.0 107.517 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.0 t -106.94 -61.14 2.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 CA-C-O 115.538 -2.172 . . . . 0.0 112.117 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 50.5 130.08 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.265 0 CA-C-O 126.64 3.114 . . . . 0.0 115.946 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -163.95 32.46 0.08 Allowed 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 109.434 -3.53 . . . . 0.0 112.913 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 114.92 -118.67 4.4 Favored Glycine 0 C--N 1.345 1.04 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -79.57 -31.01 41.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 118.073 -1.451 . . . . 0.0 112.69 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -105.45 91.51 3.8 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.729 2.811 . . . . 0.0 108.755 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.495 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 14.7 t80 -103.55 137.6 41.4 Favored 'General case' 0 CA--C 1.48 -1.73 1 O-C-N 129.642 4.339 . . . . 0.0 114.766 -179.444 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.411 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -147.99 99.8 3.11 Favored 'General case' 0 C--O 1.203 -1.363 0 N-CA-C 118.317 2.71 . . . . 0.0 118.317 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.403 HG23 ' HB2' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -73.87 153.88 39.68 Favored 'General case' 0 C--O 1.245 0.822 0 O-C-N 128.629 3.706 . . . . 0.0 105.739 177.807 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.444 ' HG2' HD11 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -159.69 134.76 8.08 Favored 'General case' 0 CA--C 1.483 -1.62 0 C-N-CA 115.197 -2.601 . . . . 0.0 111.876 -178.554 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -97.64 152.52 18.99 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.736 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -144.49 36.21 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 114.267 -1.333 . . . . 0.0 114.021 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -37.73 -46.48 0.9 Allowed 'General case' 0 C--N 1.317 -0.824 0 O-C-N 128.535 3.647 . . . . 0.0 106.171 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 88.95 10.35 0.09 Allowed 'General case' 0 N--CA 1.481 1.101 1 O-C-N 130.959 5.162 . . . . 0.0 106.219 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.408 ' CG ' ' HG ' ' A' ' 37' ' ' LEU . 0.4 OUTLIER -110.4 -51.99 2.82 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 110.765 -2.925 . . . . 0.0 110.998 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.517 ' NH2' ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -164.73 90.56 0.54 Allowed 'General case' 0 C--N 1.359 1.019 0 CA-C-N 109.076 -3.693 . . . . 0.0 109.985 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.415 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 0.0 OUTLIER -91.85 126.27 36.87 Favored 'General case' 0 N--CA 1.431 -1.418 1 CA-C-N 108.061 -4.154 . . . . 0.0 111.854 -179.708 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.517 ' CE1' ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -128.55 47.57 2.43 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 128.722 3.764 . . . . 0.0 107.184 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -28.86 133.54 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 O-C-N 128.937 3.898 . . . . 0.0 113.769 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.54 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 11.7 tp -82.48 56.31 3.25 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -92.4 99.89 12.56 Favored 'General case' 0 C--O 1.205 -1.252 0 O-C-N 126.182 2.176 . . . . 0.0 112.823 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.54 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -147.89 -157.19 0.79 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 126.526 1.931 . . . . 0.0 107.386 179.134 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.44 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.5 OUTLIER -128.27 179.27 5.71 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 178.209 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.561 HG12 ' CD1' ' A' ' 89' ' ' TRP . 4.1 t -118.97 115.58 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.8 1 O-C-N 129.714 4.384 . . . . 0.0 109.96 -179.206 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.72 -24.34 22.06 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 116.448 -2.787 . . . . 0.0 111.561 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.8 t -92.48 89.69 2.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 112.587 -1.806 . . . . 0.0 109.378 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -37.28 102.71 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.761 1 O-C-N 129.879 4.487 . . . . 0.0 113.137 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.44 86.95 0.63 Allowed 'General case' 0 C--N 1.355 0.828 0 O-C-N 126.045 2.091 . . . . 0.0 111.432 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -48.04 85.3 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.51 0 CA-C-N 112.153 -2.294 . . . . 0.0 116.193 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 57.84 -165.76 0.16 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 120.827 1.649 . . . . 0.0 108.824 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 92.08 112.83 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.963 0 CA-C-N 110.251 -3.159 . . . . 0.0 110.48 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.418 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 71.4 p -134.11 -105.81 0.23 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 110.921 -2.854 . . . . 0.0 113.462 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.418 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 58.56 162.89 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 126.235 2.922 . . . . 0.0 114.613 -179.694 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 64.23 19.95 64.6 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-N 108.582 -3.917 . . . . 0.0 107.713 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.9 tp -159.15 -52.75 0.06 Allowed 'General case' 0 N--CA 1.475 0.796 0 O-C-N 127.485 2.52 . . . . 0.0 114.826 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -125.13 -66.23 0.97 Allowed 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 125.679 2.657 . . . . 0.0 110.421 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.35 74.07 1.21 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.665 2.079 . . . . 0.0 116.608 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -150.65 -130.97 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 112.045 -2.078 . . . . 0.0 113.672 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -169.4 115.67 0.58 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.659 1.118 . . . . 0.0 108.843 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.435 HG11 ' N ' ' A' ' 100' ' ' GLY . 75.6 t -138.09 149.61 24.74 Favored 'Isoleucine or valine' 0 C--N 1.365 1.254 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -179.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.39 103.86 0.56 Allowed 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 112.281 -2.236 . . . . 0.0 106.877 178.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.4 m -115.95 78.47 1.19 Allowed 'General case' 0 C--O 1.208 -1.131 0 O-C-N 126.994 2.684 . . . . 0.0 111.557 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.5 tp -86.6 148.95 25.26 Favored 'General case' 0 C--O 1.209 -1.072 1 CA-C-N 106.572 -4.831 . . . . 0.0 109.647 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 49.7 t -135.82 147.33 28.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 125.826 1.651 . . . . 0.0 107.602 179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.7 t -167.71 126.96 1.31 Allowed 'General case' 0 CA--C 1.474 -1.979 0 CA-C-O 127.561 3.553 . . . . 0.0 111.934 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.671 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 21.2 m95 -64.09 144.38 57.15 Favored 'General case' 0 C--N 1.346 0.454 0 O-C-N 116.877 -3.639 . . . . 0.0 102.792 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.7 OUTLIER -104.33 -3.48 24.12 Favored 'General case' 0 CA--C 1.471 -2.087 1 CA-C-O 131.673 5.511 . . . . 0.0 118.689 -177.83 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 116.08 -13.51 16.7 Favored Glycine 0 C--O 1.198 -2.126 1 N-CA-C 102.883 -4.087 . . . . 0.0 102.883 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 179.33 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.609 1 O-C-N 131.325 4.78 . . . . 0.0 111.891 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.599 ' O ' ' N ' ' A' ' 90' ' ' GLU 0.315 12.6 t 161.49 130.26 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 128.093 2.557 . . . . 0.0 116.386 179.448 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.576 ' N ' ' CZ3' ' A' ' 89' ' ' TRP . 6.4 tp -52.48 -38.16 58.83 Favored 'General case' 0 CA--C 1.482 -1.66 0 N-CA-C 118.63 2.826 . . . . 0.0 118.63 -177.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.469 ' CG2' HG21 ' A' ' 93' ' ' THR . 18.1 t 28.7 120.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.285 0 N-CA-C 120.63 3.567 . . . . 0.0 120.63 -178.082 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.462 ' SG ' ' CZ3' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -139.52 137.79 35.77 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 103.416 -2.809 . . . . 0.0 103.416 179.314 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.41 ' O ' ' N ' ' A' ' 99' ' ' LYS . 3.5 t -119.93 96.57 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 119.439 3.125 . . . . 0.0 119.439 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.404 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 5.1 mm-40 -66.0 94.12 0.22 Allowed 'General case' 0 C--N 1.364 1.215 0 CA-C-O 123.992 1.853 . . . . 0.0 106.504 178.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' A' ' 97' ' ' VAL . 3.4 tttp -91.59 -56.19 3.21 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 110.036 -3.257 . . . . 0.0 114.404 -178.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.435 ' N ' HG11 ' A' ' 83' ' ' VAL . . . -49.58 146.13 7.56 Favored Glycine 0 C--O 1.206 -1.612 0 CA-C-O 124.426 2.125 . . . . 0.0 112.599 -179.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 69.98 165.79 0.28 Allowed 'General case' 0 CA--C 1.498 -1.046 1 CA-C-N 107.808 -4.196 . . . . 0.0 108.865 179.8 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.423 ' HD2' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -43.57 -48.68 7.56 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.468 2.307 . . . . 0.0 113.09 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.423 ' N ' ' HD2' ' A' ' 102' ' ' LYS . 3.3 mm-40 -42.27 147.72 0.24 Allowed 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 109.964 -3.289 . . . . 0.0 116.147 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -125.15 71.4 1.19 Allowed 'General case' 0 N--CA 1.492 1.632 1 CA-C-N 106.451 -4.886 . . . . 0.0 101.971 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.427 ' HD2' ' HA ' ' A' ' 122' ' ' CYS . 28.8 mmm-85 -88.65 1.85 54.3 Favored 'General case' 0 C--O 1.204 -1.326 1 O-C-N 131.749 5.656 . . . . 0.0 114.045 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.404 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.65 98.43 0.01 OUTLIER Glycine 0 N--CA 1.43 -1.764 2 O-C-N 134.256 7.222 . . . . 0.0 116.596 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.609 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.283 0.0 OUTLIER -108.89 126.92 53.58 Favored 'General case' 0 C--O 1.214 -0.764 1 O-C-N 131.074 4.632 . . . . 0.0 109.068 178.725 . . . . . . . . 5 4 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.55 ' HG3' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -162.48 178.57 8.49 Favored 'General case' 0 C--O 1.209 -1.055 1 O-C-N 130.877 5.111 . . . . 0.0 112.81 -179.074 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.471 ' CG ' ' HB3' ' A' ' 94' ' ' LEU 0.286 0.0 OUTLIER -133.28 -177.22 4.42 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 112.985 -3.388 . . . . 0.0 107.644 -179.825 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.55 ' CZ3' ' HG3' ' A' ' 108' ' ' LYS . 0.6 OUTLIER 174.93 92.66 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.416 1 O-C-N 131.445 5.466 . . . . 0.0 118.183 178.221 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.477 ' CG2' ' HA ' ' A' ' 4' ' ' ASP 0.277 77.5 t -31.64 100.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.783 0 O-C-N 119.134 -2.229 . . . . 0.0 115.774 179.714 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.487 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -101.41 4.05 41.03 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 112.348 -2.205 . . . . 0.0 116.617 -179.595 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 151.0 -94.08 0.15 Allowed Glycine 0 N--CA 1.435 -1.368 0 O-C-N 120.767 -1.208 . . . . 0.0 113.789 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -118.62 24.66 10.76 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 117.692 2.479 . . . . 0.0 117.692 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.423 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -172.79 153.38 2.68 Favored 'General case' 0 CA--C 1.508 -0.654 1 O-C-N 129.931 4.519 . . . . 0.0 110.477 -179.792 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.522 HD11 ' CZ2' ' A' ' 9' ' ' TRP . 2.3 mt -96.26 112.53 24.24 Favored 'General case' 0 C--O 1.199 -1.565 1 O-C-N 129.386 4.179 . . . . 0.0 114.667 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.487 ' CD1' ' HB2' ' A' ' 112' ' ' GLU . 17.6 m-85 -74.0 98.11 2.99 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 114.596 -2.842 . . . . 0.0 115.661 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.418 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -80.27 79.14 6.89 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 128.73 3.769 . . . . 0.0 108.047 179.786 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.458 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 4.3 mt-10 -93.88 122.34 36.28 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 125.373 1.671 . . . . 0.0 109.783 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.03 150.47 51.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 126.363 2.29 . . . . 0.0 109.025 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.5 m -106.24 168.04 9.41 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.427 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -162.72 41.91 0.12 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 125.991 2.805 . . . . 0.0 115.618 -179.704 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 76.06 70.62 1.25 Allowed Glycine 0 C--O 1.218 -0.876 0 CA-C-N 109.547 -3.478 . . . . 0.0 111.731 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 102.72 -50.01 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.977 0 C-N-CA 129.088 2.955 . . . . 0.0 110.672 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -73.64 143.38 46.32 Favored 'General case' 0 C--O 1.217 -0.657 1 O-C-N 129.197 4.061 . . . . 0.0 108.562 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.9 t -124.81 87.02 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 O-C-N 128.114 3.384 . . . . 0.0 112.523 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.9 t -56.83 143.46 37.05 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . 0.443 ' HB3' ' CB ' ' A' ' 15' ' ' GLU . 4.8 ttp180 -127.51 135.68 50.7 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 128.495 3.622 . . . . 0.0 110.467 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -124.42 135.56 53.36 Favored 'General case' 0 N--CA 1.481 1.122 1 O-C-N 129.157 4.036 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 54.1 t -127.99 74.74 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.202 -1.445 0 N-CA-C 102.996 -2.965 . . . . 0.0 102.996 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.544 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 2.5 m-85 -54.86 -176.34 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.807 2 CA-C-N 104.677 -5.692 . . . . 0.0 111.52 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -164.16 107.71 0.95 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 114.846 -2.502 . . . . 0.0 105.271 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.546 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -51.99 129.55 27.44 Favored 'General case' 0 N--CA 1.475 0.795 1 O-C-N 130.536 4.897 . . . . 0.0 108.682 178.521 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 pttt . . . . . 0 CA--C 1.504 -0.819 0 N-CA-C 118.075 2.62 . . . . 0.0 118.075 -179.086 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.467 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.505 -0.761 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -77.09 132.19 38.75 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -154.3 66.4 0.7 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 116.938 -1.905 . . . . 0.0 107.62 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -44.31 146.3 0.69 Allowed 'General case' 0 N--CA 1.44 -0.959 1 O-C-N 129.96 4.538 . . . . 0.0 111.579 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.38 -169.81 33.87 Favored Glycine 0 C--O 1.207 -1.536 0 C-N-CA 117.546 -2.264 . . . . 0.0 111.993 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.474 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -127.64 147.98 50.37 Favored 'General case' 0 C--O 1.203 -1.381 1 O-C-N 131.954 5.149 . . . . 0.0 104.515 179.704 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.528 ' CZ3' ' HG3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.05 105.92 3.99 Favored 'General case' 0 C--N 1.32 -0.717 0 O-C-N 128.499 3.624 . . . . 0.0 116.705 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' N ' ' A' ' 12' ' ' GLU . 3.1 mt-10 -78.75 107.96 11.83 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 127.258 2.849 . . . . 0.0 108.997 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.421 ' CE ' ' ND2' ' A' ' 14' ' ' ASN 0.273 5.8 ttp -64.08 85.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 103.507 -2.775 . . . . 0.0 103.507 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 10' ' ' GLU . 36.8 tt0 -45.24 -30.28 1.19 Allowed 'General case' 0 C--N 1.312 -1.042 1 O-C-N 130.988 5.18 . . . . 0.0 112.006 -179.955 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.1 m -144.7 149.53 35.78 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 113.377 -1.738 . . . . 0.0 111.447 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.421 ' ND2' ' CE ' ' A' ' 11' ' ' MET . 5.9 t-20 -128.59 110.18 12.02 Favored 'General case' 0 C--O 1.206 -1.236 1 O-C-N 129.503 4.252 . . . . 0.0 112.665 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -110.97 125.31 53.57 Favored 'General case' 0 CA--C 1.496 -1.103 1 O-C-N 131.348 5.405 . . . . 0.0 113.717 179.446 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 57.66 85.97 0.08 Allowed 'General case' 0 C--O 1.209 -1.07 0 CA-C-O 122.277 1.037 . . . . 0.0 109.393 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.527 ' N ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -105.4 -29.36 10.29 Favored 'General case' 0 CA--C 1.487 -1.449 0 CA-C-O 124.944 2.307 . . . . 0.0 109.148 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.7 -48.68 14.5 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 114.982 -2.437 . . . . 0.0 110.601 179.154 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.417 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -59.58 -20.88 53.29 Favored Glycine 0 N--CA 1.475 1.241 0 O-C-N 128.43 3.581 . . . . 0.0 111.214 178.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.44 -38.69 48.95 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-O 127.434 3.492 . . . . 0.0 105.611 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.441 ' HG3' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -69.12 -36.3 77.35 Favored 'General case' 0 C--O 1.214 -0.789 0 CA-C-N 111.194 -2.73 . . . . 0.0 109.617 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.417 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -72.82 -22.57 60.78 Favored 'General case' 0 C--O 1.207 -1.164 1 O-C-N 134.03 7.081 . . . . 0.0 114.617 -179.328 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.14 -27.65 61.79 Favored 'General case' 0 N--CA 1.477 0.924 2 O-C-N 132.082 5.864 . . . . 0.0 109.11 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.418 HD23 ' NH1' ' A' ' 105' ' ' ARG . 0.6 OUTLIER -122.95 25.53 8.54 Favored 'General case' 0 CA--C 1.542 0.651 1 O-C-N 130.362 4.789 . . . . 0.0 105.484 179.775 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.402 ' C ' ' N ' ' A' ' 27' ' ' ASP . 1.6 m-20 57.72 -73.72 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.646 0 C-N-CA 130.826 3.65 . . . . 0.0 111.786 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.492 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 4.5 tt 28.54 49.8 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.046 3 CA-C-O 130.333 4.873 . . . . 0.0 106.84 179.557 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -67.87 62.41 0.08 Allowed 'General case' 0 N--CA 1.49 1.552 1 CA-C-N 107.992 -4.186 . . . . 0.0 113.844 -177.454 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -106.72 -43.14 4.77 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 118.153 2.649 . . . . 0.0 118.153 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 158.36 155.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 104.328 -2.471 . . . . 0.0 104.328 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.404 ' O ' ' N ' ' A' ' 33' ' ' ILE . 2.4 m 154.04 -50.26 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.099 1 O-C-N 131.148 5.28 . . . . 0.0 110.392 -178.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.436 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -50.36 -32.66 17.97 Favored 'General case' 0 N--CA 1.472 0.632 1 O-C-N 132.597 6.186 . . . . 0.0 106.288 179.234 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.436 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.6 OUTLIER -82.89 -45.69 13.9 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 127.807 3.192 . . . . 0.0 106.493 178.366 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.504 ' CG2' ' O ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -172.76 97.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.383 0 CA-C-O 128.245 3.878 . . . . 0.0 115.948 177.305 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 169.25 46.25 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.543 0 CA-C-O 127.697 3.618 . . . . 0.0 107.732 175.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.518 HG12 ' CZ ' ' A' ' 17' ' ' PHE . 58.6 t -62.03 -25.93 38.68 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.622 1 CA-C-N 106.932 -4.667 . . . . 0.0 108.282 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.448 ' HG3' ' HB2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER 174.84 -80.83 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.868 1 CA-C-N 107.917 -4.22 . . . . 0.0 108.421 177.133 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.576 ' C ' ' CD1' ' A' ' 37' ' ' LEU . 0.0 OUTLIER 123.1 2.09 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.035 1 O-C-N 132.613 6.196 . . . . 0.0 110.977 178.3 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 m 157.85 -70.34 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.309 1 O-C-N 129.871 4.482 . . . . 0.0 112.675 179.359 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.448 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 0.5 OUTLIER 57.56 101.14 0.02 OUTLIER 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -121.44 75.22 1.16 Allowed 'General case' 0 C--O 1.2 -1.539 1 O-C-N 131.44 5.462 . . . . 0.0 109.712 179.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.82 138.0 54.02 Favored 'General case' 0 N--CA 1.49 1.564 1 O-C-N 132.373 6.046 . . . . 0.0 106.823 -179.646 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.458 ' N ' ' O ' ' A' ' 53' ' ' LYS . 5.3 mt -136.46 109.1 8.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 O-C-N 127.509 3.005 . . . . 0.0 111.901 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.5 HD12 ' CZ ' ' A' ' 50' ' ' PHE 0.262 0.3 OUTLIER -83.97 118.62 31.65 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.672 1 CA-C-N 106.922 -4.672 . . . . 0.0 110.157 -179.432 . . . . . . . . 5 4 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -95.84 -40.77 11.19 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.485 0 CA-C-N 112.047 -2.342 . . . . 0.0 112.939 -179.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.498 ' HB2' ' CD1' ' A' ' 50' ' ' PHE . 47.3 tt0 18.4 102.7 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.523 0 O-C-N 127.936 3.272 . . . . 0.0 117.617 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -118.86 23.95 11.13 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-N 111.124 -2.762 . . . . 0.0 117.017 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.31 106.01 2.24 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-O 116.601 -2.222 . . . . 0.0 109.904 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 68.37 -68.13 0.18 Allowed 'General case' 0 C--O 1.211 -0.962 0 O-C-N 128.509 3.123 . . . . 0.0 109.454 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.63 99.29 2.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 112.833 -3.461 . . . . 0.0 107.58 178.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.5 ' CZ ' HD12 ' A' ' 43' ' ' ILE . 2.3 t80 -122.55 102.88 8.33 Favored 'General case' 0 CA--C 1.484 -1.576 1 O-C-N 130.444 4.84 . . . . 0.0 113.509 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 93.03 3.95 Favored 'General case' 0 C--O 1.194 -1.835 0 O-C-N 128.375 3.547 . . . . 0.0 115.198 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 62' ' ' ASP . 0.3 OUTLIER -69.21 155.19 40.81 Favored 'General case' 0 CA--C 1.499 -0.984 0 O-C-N 127.248 2.842 . . . . 0.0 107.322 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.458 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -168.58 143.46 3.36 Favored 'General case' 0 CA--C 1.485 -1.52 0 C-N-CA 115.843 -2.343 . . . . 0.0 112.551 -179.712 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.7 t -90.1 175.06 7.3 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 112.905 -1.952 . . . . 0.0 108.218 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -138.85 23.58 2.62 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.503 ' CB ' HD13 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -36.48 -64.88 0.31 Allowed 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.572 5.545 . . . . 0.0 110.187 179.969 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.4 t 118.62 -36.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 O-C-N 130.076 4.61 . . . . 0.0 103.02 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.529 ' CD1' ' CD2' ' A' ' 37' ' ' LEU . 2.2 m-85 -58.55 -64.83 0.79 Allowed 'General case' 0 C--O 1.241 0.632 0 O-C-N 126.849 2.593 . . . . 0.0 110.987 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -145.79 106.76 4.14 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 127.788 3.18 . . . . 0.0 110.291 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -99.4 64.92 1.36 Allowed 'General case' 0 C--O 1.21 -0.992 1 O-C-N 129.286 4.116 . . . . 0.0 107.508 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.76 77.89 1.74 Allowed 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 128.957 3.911 . . . . 0.0 108.692 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.412 ' HB3' HG23 ' A' ' 52' ' ' THR . 0.2 OUTLIER -101.83 -65.73 0.96 Allowed 'General case' 0 C--O 1.204 -1.331 0 O-C-N 126.632 2.457 . . . . 0.0 114.232 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.518 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 0.5 OUTLIER -149.41 103.86 3.33 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.916 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.442 ' C ' ' CD1' ' A' ' 65' ' ' PHE . 8.2 p-10 -126.23 70.76 1.24 Allowed 'General case' 0 CA--C 1.499 -1.018 0 C-N-CA 118.158 -1.417 . . . . 0.0 110.597 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.518 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -134.84 160.83 36.97 Favored 'General case' 0 C--N 1.353 0.743 1 CA-C-O 129.205 4.336 . . . . 0.0 111.02 179.842 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.43 HG23 ' CG2' ' A' ' 69' ' ' VAL . 1.2 m -107.77 102.44 11.66 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 109.454 -3.521 . . . . 0.0 102.862 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.478 HG13 ' CD1' ' A' ' 89' ' ' TRP . 14.1 t -33.52 129.39 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.489 -1.379 1 O-C-N 129.568 4.293 . . . . 0.0 115.97 -179.258 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.61 -18.39 56.58 Favored Glycine 0 N--CA 1.481 1.638 0 CA-C-N 111.517 -2.583 . . . . 0.0 112.968 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.43 ' CG2' HG23 ' A' ' 66' ' ' THR . 97.2 t -88.38 79.03 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 119.136 -1.025 . . . . 0.0 109.486 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -38.04 105.45 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.501 2 O-C-N 132.871 6.357 . . . . 0.0 110.611 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -64.86 92.5 0.1 Allowed 'General case' 0 CA--C 1.51 -0.569 0 O-C-N 129.043 3.964 . . . . 0.0 114.314 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -58.22 70.77 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 0 O-C-N 126.656 2.473 . . . . 0.0 113.125 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.45 ' HB3' ' CA ' ' A' ' 82' ' ' ASN . 13.9 mt-10 54.51 -165.79 0.09 Allowed 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 123.274 1.511 . . . . 0.0 110.688 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 72.84 86.31 0.11 Allowed 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 110.307 -3.133 . . . . 0.0 114.513 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.455 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 14.4 p -94.98 -70.88 0.69 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.4 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.455 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 43.54 140.62 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.954 2 O-C-N 130.218 4.699 . . . . 0.0 116.781 179.666 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.02 -15.77 61.1 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.644 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.492 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 8.2 tp -153.1 53.24 0.75 Allowed 'General case' 0 C--N 1.347 0.459 0 O-C-N 128.994 3.408 . . . . 0.0 116.028 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.5 t0 141.63 -67.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 O-C-N 128.568 3.667 . . . . 0.0 110.22 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.05 82.6 0.32 Allowed Glycine 0 C--O 1.213 -1.185 0 CA-C-N 110.073 -3.239 . . . . 0.0 110.557 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.97 -125.36 0.14 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 108.512 -3.844 . . . . 0.0 113.803 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.45 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER 178.68 93.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 120.455 1.48 . . . . 0.0 107.476 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.45 HG11 ' N ' ' A' ' 99' ' ' LYS . 68.0 t -128.88 151.6 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 O-C-N 127.8 3.187 . . . . 0.0 118.445 -178.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.24 95.65 5.04 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.064 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 76.7 m -99.84 81.74 2.49 Favored 'General case' 0 C--O 1.202 -1.439 0 CA-C-N 109.41 -3.541 . . . . 0.0 116.566 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.12 141.93 32.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 108.684 -3.871 . . . . 0.0 113.437 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.488 HG23 ' CD2' ' A' ' 65' ' ' PHE . 39.1 t -131.02 131.37 64.07 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 125.699 1.6 . . . . 0.0 108.673 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.261 99.2 m -156.42 170.73 21.64 Favored 'General case' 0 CA--C 1.476 -1.89 0 CA-C-N 113.02 -1.9 . . . . 0.0 111.412 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.678 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 31.1 m95 -100.37 143.54 30.43 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 129.134 2.973 . . . . 0.0 106.61 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.453 ' CG ' ' CG2' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -99.07 -12.49 20.49 Favored 'General case' 0 CA--C 1.477 -1.852 0 CA-C-O 127.237 3.399 . . . . 0.0 113.286 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 128.31 -29.61 4.04 Favored Glycine 0 C--O 1.196 -2.264 0 CA-C-N 109.961 -3.29 . . . . 0.0 105.226 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -150.11 24.15 0.83 Allowed 'General case' 0 N--CA 1.434 -1.257 1 O-C-N 130.041 4.024 . . . . 0.0 111.841 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.445 ' O ' ' N ' ' A' ' 90' ' ' GLU . 5.3 t -174.01 163.48 4.01 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.562 2.43 . . . . 0.0 117.562 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.436 ' N ' ' OG1' ' A' ' 93' ' ' THR . 1.1 tp -92.99 98.41 11.33 Favored 'General case' 0 C--O 1.209 -1.046 0 CA-C-O 125.332 2.491 . . . . 0.0 114.343 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.453 ' CG2' ' CG ' ' A' ' 90' ' ' GLU 0.271 90.6 t -100.0 112.2 31.83 Favored 'Isoleucine or valine' 0 C--N 1.363 1.159 0 CA-C-N 110.406 -3.088 . . . . 0.0 112.623 179.672 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.416 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -139.42 150.04 44.78 Favored 'General case' 0 C--O 1.196 -1.726 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.36 139.48 43.66 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 128.102 3.376 . . . . 0.0 114.489 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.404 ' CB ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -111.07 107.69 17.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.328 1.851 . . . . 0.0 107.266 179.065 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.45 ' N ' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.69 98.92 3.5 Favored 'General case' 0 C--O 1.201 -1.464 0 C-N-CA 115.203 -2.599 . . . . 0.0 112.797 -179.329 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -165.92 57.36 0.25 Allowed Glycine 0 C--O 1.212 -1.239 0 CA-C-O 124.428 2.127 . . . . 0.0 111.95 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 62.3 145.65 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.188 1 CA-C-N 106.365 -4.918 . . . . 0.0 113.916 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.455 ' CD ' ' HG2' ' A' ' 103' ' ' GLU . 0.3 OUTLIER 99.17 -49.71 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 110.94 -2.846 . . . . 0.0 116.348 179.357 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.455 ' HG2' ' CD ' ' A' ' 102' ' ' LYS . 14.7 pt-20 -156.11 -177.87 6.9 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 108.46 -3.973 . . . . 0.0 114.899 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -128.22 88.63 2.78 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 113.633 -3.079 . . . . 0.0 104.107 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.468 ' CD ' ' HB3' ' A' ' 122' ' ' CYS . 10.3 mmm-85 -68.59 -9.27 48.6 Favored 'General case' 0 C--O 1.201 -1.468 1 O-C-N 130.508 4.88 . . . . 0.0 113.345 179.419 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -33.43 114.85 0.11 Allowed Glycine 0 C--N 1.352 1.441 1 O-C-N 130.483 4.864 . . . . 0.0 116.983 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.416 ' CZ2' ' SG ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -123.1 142.34 50.99 Favored 'General case' 0 C--N 1.32 -0.693 1 O-C-N 132.051 5.207 . . . . 0.0 109.878 178.738 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.461 ' HD3' ' CH2' ' A' ' 110' ' ' TRP . 0.3 OUTLIER -165.27 170.85 14.29 Favored 'General case' 0 CA--C 1.505 -0.786 1 O-C-N 129.442 4.214 . . . . 0.0 112.697 -179.292 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.453 ' C ' ' CG ' ' A' ' 110' ' ' TRP . 3.9 mp0 -132.71 -178.35 4.9 Favored 'General case' 0 C--N 1.365 1.265 0 C-N-CA 115.989 -2.284 . . . . 0.0 108.616 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.461 ' CH2' ' HD3' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -159.67 15.75 0.15 Allowed 'General case' 0 CA--C 1.501 -0.925 1 O-C-N 129.279 4.112 . . . . 0.0 118.063 -179.823 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.3 t 39.87 71.13 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.628 0 CA-C-O 125.821 2.724 . . . . 0.0 115.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.402 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 2.8 mm-40 -97.02 84.8 3.6 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-O 125.924 2.773 . . . . 0.0 117.308 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.58 87.79 0.01 OUTLIER Glycine 0 C--O 1.197 -2.206 0 O-C-N 119.048 -2.283 . . . . 0.0 117.347 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 41.16 51.79 3.44 Favored 'General case' 0 CA--C 1.501 -0.936 0 C-N-CA 128.576 2.75 . . . . 0.0 118.39 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.401 ' HB2' ' C ' ' A' ' 131' ' ' PHE . 6.4 pttt 177.14 146.12 0.1 Allowed 'General case' 0 C--N 1.32 -0.713 0 O-C-N 129.057 3.973 . . . . 0.0 109.982 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.9 mp -105.3 104.56 14.32 Favored 'General case' 0 C--O 1.199 -1.563 0 O-C-N 128.308 3.505 . . . . 0.0 118.605 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.402 ' CD2' ' HB2' ' A' ' 112' ' ' GLU . 6.8 m-30 -70.2 93.27 0.82 Allowed 'General case' 0 C--O 1.203 -1.369 0 O-C-N 127.988 3.305 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.494 HD13 ' CZ ' ' A' ' 131' ' ' PHE . 1.2 mt -82.73 69.4 9.51 Favored 'General case' 0 C--N 1.346 0.449 1 CA-C-N 108.356 -4.02 . . . . 0.0 107.338 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -73.88 111.01 8.62 Favored 'General case' 0 CA--C 1.501 -0.938 1 O-C-N 129.316 4.135 . . . . 0.0 110.26 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.44 160.13 23.73 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 126.821 2.576 . . . . 0.0 113.46 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.23 160.4 36.25 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 127.006 2.691 . . . . 0.0 105.175 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.468 ' HB3' ' CD ' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -163.95 70.57 0.21 Allowed 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 125.197 2.427 . . . . 0.0 110.952 -179.647 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.2 -57.59 0.44 Allowed Glycine 0 CA--C 1.525 0.708 0 CA-C-N 111.76 -2.473 . . . . 0.0 108.769 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.8 t0 166.8 53.05 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 125.933 1.693 . . . . 0.0 106.549 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -119.8 10.23 11.57 Favored 'General case' 0 N--CA 1.475 0.776 1 O-C-N 129.259 4.099 . . . . 0.0 109.06 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 12.6 p 4.39 72.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.967 1 O-C-N 130.082 4.614 . . . . 0.0 116.761 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 64.1 m -64.33 133.44 52.67 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 119.744 -1.847 . . . . 0.0 112.019 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.28 93.32 4.43 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 128.241 3.463 . . . . 0.0 113.701 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -84.54 157.07 21.38 Favored 'General case' 0 CA--C 1.499 -1.001 0 C-N-CA 116.12 -2.232 . . . . 0.0 115.311 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 74.3 t -140.43 123.54 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 126.482 3.039 . . . . 0.0 106.958 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.494 ' CZ ' HD13 ' A' ' 118' ' ' LEU . 4.3 m-85 -100.74 -177.75 3.57 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 110.226 -3.17 . . . . 0.0 115.82 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.464 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.257 0.0 OUTLIER -157.89 124.29 4.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 110.751 -2.931 . . . . 0.0 103.885 179.895 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.528 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 30.6 tttt -75.66 113.77 13.48 Favored 'General case' 0 C--O 1.198 -1.643 1 O-C-N 129.147 4.029 . . . . 0.0 112.406 179.609 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.405 ' CB ' HG21 ' A' ' 8' ' ' THR . 32.5 ttmt . . . . . 0 CA--C 1.498 -1.039 0 N-CA-C 116.547 2.055 . . . . 0.0 116.547 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.513 ' HD3' ' CZ3' ' A' ' 89' ' ' TRP . 9.4 mttm . . . . . 0 CA--C 1.504 -0.822 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -80.52 -97.32 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 102.704 -3.073 . . . . 0.0 102.704 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -175.28 -94.18 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 113.506 -3.14 . . . . 0.0 107.692 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 158.25 112.83 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.018 1 O-C-N 130.116 4.635 . . . . 0.0 111.771 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 177.65 -141.17 5.1 Favored Glycine 0 C--O 1.209 -1.456 0 CA-C-O 117.057 -1.968 . . . . 0.0 114.967 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.512 ' CG2' ' CG2' ' A' ' 40' ' ' THR . 63.2 m -147.31 148.86 31.83 Favored 'General case' 0 C--O 1.215 -0.715 1 O-C-N 130.193 4.114 . . . . 0.0 104.003 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.536 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.258 0.0 OUTLIER -139.26 118.06 12.38 Favored 'General case' 0 CA--C 1.508 -0.65 1 O-C-N 130.128 4.642 . . . . 0.0 111.594 -179.112 . . . . . . . . 5 4 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.94 -6.29 32.0 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 126.891 2.62 . . . . 0.0 115.581 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.9 ttm 83.56 -79.91 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 112.857 -3.449 . . . . 0.0 107.219 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 123.8 -28.23 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.069 0 O-C-N 128.875 3.859 . . . . 0.0 106.62 -179.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.288 3.1 p 164.18 160.97 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 110.872 -2.876 . . . . 0.0 110.182 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -121.67 136.23 54.95 Favored 'General case' 0 CA--C 1.486 -1.514 0 O-C-N 128.55 3.656 . . . . 0.0 115.96 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -87.45 -137.38 0.09 Allowed 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 110.902 -2.863 . . . . 0.0 111.279 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -41.34 95.81 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.186 0 C-N-CA 124.37 1.068 . . . . 0.0 113.077 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -111.07 -36.92 5.5 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-O 126.646 3.117 . . . . 0.0 110.454 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.04 -29.39 60.77 Favored 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 119.758 -1.838 . . . . 0.0 115.455 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.414 ' N ' ' HG3' ' A' ' 18' ' ' GLU . . . -78.29 -23.78 64.89 Favored Glycine 0 N--CA 1.485 1.909 0 O-C-N 127.723 3.14 . . . . 0.0 109.194 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -71.79 -20.37 61.87 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 123.747 1.737 . . . . 0.0 107.966 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.52 -34.68 47.08 Favored 'General case' 0 CA--C 1.488 -1.417 0 C-N-CA 116.705 -1.998 . . . . 0.0 109.237 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.44 ' HD3' ' HB3' ' A' ' 28' ' ' PHE . 2.7 mtmt -71.61 -27.74 63.32 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-N 109.668 -3.424 . . . . 0.0 115.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.64 72.38 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 108.764 -3.835 . . . . 0.0 111.369 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.498 ' CD2' ' N ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -93.36 -24.61 18.04 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 128.462 3.601 . . . . 0.0 107.579 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t0 65.7 74.88 0.36 Allowed 'General case' 0 C--O 1.2 -1.534 1 O-C-N 129.4 4.188 . . . . 0.0 105.38 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.1 tt -104.64 -54.88 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 CA-C-N 109.426 -3.534 . . . . 0.0 115.316 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -167.2 32.44 0.03 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 115.138 -2.363 . . . . 0.0 113.874 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.44 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -16.99 129.35 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 O-C-N 127.975 3.297 . . . . 0.0 117.916 179.568 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 92.91 66.53 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 127.66 3.1 . . . . 0.0 107.745 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -119.69 -47.5 2.42 Favored 'General case' 0 C--O 1.218 -0.598 2 CA-C-N 105.576 -5.284 . . . . 0.0 112.949 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.51 113.51 0.46 Allowed 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 129.691 4.369 . . . . 0.0 107.805 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttt 179.62 -47.76 0.01 OUTLIER 'General case' 0 CA--C 1.491 -1.319 0 O-C-N 127.892 3.245 . . . . 0.0 110.23 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -124.11 -11.18 6.54 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.241 0 O-C-N 126.987 2.68 . . . . 0.0 112.894 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -101.61 19.09 18.69 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-O 124.071 1.891 . . . . 0.0 112.091 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.4 t -49.27 -37.34 10.36 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.374 0 CA-C-N 109.519 -3.491 . . . . 0.0 109.386 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.716 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -171.38 151.01 2.97 Favored 'General case' 0 C--O 1.21 -0.991 1 CA-C-N 106.42 -4.9 . . . . 0.0 112.123 179.833 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.716 ' N ' ' HG3' ' A' ' 36' ' ' ARG . 2.5 pt? 153.99 -19.12 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.991 2 O-C-N 134.88 7.613 . . . . 0.0 106.282 177.026 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.466 ' HA ' ' HB2' ' A' ' 56' ' ' SER . 16.1 m -46.36 -29.46 1.69 Allowed 'General case' 0 N--CA 1.485 1.281 1 O-C-N 132.269 5.981 . . . . 0.0 109.455 175.231 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.557 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.0 OUTLIER 42.57 -171.66 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 118.556 2.798 . . . . 0.0 118.556 179.313 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.557 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 57.5 m -20.13 90.99 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 131.575 3.95 . . . . 0.0 115.522 178.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.521 ' HE3' ' CD1' ' A' ' 9' ' ' TRP 0.262 0.0 OUTLIER -75.33 161.28 29.42 Favored 'General case' 0 N--CA 1.492 1.631 1 O-C-N 129.414 4.196 . . . . 0.0 101.889 178.94 . . . . . . . . 5 4 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.479 ' N ' ' O ' ' A' ' 53' ' ' LYS . 11.6 mt -137.72 164.34 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.282 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.458 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 5.8 tt -140.02 150.02 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.485 0 O-C-N 127.489 2.993 . . . . 0.0 108.932 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.3 t -130.62 -46.67 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 C-N-CA 115.014 -2.674 . . . . 0.0 115.973 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? 32.47 101.53 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 126.052 2.834 . . . . 0.0 115.205 -179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.18 51.88 1.75 Allowed 'General case' 0 CA--C 1.494 -1.179 0 CA-C-N 110.465 -3.061 . . . . 0.0 114.021 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.06 98.28 0.01 OUTLIER Glycine 0 N--CA 1.475 1.267 0 CA-C-N 115.349 -0.841 . . . . 0.0 115.028 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 84.16 -60.49 0.11 Allowed 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 127.645 2.615 . . . . 0.0 110.935 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.37 124.45 33.4 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 128.541 3.651 . . . . 0.0 107.755 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.654 ' CD1' ' CZ ' ' A' ' 65' ' ' PHE . 3.3 t80 -125.12 138.37 54.17 Favored 'General case' 0 CA--C 1.484 -1.583 1 O-C-N 131.059 5.224 . . . . 0.0 117.796 -178.56 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.435 ' HD3' ' HB3' ' A' ' 64' ' ' ASP . 54.0 mttt -145.15 100.32 3.45 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 178.137 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.468 ' CB ' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -84.52 160.66 20.46 Favored 'General case' 0 N--CA 1.473 0.694 1 O-C-N 129.568 4.292 . . . . 0.0 106.251 177.176 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 42' ' ' ILE . 20.1 tttt -158.91 137.72 11.1 Favored 'General case' 0 CA--C 1.481 -1.696 0 C-N-CA 114.119 -3.032 . . . . 0.0 112.327 -177.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.94 123.39 32.0 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 110.343 -3.117 . . . . 0.0 108.877 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.436 ' O ' ' NE2' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -102.41 11.59 37.79 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 113.849 -2.977 . . . . 0.0 114.883 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.466 ' HB2' ' HA ' ' A' ' 38' ' ' THR . 5.6 p -39.6 173.31 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.695 1 O-C-N 133.288 6.617 . . . . 0.0 112.385 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.72 6.08 25.37 Favored 'General case' 0 N--CA 1.48 1.031 1 CA-C-N 107.16 -4.564 . . . . 0.0 102.801 178.886 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.613 ' CE1' ' CD1' ' A' ' 37' ' ' LEU . 2.6 m-30 -121.57 -78.81 0.6 Allowed 'General case' 0 C--N 1.357 0.905 0 O-C-N 126.831 2.582 . . . . 0.0 116.659 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.404 ' N ' ' OG ' ' A' ' 56' ' ' SER . 5.2 mtt180 -106.85 123.55 48.32 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 109.073 -3.694 . . . . 0.0 116.143 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.37 62.35 1.52 Allowed 'General case' 0 C--O 1.198 -1.62 1 O-C-N 129.76 4.412 . . . . 0.0 105.792 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -95.75 16.29 17.87 Favored 'General case' 0 N--CA 1.448 -0.553 2 O-C-N 131.458 5.474 . . . . 0.0 111.271 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 1.89 126.42 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.131 1 O-C-N 133.076 6.485 . . . . 0.0 117.156 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.522 ' HG ' ' CE1' ' A' ' 65' ' ' PHE . 4.2 tp -78.17 61.81 2.76 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.751 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.435 ' HB3' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -101.37 101.12 11.7 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 126.354 2.284 . . . . 0.0 111.112 -179.788 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.654 ' CZ ' ' CD1' ' A' ' 50' ' ' PHE . 17.2 p90 -133.29 -152.38 0.49 Allowed 'General case' 0 CA--C 1.486 -1.5 0 CA-C-O 124.991 2.329 . . . . 0.0 107.527 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -159.08 141.47 13.95 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 118.408 -2.683 . . . . 0.0 104.582 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.408 ' HA ' ' CG1' ' A' ' 87' ' ' VAL . 2.5 t -65.25 131.24 31.05 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.836 0 O-C-N 128.771 3.794 . . . . 0.0 115.823 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 61.92 24.73 65.09 Favored Glycine 0 N--CA 1.474 1.18 0 CA-C-N 112.188 -2.278 . . . . 0.0 116.398 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.316 1.8 p -93.77 -16.5 7.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 O-C-N 126.013 1.655 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 72.88 107.37 0.07 Allowed 'General case' 0 C--N 1.355 0.814 1 O-C-N 129.405 4.19 . . . . 0.0 108.195 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.426 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.7 t80 -97.71 31.63 2.56 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 128.11 3.382 . . . . 0.0 113.649 -178.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -16.8 103.08 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.3 0 C-N-CA 127.245 2.218 . . . . 0.0 116.416 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.434 ' HG3' ' CB ' ' A' ' 82' ' ' ASN . 2.7 tt0 69.92 -168.58 0.17 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-O 124.533 2.111 . . . . 0.0 112.254 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 82.39 85.83 0.04 OUTLIER 'General case' 0 C--O 1.21 -1.002 0 CA-C-O 125.6 2.619 . . . . 0.0 116.798 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.252 0.6 OUTLIER -114.96 -52.11 2.71 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 110.525 -3.034 . . . . 0.0 111.99 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.8 pttt -27.18 111.72 0.05 OUTLIER 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 128.633 3.708 . . . . 0.0 115.302 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 155.41 -33.97 0.64 Allowed Glycine 0 C--O 1.212 -1.223 0 CA-C-N 110.993 -2.821 . . . . 0.0 112.624 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.02 -52.04 2.7 Favored 'General case' 0 N--CA 1.474 0.747 1 CA-C-N 106.896 -4.652 . . . . 0.0 115.587 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.44 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 58.6 t0 -109.84 -60.33 1.8 Allowed 'General case' 0 C--O 1.215 -0.756 0 O-C-N 120.035 -1.666 . . . . 0.0 112.85 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.02 75.05 1.22 Allowed Glycine 0 N--CA 1.477 1.403 0 CA-C-O 126.336 3.187 . . . . 0.0 110.7 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -142.0 -130.2 0.1 Allowed 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 108.807 -3.697 . . . . 0.0 113.2 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.434 ' CB ' ' HG3' ' A' ' 73' ' ' GLU . 0.7 OUTLIER -176.3 111.39 0.1 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 120.006 1.276 . . . . 0.0 110.931 -179.865 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 58.8 t -137.59 144.58 31.01 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.174 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.77 -75.94 0.03 OUTLIER 'General case' 0 CA--C 1.507 -0.703 1 O-C-N 130.108 4.63 . . . . 0.0 110.69 -179.589 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.426 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 7.7 m 71.23 61.56 0.17 Allowed 'General case' 0 CA--C 1.497 -1.067 0 C-N-CA 128.758 2.823 . . . . 0.0 112.878 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.419 ' HG ' ' N ' ' A' ' 87' ' ' VAL . 1.4 tp -82.23 136.38 35.1 Favored 'General case' 0 N--CA 1.43 -1.459 1 CA-C-N 107.723 -4.308 . . . . 0.0 110.44 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.491 HG23 ' CD2' ' A' ' 65' ' ' PHE . 47.8 t -108.83 147.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 125.244 1.418 . . . . 0.0 108.449 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.429 ' N ' HG11 ' A' ' 87' ' ' VAL 0.259 53.3 m -161.12 152.35 18.85 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 111.419 -2.628 . . . . 0.0 112.07 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.654 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.268 19.1 m95 -92.47 121.97 34.45 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 127.341 2.256 . . . . 0.0 105.043 179.738 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.428 ' HG3' HG22 ' A' ' 95' ' ' VAL . 3.4 tt0 -88.22 -148.75 0.16 Allowed 'General case' 0 CA--C 1.477 -1.864 0 CA-C-O 126.381 2.991 . . . . 0.0 112.189 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -42.22 95.86 Favored Glycine 0 N--CA 1.488 2.119 0 N-CA-C 103.342 -3.903 . . . . 0.0 103.342 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -169.8 67.35 0.05 Allowed 'General case' 0 C--O 1.21 -1.008 1 O-C-N 130.04 4.023 . . . . 0.0 110.809 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.42 ' O ' ' CE3' ' A' ' 89' ' ' TRP . 1.7 t 176.15 169.9 0.42 Allowed 'General case' 0 C--O 1.2 -1.549 0 N-CA-C 117.19 2.293 . . . . 0.0 117.19 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.474 HD12 ' CG ' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -96.8 94.22 7.14 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 129.103 2.961 . . . . 0.0 113.921 179.364 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.428 HG22 ' HG3' ' A' ' 90' ' ' GLU 0.319 50.5 t -103.75 141.28 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.898 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 179.776 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -143.81 127.77 17.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 125.433 1.708 . . . . 0.0 107.705 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.401 HG21 ' HB3' ' A' ' 86' ' ' LEU . 35.4 m -104.63 98.8 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.442 0 CA-C-O 127.234 3.397 . . . . 0.0 118.437 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.424 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -73.75 92.24 1.99 Allowed 'General case' 0 C--N 1.355 0.826 0 O-C-N 117.594 -3.191 . . . . 0.0 109.045 179.683 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.41 87.29 4.09 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 108.649 -3.887 . . . . 0.0 111.403 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -145.59 91.83 0.16 Allowed Glycine 0 C--O 1.211 -1.306 0 C-N-CA 117.16 -2.448 . . . . 0.0 113.571 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 49.63 -70.78 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 110.712 -2.744 . . . . 0.0 115.401 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.431 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -100.45 -73.44 0.64 Allowed 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -179.004 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -48.78 160.21 0.2 Allowed 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -128.84 76.91 1.75 Allowed 'General case' 0 N--CA 1.491 1.599 2 O-C-N 131.759 5.662 . . . . 0.0 102.344 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.438 ' HD2' ' HA ' ' A' ' 122' ' ' CYS . 13.7 mmm-85 -87.13 -3.7 59.08 Favored 'General case' 0 C--O 1.212 -0.901 0 O-C-N 127.637 3.086 . . . . 0.0 114.383 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -34.86 86.21 0.01 OUTLIER Glycine 0 CA--C 1.535 1.322 2 CA-C-N 105.796 -5.184 . . . . 0.0 117.24 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.554 ' CD1' ' C ' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -84.66 132.44 34.47 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 127.275 2.397 . . . . 0.0 110.289 178.892 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.422 ' C ' ' NE2' ' A' ' 109' ' ' GLN . 0.3 OUTLIER -159.78 168.87 24.87 Favored 'General case' 0 C--O 1.2 -1.511 1 O-C-N 129.403 4.189 . . . . 0.0 118.458 -179.558 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.437 ' NE2' ' CD1' ' A' ' 107' ' ' TRP . 8.8 mm-40 -128.78 169.61 14.33 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 110.152 -3.204 . . . . 0.0 110.125 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.518 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.2 OUTLIER -166.46 14.39 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.074 1 O-C-N 129.351 4.157 . . . . 0.0 118.565 179.263 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 25.4 t 29.86 105.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.475 -1.912 0 CA-C-O 127.72 3.628 . . . . 0.0 119.673 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.4 ' HG3' ' CD1' ' A' ' 117' ' ' TYR . 3.6 mt-10 -123.05 49.64 1.63 Allowed 'General case' 0 N--CA 1.484 1.271 0 O-C-N 118.479 -2.638 . . . . 0.0 114.033 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.33 -132.82 6.38 Favored Glycine 0 C--O 1.202 -1.854 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.429 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.94 38.59 1.61 Allowed 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 127.677 2.391 . . . . 0.0 114.113 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.441 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 54.9 pttt -168.2 162.17 12.7 Favored 'General case' 0 CA--C 1.515 -0.384 1 O-C-N 130.747 5.029 . . . . 0.0 110.129 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.4 tt -118.8 104.59 10.71 Favored 'General case' 0 C--O 1.207 -1.165 0 O-C-N 126.285 2.241 . . . . 0.0 114.371 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.4 ' CD1' ' HG3' ' A' ' 112' ' ' GLU . 51.7 m-85 -57.94 110.35 0.9 Allowed 'General case' 0 C--O 1.201 -1.491 1 O-C-N 129.554 4.283 . . . . 0.0 115.343 179.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.52 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -98.37 71.52 2.05 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 127.803 3.19 . . . . 0.0 106.533 179.89 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.518 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.3 mt-10 -83.5 105.58 14.55 Favored 'General case' 0 CA--C 1.484 -1.564 1 O-C-N 130.294 4.746 . . . . 0.0 112.277 -179.883 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.15 155.57 20.87 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 114.151 -1.386 . . . . 0.0 108.376 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.9 m -109.9 161.48 15.44 Favored 'General case' 0 CA--C 1.489 -1.391 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.438 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -161.45 72.39 0.41 Allowed 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 121.259 1.845 . . . . 0.0 115.008 -179.957 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 34.6 67.1 0.28 Allowed Glycine 0 N--CA 1.435 -1.374 0 C-N-CA 126.397 1.951 . . . . 0.0 114.557 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 119.43 -56.15 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.342 0 O-C-N 128.888 3.346 . . . . 0.0 109.85 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -75.44 162.13 28.61 Favored 'General case' 0 C--N 1.352 0.683 0 O-C-N 127.972 3.295 . . . . 0.0 107.627 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 7.7 t -146.18 82.7 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 CA-C-N 109.214 -3.63 . . . . 0.0 113.335 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 38.8 t -51.26 144.53 9.46 Favored 'General case' 0 CA--C 1.504 -0.805 0 O-C-N 124.644 1.215 . . . . 0.0 109.614 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -135.39 63.79 1.6 Allowed 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 116.953 -1.498 . . . . 0.0 113.215 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -48.18 168.07 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.727 1 O-C-N 129.767 4.417 . . . . 0.0 115.484 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.35 120.73 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 102.71 -3.071 . . . . 0.0 102.71 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.52 ' CE1' ' CB ' ' A' ' 118' ' ' LEU . 30.8 m-85 -102.12 178.87 4.48 Favored 'General case' 0 CA--C 1.475 -1.934 0 CA-C-O 127.098 3.332 . . . . 0.0 118.538 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.424 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.1 OUTLIER -168.85 117.78 0.69 Allowed 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 110.593 -3.003 . . . . 0.0 108.947 -179.55 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.524 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 28.2 ttpt -59.38 108.07 0.66 Allowed 'General case' 0 CA--C 1.488 -1.421 0 O-C-N 128.104 3.377 . . . . 0.0 116.156 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.501 -0.91 0 CA-C-O 114.786 -2.53 . . . . 0.0 113.489 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.537 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 0.5 OUTLIER . . . . . 0 CA--C 1.498 -1.056 0 N-CA-C 119.32 3.081 . . . . 0.0 119.32 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.32 122.2 27.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -134.05 31.38 3.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 113.744 -3.026 . . . . 0.0 108.621 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -24.41 128.16 0.03 OUTLIER 'General case' 0 C--O 1.236 0.381 1 O-C-N 130.136 4.648 . . . . 0.0 110.63 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.37 -118.15 0.51 Allowed Glycine 0 C--O 1.221 -0.693 0 C-N-CA 115.746 -3.121 . . . . 0.0 114.511 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.56 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 98.4 m 177.67 144.54 0.11 Allowed 'General case' 0 N--CA 1.476 0.85 1 O-C-N 132.504 5.473 . . . . 0.0 106.018 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.56 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -144.5 90.07 2.06 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -179.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -57.69 100.75 0.06 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 128.493 3.621 . . . . 0.0 106.779 179.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.403 ' O ' ' CB ' ' A' ' 12' ' ' GLU . 32.2 ttm -32.61 -59.89 0.31 Allowed 'General case' 0 N--CA 1.479 0.99 0 O-C-N 129.099 4.0 . . . . 0.0 109.611 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.403 ' CB ' ' O ' ' A' ' 11' ' ' MET . 1.9 tt0 98.58 -44.54 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.012 0 O-C-N 125.946 2.029 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.25 15.7 m -174.62 149.41 1.25 Allowed 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 110.015 -3.266 . . . . 0.0 113.711 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -125.38 139.62 53.51 Favored 'General case' 0 C--O 1.213 -0.867 2 O-C-N 129.816 4.447 . . . . 0.0 110.495 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -71.08 -95.53 0.01 OUTLIER 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 109.375 -3.557 . . . . 0.0 111.31 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 5.1 p30 -83.94 147.18 27.62 Favored 'General case' 0 C--O 1.204 -1.297 0 O-C-N 119.225 -2.172 . . . . 0.0 109.004 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -116.8 -68.39 0.92 Allowed 'General case' 0 C--O 1.204 -1.316 0 O-C-N 127.041 2.713 . . . . 0.0 111.263 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 -46.73 87.01 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 117.747 2.499 . . . . 0.0 117.747 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.49 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.18 -25.36 25.11 Favored Glycine 0 CA--C 1.491 -1.415 0 O-C-N 128.786 3.804 . . . . 0.0 113.308 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.506 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -75.14 -43.18 54.05 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 104.734 -2.321 . . . . 0.0 104.734 179.399 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -72.12 -21.54 61.46 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 116.487 -2.085 . . . . 0.0 112.302 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.49 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 1.3 ttmt -76.87 -40.92 45.86 Favored 'General case' 0 C--O 1.207 -1.135 0 O-C-N 129.023 3.952 . . . . 0.0 113.084 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.45 ' CB ' ' HB2' ' A' ' 122' ' ' CYS . . . -56.3 -44.38 79.83 Favored 'General case' 0 C--O 1.214 -0.815 0 O-C-N 128.905 3.878 . . . . 0.0 115.222 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.502 ' CD1' ' HB2' ' A' ' 79' ' ' ASP . 0.1 OUTLIER -88.96 1.6 55.21 Favored 'General case' 0 N--CA 1.491 1.576 2 O-C-N 130.76 5.038 . . . . 0.0 109.177 -178.661 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 50.22 82.92 0.05 OUTLIER 'General case' 0 CA--C 1.48 -1.726 0 CA-C-O 127.83 3.681 . . . . 0.0 114.447 178.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.438 HD13 ' HA ' ' A' ' 78' ' ' LEU . 2.2 tt -110.8 -33.56 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.632 0 CA-C-N 110.946 -2.843 . . . . 0.0 111.873 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 179.82 127.59 0.08 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.539 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -79.18 12.88 2.08 Favored 'General case' 0 CA--C 1.5 -0.946 0 C-N-CA 116.162 -2.215 . . . . 0.0 116.485 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -172.61 75.05 0.04 OUTLIER 'General case' 0 C--O 1.208 -1.102 0 CA-C-O 123.09 1.424 . . . . 0.0 110.712 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.66 -31.67 6.1 Favored 'General case' 0 C--N 1.353 0.724 2 CA-C-N 106.348 -4.933 . . . . 0.0 115.872 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.418 ' CG ' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -57.04 -164.57 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.963 1 O-C-N 129.654 4.346 . . . . 0.0 112.514 -179.775 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' A' ' 31' ' ' ARG . 14.5 tttm 67.76 39.61 2.63 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 125.658 1.849 . . . . 0.0 108.58 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -166.0 -49.78 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.93 2 O-C-N 130.095 4.622 . . . . 0.0 111.534 179.934 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.14 18.55 9.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.657 -1.902 . . . . 0.0 113.912 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.6 t -40.31 -36.35 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.278 0 CA-C-O 124.231 1.967 . . . . 0.0 110.372 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.606 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -154.69 153.86 31.99 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 109.831 -3.349 . . . . 0.0 107.687 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.655 HD11 ' CG ' ' A' ' 58' ' ' PHE . 2.1 pt? 148.79 -18.21 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 2 O-C-N 135.608 8.068 . . . . 0.0 110.811 178.755 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.501 ' HA ' ' CB ' ' A' ' 56' ' ' SER 0.265 0.5 OUTLIER -77.13 51.32 0.81 Allowed 'General case' 0 CA--C 1.48 -1.728 0 C-N-CA 130.547 3.539 . . . . 0.0 119.063 -176.837 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.465 ' HG2' ' N ' ' A' ' 40' ' ' THR . 38.9 tt0 -122.42 144.25 49.16 Favored 'General case' 0 CA--C 1.493 -1.224 0 O-C-N 119.106 -2.246 . . . . 0.0 116.69 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.465 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 99.6 m 97.85 64.5 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.327 0 C-N-CA 130.352 3.461 . . . . 0.0 111.072 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.456 ' HD3' ' C ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -76.46 150.07 36.73 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 108.406 -3.997 . . . . 0.0 101.93 179.752 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.489 ' CD1' ' HD2' ' A' ' 53' ' ' LYS . 2.3 mt -143.0 158.5 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 125.65 1.844 . . . . 0.0 109.246 179.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.408 HG13 ' CE2' ' A' ' 50' ' ' PHE 0.292 18.2 tt -132.95 148.17 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 1 O-C-N 129.399 4.187 . . . . 0.0 111.428 -179.685 . . . . . . . . 4 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 77.7 t -154.95 85.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.658 0 CA-C-N 111.93 -2.395 . . . . 0.0 110.066 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.74 84.72 6.3 Favored 'General case' 0 CA--C 1.485 -1.519 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.07 -13.7 59.92 Favored 'General case' 0 C--N 1.364 1.198 0 O-C-N 126.933 2.646 . . . . 0.0 117.985 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 146.33 -103.3 0.27 Allowed Glycine 0 C--O 1.212 -1.273 0 N-CA-C 111.432 -0.667 . . . . 0.0 111.432 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.07 40.24 1.36 Allowed 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 124.58 0.812 . . . . 0.0 110.776 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -176.29 86.39 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 O-C-N 127.048 2.717 . . . . 0.0 109.318 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.515 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 1.8 t80 -99.19 135.12 41.06 Favored 'General case' 0 CA--C 1.486 -1.499 1 O-C-N 131.187 5.304 . . . . 0.0 112.105 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -144.48 90.53 2.1 Favored 'General case' 0 CA--C 1.481 -1.71 0 O-C-N 128.63 3.706 . . . . 0.0 117.421 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.75 120.06 15.8 Favored 'General case' 0 CA--C 1.501 -0.917 0 O-C-N 128.276 3.485 . . . . 0.0 106.907 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.489 ' HD2' ' CD1' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.83 146.17 49.4 Favored 'General case' 0 CA--C 1.49 -1.344 0 C-N-CA 117.407 -1.717 . . . . 0.0 107.967 -178.605 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.495 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 5.7 t -105.95 175.18 5.58 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.147 1.529 . . . . 0.0 113.22 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -148.96 37.53 0.79 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.501 ' CB ' ' HA ' ' A' ' 38' ' ' THR . 1.1 p -62.54 142.15 58.11 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 128.513 2.725 . . . . 0.0 108.314 179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 37' ' ' LEU 0.254 0.1 OUTLIER -39.45 -50.56 2.13 Favored 'General case' 0 N--CA 1.489 1.518 1 O-C-N 130.608 4.942 . . . . 0.0 106.669 -179.952 . . . . . . . . 5 4 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.655 ' CG ' HD11 ' A' ' 37' ' ' LEU . 12.2 p90 -166.57 76.38 0.19 Allowed 'General case' 0 C--N 1.366 1.318 0 O-C-N 126.967 2.667 . . . . 0.0 115.203 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.62 51.29 0.0 OUTLIER 'General case' 0 C--N 1.363 1.186 1 CA-C-N 107.298 -4.501 . . . . 0.0 111.235 179.788 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.495 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 15.6 m-80 -86.59 107.17 18.03 Favored 'General case' 0 C--O 1.219 -0.543 2 CA-C-N 107.799 -4.273 . . . . 0.0 112.777 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -124.94 98.3 5.63 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 127.943 3.277 . . . . 0.0 106.816 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.63 152.68 41.56 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.495 2.997 . . . . 0.0 115.552 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.527 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 11.9 tp -117.8 47.17 1.6 Allowed 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 112.95 -1.932 . . . . 0.0 111.456 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -87.1 94.37 9.62 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 124.479 2.085 . . . . 0.0 112.544 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.527 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -140.05 -153.01 0.44 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 126.103 1.761 . . . . 0.0 106.528 179.447 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.417 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -151.03 -178.63 6.72 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-O 116.873 -1.537 . . . . 0.0 108.017 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.417 ' N ' ' OG1' ' A' ' 66' ' ' THR . 63.4 t -80.64 119.24 29.81 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.642 1 O-C-N 133.74 6.9 . . . . 0.0 112.597 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.52 9.48 55.42 Favored Glycine 0 N--CA 1.484 1.885 0 CA-C-N 109.451 -3.522 . . . . 0.0 117.447 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.447 HG12 ' N ' ' A' ' 71' ' ' PHE 0.285 14.0 p -59.78 -17.79 13.91 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 O-C-N 124.902 1.001 . . . . 0.0 111.312 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.61 63.17 1.2 Allowed 'General case' 0 CA--C 1.543 0.681 0 O-C-N 128.546 3.654 . . . . 0.0 107.433 -179.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.447 ' N ' HG12 ' A' ' 69' ' ' VAL . 12.0 t80 -64.85 141.46 58.77 Favored 'General case' 0 CA--C 1.494 -1.211 2 CA-C-N 106.33 -4.941 . . . . 0.0 118.954 -178.164 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -100.32 104.15 15.59 Favored 'General case' 0 C--O 1.21 -1.026 0 O-C-N 119.347 -2.096 . . . . 0.0 110.225 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -72.11 74.32 0.93 Allowed 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 125.336 2.493 . . . . 0.0 109.642 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -80.24 116.59 20.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 109.509 -3.496 . . . . 0.0 112.008 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.469 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.2 OUTLIER -157.66 -179.47 8.19 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 114.013 -1.449 . . . . 0.0 113.04 -179.62 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.469 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -150.54 -52.2 0.14 Allowed 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 127.185 3.374 . . . . 0.0 110.43 179.51 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -44.65 -32.88 3.1 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 108.793 -3.821 . . . . 0.0 108.261 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.438 ' HA ' HD13 ' A' ' 26' ' ' ILE . 5.0 tp -124.05 79.89 1.77 Allowed 'General case' 0 CA--C 1.529 0.165 0 O-C-N 129.22 3.541 . . . . 0.0 115.536 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.502 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 17.7 t70 85.82 -63.81 0.05 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.807 3.192 . . . . 0.0 110.333 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.83 119.58 2.46 Favored Glycine 0 C--O 1.213 -1.177 0 CA-C-N 109.02 -3.718 . . . . 0.0 115.868 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.414 ' HD3' ' CG2' ' A' ' 83' ' ' VAL . 0.0 OUTLIER -171.02 -123.55 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 O-C-N 126.818 2.128 . . . . 0.0 113.413 179.836 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.0 p30 168.8 63.44 0.0 OUTLIER 'General case' 0 C--O 1.197 -1.698 0 CA-C-N 119.923 1.238 . . . . 0.0 112.417 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.414 ' CG2' ' HD3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -90.84 158.93 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.027 0 CA-C-O 116.418 -1.753 . . . . 0.0 112.717 179.948 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.416 ' HE2' ' N ' ' A' ' 84' ' ' LYS . 7.8 mmpt? -68.28 169.0 11.29 Favored 'General case' 0 C--N 1.326 -0.44 1 O-C-N 129.392 4.183 . . . . 0.0 107.053 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.425 HG23 ' HB3' ' A' ' 71' ' ' PHE . 1.2 m -171.32 77.3 0.06 Allowed 'General case' 0 C--O 1.194 -1.823 1 O-C-N 131.11 5.256 . . . . 0.0 111.107 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.1 tt -68.38 141.52 55.7 Favored 'General case' 0 N--CA 1.431 -1.398 1 CA-C-N 105.975 -5.102 . . . . 0.0 109.886 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.51 HG12 ' CE1' ' A' ' 65' ' ' PHE . 46.1 t -129.91 144.43 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.069 1.347 . . . . 0.0 108.446 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.9 t -163.49 177.26 9.0 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 126.378 2.99 . . . . 0.0 110.482 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.666 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 65.3 m95 -102.12 133.99 46.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 128.484 2.714 . . . . 0.0 110.236 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.1 -37.82 15.91 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-O 131.651 5.501 . . . . 0.0 111.605 179.871 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.08 65.32 0.32 Allowed Glycine 0 N--CA 1.481 1.655 2 CA-C-N 106.429 -4.896 . . . . 0.0 102.226 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.428 ' ND2' ' HB ' ' A' ' 93' ' ' THR . 1.0 OUTLIER 149.26 -36.2 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 132.888 5.699 . . . . 0.0 111.007 -179.87 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.428 ' HB ' ' ND2' ' A' ' 92' ' ' ASN . 0.7 OUTLIER -136.46 174.55 10.5 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 119.19 3.033 . . . . 0.0 119.19 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.87 82.6 2.27 Favored 'General case' 0 CA--C 1.485 -1.548 0 C-N-CA 129.596 3.159 . . . . 0.0 115.766 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.339 97.9 t -77.19 131.53 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-N 108.888 -3.778 . . . . 0.0 113.188 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.546 ' CB ' ' CZ2' ' A' ' 107' ' ' TRP . 0.5 OUTLIER -141.39 134.17 28.77 Favored 'General case' 0 C--O 1.201 -1.449 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -131.63 123.2 51.7 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.107 0 CA-C-N 109.58 -3.463 . . . . 0.0 116.035 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.509 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 1.4 tt0 -85.37 98.67 10.69 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 126.747 3.165 . . . . 0.0 110.382 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -81.65 158.79 24.17 Favored 'General case' 0 C--O 1.205 -1.251 1 CA-C-N 108.11 -4.132 . . . . 0.0 106.846 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.4 138.93 5.85 Favored Glycine 0 C--O 1.211 -1.306 0 O-C-N 126.947 2.654 . . . . 0.0 107.212 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 63.24 163.26 0.11 Allowed 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 109.48 -3.36 . . . . 0.0 108.718 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -39.96 -58.48 1.4 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 112.114 -2.312 . . . . 0.0 111.548 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.17 146.22 0.93 Allowed 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 111.128 -2.76 . . . . 0.0 113.192 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -127.17 64.55 1.32 Allowed 'General case' 0 N--CA 1.483 1.22 2 O-C-N 130.141 4.65 . . . . 0.0 103.576 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.509 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 3.6 mmm180 -67.33 69.73 0.1 Allowed 'General case' 0 N--CA 1.478 0.972 0 O-C-N 128.127 3.392 . . . . 0.0 113.853 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -114.08 95.92 0.76 Allowed Glycine 0 C--O 1.205 -1.67 0 CA-C-O 113.689 -3.84 . . . . 0.0 111.769 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.546 ' CZ2' ' CB ' ' A' ' 96' ' ' CYS . 9.3 p90 -88.71 1.8 54.48 Favored 'General case' 0 C--O 1.195 -1.791 2 O-C-N 134.226 6.486 . . . . 0.0 115.656 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.518 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 7.0 ptpt -24.5 141.63 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.359 2 O-C-N 130.482 4.864 . . . . 0.0 113.819 -179.338 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.607 ' N ' HE21 ' A' ' 109' ' ' GLN 0.287 0.3 OUTLIER -102.96 169.98 8.25 Favored 'General case' 0 C--N 1.362 1.147 0 CA-C-N 112.539 -2.119 . . . . 0.0 109.793 -179.786 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.518 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 19.0 m95 -127.11 -57.93 1.3 Allowed 'General case' 0 C--O 1.208 -1.11 1 O-C-N 129.587 4.304 . . . . 0.0 116.968 179.47 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 21.2 t 93.05 68.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-O 127.635 3.588 . . . . 0.0 108.654 -175.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.21 120.27 40.19 Favored 'General case' 0 CA--C 1.478 -1.818 1 CA-C-N 108.069 -4.15 . . . . 0.0 118.302 -176.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 14.79 83.73 0.01 OUTLIER Glycine 0 C--O 1.215 -1.073 0 C-N-CA 127.289 2.376 . . . . 0.0 116.183 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 49.38 81.11 0.06 Allowed 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 115.81 -2.043 . . . . 0.0 116.239 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.453 ' HB2' ' HB3' ' A' ' 131' ' ' PHE . 0.4 OUTLIER 148.13 -167.77 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.132 1 O-C-N 133.79 6.931 . . . . 0.0 110.46 -179.855 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.481 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -145.99 71.26 1.26 Allowed 'General case' 0 CA--C 1.493 -1.245 0 O-C-N 128.938 3.899 . . . . 0.0 115.589 -179.936 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.435 ' CZ ' ' HE3' ' A' ' 115' ' ' LYS . 4.2 m-30 -44.67 126.23 5.42 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 126.727 2.517 . . . . 0.0 116.255 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.486 ' CD2' ' HG3' ' A' ' 109' ' ' GLN . 28.4 mt -110.24 117.7 34.37 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 111.396 -2.638 . . . . 0.0 106.578 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.37 105.22 13.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 115.728 -2.082 . . . . 0.0 106.198 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.13 118.96 34.83 Favored 'General case' 0 N--CA 1.489 1.487 1 O-C-N 131.328 5.392 . . . . 0.0 114.023 -179.739 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.2 m -96.72 145.81 25.46 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 110.643 -2.981 . . . . 0.0 103.758 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.45 ' HB2' ' CB ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -133.62 39.68 3.18 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 125.382 2.515 . . . . 0.0 111.295 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 114.06 -80.97 0.29 Allowed Glycine 0 C--O 1.218 -0.851 0 CA-C-N 113.428 -1.715 . . . . 0.0 109.96 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.24 -18.77 13.52 Favored 'General case' 0 CA--C 1.494 -1.202 0 C-N-CA 125.547 1.539 . . . . 0.0 111.876 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -103.55 159.93 15.17 Favored 'General case' 0 C--O 1.198 -1.643 0 O-C-N 125.855 1.972 . . . . 0.0 107.611 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 11.0 m -134.01 131.53 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 CA-C-N 109.215 -3.629 . . . . 0.0 112.542 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.7 m -117.86 119.64 35.49 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 116.297 -1.811 . . . . 0.0 110.006 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.24 102.95 12.64 Favored 'General case' 0 N--CA 1.484 1.269 1 O-C-N 129.258 4.099 . . . . 0.0 110.885 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -68.4 167.17 15.19 Favored 'General case' 0 CA--C 1.491 -1.309 0 C-N-CA 114.121 -3.032 . . . . 0.0 116.049 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.3 t -141.8 81.07 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.605 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.453 ' HB3' ' HB2' ' A' ' 115' ' ' LYS . 16.2 m-85 -66.92 175.58 2.42 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 109.968 -3.287 . . . . 0.0 117.976 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.258 4.3 tptt -159.93 99.7 1.39 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 109.036 -3.711 . . . . 0.0 107.872 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.54 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 28.1 ttpt -57.56 110.03 0.8 Allowed 'General case' 0 C--O 1.218 -0.585 0 CA-C-O 115.539 -2.172 . . . . 0.0 109.904 178.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.492 -1.262 0 N-CA-C 118.756 2.873 . . . . 0.0 118.756 -178.65 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.528 ' HE2' ' CE3' ' A' ' 89' ' ' TRP . 1.4 mtmt . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 29.2 t0 44.9 71.37 0.27 Allowed 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 124.501 2.096 . . . . 0.0 107.759 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -97.57 -75.88 0.53 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.205 -179.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.424 ' OD1' ' N ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 47.26 135.05 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.629 1 O-C-N 131.897 5.748 . . . . 0.0 114.473 -176.677 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.3 -133.87 1.63 Allowed Glycine 0 C--O 1.206 -1.603 0 CA-C-N 109.874 -3.33 . . . . 0.0 114.431 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.9 t -174.47 62.36 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.321 1 O-C-N 131.476 4.868 . . . . 0.0 108.129 -179.023 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.613 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.253 0.0 OUTLIER -51.82 106.77 0.16 Allowed 'General case' 0 CA--C 1.507 -0.675 1 O-C-N 130.677 4.986 . . . . 0.0 115.595 -179.495 . . . . . . . . 5 4 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -48.8 -25.81 2.05 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 116.966 -1.493 . . . . 0.0 114.162 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.5 ttp 83.65 -74.39 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.9 1 O-C-N 129.609 4.318 . . . . 0.0 105.744 -179.855 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 102.1 -48.08 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.527 0 O-C-N 128.028 3.33 . . . . 0.0 111.773 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.6 137.13 28.12 Favored 'General case' 0 C--N 1.361 1.087 0 CA-C-N 110.143 -3.208 . . . . 0.0 110.006 -179.803 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -121.01 100.23 6.95 Favored 'General case' 0 C--O 1.197 -1.686 0 N-CA-C 117.942 2.571 . . . . 0.0 117.942 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.434 ' HB2' ' N ' ' A' ' 128' ' ' ARG . 15.9 pt-20 5.37 -133.5 0.0 OUTLIER 'General case' 0 CA--C 1.473 -1.987 2 O-C-N 136.34 8.525 . . . . 0.0 117.005 178.402 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.41 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 0.3 OUTLIER -112.64 137.25 51.18 Favored 'General case' 0 C--O 1.203 -1.354 1 O-C-N 114.651 -5.031 . . . . 0.0 106.755 -179.519 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.52 ' CE2' HG23 ' A' ' 35' ' ' VAL . 1.9 p90 -118.19 -30.15 5.37 Favored 'General case' 0 CA--C 1.487 -1.469 0 O-C-N 127.565 3.041 . . . . 0.0 114.908 -178.563 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 22' ' ' LYS . 12.3 tt0 -74.78 -53.84 8.44 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 115.778 -2.058 . . . . 0.0 110.551 179.757 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.517 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -59.3 -24.35 58.9 Favored Glycine 0 N--CA 1.474 1.217 1 O-C-N 132.869 6.356 . . . . 0.0 111.479 178.741 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.444 ' HH ' ' NH1' ' A' ' 105' ' ' ARG . 15.6 t80 -70.77 -46.74 62.38 Favored 'General case' 0 C--O 1.195 -1.767 0 CA-C-O 125.752 2.692 . . . . 0.0 106.047 179.676 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.9 mmt -73.35 -23.71 60.25 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.495 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.517 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -78.99 -28.06 43.41 Favored 'General case' 0 C--O 1.206 -1.231 0 O-C-N 127.901 3.251 . . . . 0.0 110.124 -179.862 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -63.9 -37.62 88.06 Favored 'General case' 0 C--O 1.208 -1.097 1 O-C-N 129.517 4.26 . . . . 0.0 111.734 -179.778 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.472 ' CD1' ' HB2' ' A' ' 79' ' ' ASP 0.361 1.5 mm? -81.45 -56.23 4.17 Favored 'General case' 0 C--O 1.208 -1.128 2 CA-C-N 105.517 -5.31 . . . . 0.0 108.501 179.98 . . . . . . . . 4 3 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.291 19.3 t0 83.71 79.01 0.02 OUTLIER 'General case' 0 CA--C 1.484 -1.577 3 O-C-N 133.48 6.738 . . . . 0.0 107.258 -179.523 . . . . . . . . 3 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 14.0 tt -102.29 41.13 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 128.397 3.951 . . . . 0.0 110.052 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.04 164.35 0.28 Allowed 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 109.701 -3.409 . . . . 0.0 111.641 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -87.45 84.69 7.13 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 118.812 0.733 . . . . 0.0 112.422 179.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 169.53 156.61 0.05 Allowed 'General case' 0 C--N 1.364 1.231 0 O-C-N 126.382 2.301 . . . . 0.0 106.07 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.274 0.4 OUTLIER 101.06 -19.22 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.847 1 O-C-N 130.876 5.11 . . . . 0.0 113.935 179.669 . . . . . . . . 4 3 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.6 162.16 15.99 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 130.562 3.545 . . . . 0.0 108.865 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 84.36 3.14 0.79 Allowed 'General case' 0 C--N 1.31 -1.139 0 O-C-N 128.431 3.582 . . . . 0.0 111.827 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 mp -128.87 -33.82 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.137 1 O-C-N 130.191 4.682 . . . . 0.0 111.404 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.566 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -99.52 16.05 24.54 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.914 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.52 HG23 ' CE2' ' A' ' 17' ' ' PHE . 12.1 t -26.78 -52.23 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.2 -1.547 0 O-C-N 127.167 2.792 . . . . 0.0 111.0 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.99 117.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 2 O-C-N 131.132 5.27 . . . . 0.0 109.144 179.674 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 58' ' ' PHE . 2.5 pp -87.3 -45.01 10.99 Favored 'General case' 0 N--CA 1.433 -1.288 1 O-C-N 129.406 4.191 . . . . 0.0 110.664 -179.923 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.466 ' N ' ' CD1' ' A' ' 37' ' ' LEU . 1.3 m 145.64 117.31 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.206 1 O-C-N 134.569 7.418 . . . . 0.0 116.915 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.522 ' HG2' ' N ' ' A' ' 56' ' ' SER . 5.4 tp60 -158.12 -98.94 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 115.677 -2.409 . . . . 0.0 116.456 179.148 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.518 ' N ' ' HG3' ' A' ' 39' ' ' GLN . 1.9 m 157.72 151.55 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.597 1 O-C-N 132.633 6.208 . . . . 0.0 111.768 -175.359 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.539 ' HE3' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -110.27 131.93 54.62 Favored 'General case' 0 N--CA 1.492 1.649 1 O-C-N 129.791 4.432 . . . . 0.0 101.656 177.979 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.456 ' HB ' ' HB3' ' A' ' 53' ' ' LYS . 3.2 mp -107.8 164.43 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 126.333 2.271 . . . . 0.0 111.19 179.511 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.445 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 0.5 OUTLIER -141.94 143.59 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.407 0 CA-C-N 112.386 -2.188 . . . . 0.0 106.855 179.789 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.9 t -117.15 -66.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.223 0 C-N-CA 115.735 -2.386 . . . . 0.0 109.844 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 57.84 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 117.156 2.28 . . . . 0.0 117.156 -179.88 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -121.43 29.11 7.39 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 127.209 2.818 . . . . 0.0 116.685 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 117.57 -74.52 0.28 Allowed Glycine 0 C--O 1.213 -1.17 0 CA-C-O 118.698 -1.056 . . . . 0.0 111.914 -179.799 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.23 -37.62 5.25 Favored 'General case' 0 N--CA 1.438 -1.037 0 O-C-N 126.463 1.92 . . . . 0.0 112.753 -179.828 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -83.75 85.43 7.29 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.519 1.928 . . . . 0.0 111.915 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.511 ' CE2' HD21 ' A' ' 94' ' ' LEU . 76.7 t80 -86.96 79.89 8.61 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 127.293 2.871 . . . . 0.0 112.315 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -95.96 77.13 3.15 Favored 'General case' 0 CA--C 1.481 -1.7 1 O-C-N 129.678 4.361 . . . . 0.0 118.807 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.521 ' CG2' ' N ' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -65.37 168.92 6.45 Favored 'General case' 0 C--N 1.367 1.332 0 O-C-N 128.221 3.451 . . . . 0.0 107.319 179.812 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.521 ' N ' ' CG2' ' A' ' 52' ' ' THR 0.279 13.1 ttpt -160.3 164.99 32.14 Favored 'General case' 0 N--CA 1.488 1.473 1 O-C-N 129.125 4.016 . . . . 0.0 111.369 -175.856 . . . . . . . . 4 3 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.4 m -140.45 103.31 4.53 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 110.386 -3.097 . . . . 0.0 107.233 178.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -78.01 -20.17 53.01 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 111.374 -2.648 . . . . 0.0 116.187 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.522 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 2.6 t -31.17 117.96 0.19 Allowed 'General case' 0 N--CA 1.469 0.505 1 O-C-N 132.649 6.218 . . . . 0.0 106.156 -179.838 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.465 ' CG2' HD23 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -52.85 -27.16 17.13 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 129.085 3.991 . . . . 0.0 108.396 -179.775 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.566 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 0.4 OUTLIER -61.49 -80.88 0.02 OUTLIER 'General case' 0 C--N 1.355 0.813 0 O-C-N 126.298 2.249 . . . . 0.0 111.297 179.907 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.48 110.01 13.96 Favored 'General case' 0 C--N 1.368 1.373 0 O-C-N 126.842 2.589 . . . . 0.0 112.534 -179.849 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.18 83.82 1.98 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 128.421 3.576 . . . . 0.0 108.599 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.23 -27.95 29.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.812 3.195 . . . . 0.0 111.427 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 155.35 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 127.665 3.103 . . . . 0.0 115.257 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.481 ' CD2' ' CZ2' ' A' ' 107' ' ' TRP . 8.6 tp -121.16 45.28 2.31 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.371 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -81.44 99.51 8.77 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 126.28 2.238 . . . . 0.0 110.736 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.532 ' CG ' ' N ' ' A' ' 66' ' ' THR . 0.0 OUTLIER -149.34 173.76 13.17 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 112.831 -1.986 . . . . 0.0 107.367 179.657 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.532 ' N ' ' CG ' ' A' ' 65' ' ' PHE . 2.1 m -132.13 135.07 46.14 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-O 117.099 -1.429 . . . . 0.0 107.683 179.65 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.41 HG21 ' N ' ' A' ' 68' ' ' GLY . 2.1 p -49.22 146.65 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.674 0 O-C-N 126.947 2.655 . . . . 0.0 114.705 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.41 ' N ' HG21 ' A' ' 67' ' ' VAL . . . 65.79 16.01 63.07 Favored Glycine 0 N--CA 1.485 1.904 0 O-C-N 128.688 3.742 . . . . 0.0 115.952 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.305 1.2 t -86.06 -23.44 6.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.71 -179.642 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 72.97 72.1 0.13 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 128.559 3.662 . . . . 0.0 108.204 -178.832 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.438 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -58.28 94.8 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.723 1 CA-C-N 107.107 -4.588 . . . . 0.0 116.014 -179.662 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.25 96.22 2.76 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.894 -179.854 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.26 107.93 15.32 Favored 'General case' 0 CA--C 1.498 -1.028 0 CA-C-O 122.535 1.16 . . . . 0.0 111.827 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -75.11 -24.07 58.01 Favored 'General case' 0 C--O 1.215 -0.741 0 C-N-CA 117.539 -1.664 . . . . 0.0 110.985 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.5 m 47.75 62.9 2.24 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 112.56 -2.109 . . . . 0.0 114.501 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.58 -34.54 10.54 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 128.014 3.769 . . . . 0.0 114.318 -179.961 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.81 -20.84 76.3 Favored Glycine 0 C--O 1.209 -1.416 0 CA-C-N 109.903 -3.317 . . . . 0.0 113.175 -179.76 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.2 tp -112.81 -11.02 13.53 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 128.103 2.884 . . . . 0.0 115.33 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.472 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 2.7 t70 -173.78 -73.82 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.856 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.613 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.61 76.35 0.26 Allowed Glycine 0 N--CA 1.472 1.047 0 C-N-CA 128.17 2.795 . . . . 0.0 110.681 -179.596 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -116.1 -127.86 0.29 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 109.768 -3.216 . . . . 0.0 109.977 -179.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 165.55 61.14 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.24 1.382 . . . . 0.0 110.887 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -93.27 179.41 0.52 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-N 111.909 -2.405 . . . . 0.0 114.628 -179.812 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -126.2 151.71 47.01 Favored 'General case' 0 C--N 1.314 -0.949 1 O-C-N 133.682 6.864 . . . . 0.0 107.521 179.525 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.442 HG22 ' CZ3' ' A' ' 107' ' ' TRP . 24.2 m -149.01 74.16 1.24 Allowed 'General case' 0 C--O 1.203 -1.353 1 O-C-N 129.171 4.044 . . . . 0.0 113.603 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 132.64 54.43 Favored 'General case' 0 N--CA 1.428 -1.529 2 CA-C-N 106.524 -4.853 . . . . 0.0 109.691 -179.614 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.508 ' HB ' ' CE2' ' A' ' 65' ' ' PHE . 2.0 t -122.77 155.35 28.17 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.139 0 CA-C-O 123.705 1.717 . . . . 0.0 110.606 -179.734 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.7 t -162.68 157.86 22.35 Favored 'General case' 0 CA--C 1.493 -1.247 0 CA-C-N 109.188 -3.642 . . . . 0.0 111.742 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.66 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.266 26.4 m95 -83.38 128.09 34.21 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-O 114.743 -2.551 . . . . 0.0 105.295 179.863 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.444 ' CG ' ' CG2' ' A' ' 95' ' ' VAL . 0.2 OUTLIER -81.59 -5.74 58.33 Favored 'General case' 0 CA--C 1.474 -1.955 1 CA-C-O 130.227 4.822 . . . . 0.0 114.223 -179.644 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 105.86 -3.63 38.88 Favored Glycine 0 C--O 1.197 -2.184 1 N-CA-C 103.098 -4.001 . . . . 0.0 103.098 -179.758 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 179.17 78.68 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.46 0 O-C-N 127.026 2.251 . . . . 0.0 107.568 179.831 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.418 ' O ' ' CE3' ' A' ' 89' ' ' TRP . 4.3 t 124.46 163.86 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.361 0 C-N-CA 129.612 3.165 . . . . 0.0 116.944 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.511 HD21 ' CE2' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -103.32 78.15 1.59 Allowed 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 127.641 3.088 . . . . 0.0 116.913 179.989 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.444 ' CG2' ' CG ' ' A' ' 90' ' ' GLU 0.4 98.7 t -71.55 128.83 35.07 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.254 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.41 ' HB3' HG21 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -125.7 134.61 51.75 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 120.764 1.62 . . . . 0.0 106.668 -179.943 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.9 t -117.64 119.15 60.78 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.475 0 CA-C-O 127.783 3.658 . . . . 0.0 115.413 -179.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.5 ' HG3' ' CA ' ' A' ' 105' ' ' ARG 0.301 16.7 mm100 -78.43 98.67 6.11 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 111.49 -2.595 . . . . 0.0 115.736 179.929 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.6 ttmm -85.95 66.98 9.86 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 115.045 -2.662 . . . . 0.0 109.826 179.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -108.82 -156.4 17.81 Favored Glycine 0 C--O 1.203 -1.806 0 CA-C-O 126.051 3.028 . . . . 0.0 113.71 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.1 tm-20 -159.0 140.24 13.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 108.266 -3.967 . . . . 0.0 107.752 179.879 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 95.0 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 128.352 2.661 . . . . 0.0 111.737 -179.469 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -157.42 170.31 22.74 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 125.156 2.408 . . . . 0.0 113.401 179.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -120.02 95.48 4.78 Favored 'General case' 0 CA--C 1.515 -0.389 1 CA-C-N 106.277 -4.965 . . . . 0.0 104.469 179.973 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.5 ' CA ' ' HG3' ' A' ' 98' ' ' GLN . 5.7 mmm-85 -72.66 -8.48 55.5 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 128.276 3.485 . . . . 0.0 113.969 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.451 ' N ' ' CG ' ' A' ' 98' ' ' GLN . . . -10.7 95.79 0.01 OUTLIER Glycine 0 N--CA 1.431 -1.687 1 O-C-N 133.467 6.729 . . . . 0.0 114.591 179.436 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.547 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.278 0.0 OUTLIER -116.03 116.15 27.39 Favored 'General case' 0 C--O 1.194 -1.825 0 O-C-N 128.308 3.005 . . . . 0.0 109.235 179.317 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.449 ' HA ' ' NE2' ' A' ' 109' ' ' GLN . 2.1 ptpt -149.72 170.28 19.09 Favored 'General case' 0 C--O 1.211 -0.957 1 O-C-N 130.353 4.783 . . . . 0.0 112.238 -179.198 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.463 ' NE2' ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -132.82 171.82 13.4 Favored 'General case' 0 C--N 1.366 1.285 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.771 179.974 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.416 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 0.4 OUTLIER -176.27 93.83 0.05 Allowed 'General case' 0 C--N 1.311 -1.077 1 O-C-N 131.332 5.395 . . . . 0.0 117.24 179.32 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 49.0 t -39.07 107.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 C-N-CA 126.969 2.108 . . . . 0.0 113.029 179.473 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.23 88.88 3.01 Favored 'General case' 0 CA--C 1.488 -1.433 0 CA-C-N 109.981 -3.281 . . . . 0.0 114.208 -179.966 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.48 -112.97 3.75 Favored Glycine 0 C--O 1.2 -2.023 0 N-CA-C 117.524 1.769 . . . . 0.0 117.524 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -122.57 39.85 3.82 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 125.241 1.417 . . . . 0.0 113.74 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.512 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -178.44 162.53 1.48 Allowed 'General case' 0 C--N 1.313 -1.015 1 O-C-N 130.091 4.619 . . . . 0.0 109.407 -179.767 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.515 ' CD1' ' CZ2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -92.96 173.21 7.86 Favored 'General case' 0 CA--C 1.482 -1.669 0 O-C-N 128.656 3.722 . . . . 0.0 115.607 -179.617 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -142.42 80.72 1.71 Allowed 'General case' 0 C--N 1.366 1.292 1 CA-C-N 107.74 -4.3 . . . . 0.0 114.27 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.88 87.56 4.72 Favored 'General case' 0 CA--C 1.516 -0.346 1 CA-C-N 107.648 -4.342 . . . . 0.0 108.342 -179.851 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -94.7 124.96 39.04 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 127.955 3.284 . . . . 0.0 106.689 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.72 145.55 44.8 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 125.001 1.438 . . . . 0.0 108.875 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.5 t -127.55 174.27 9.19 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 125.227 1.579 . . . . 0.0 108.703 179.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 36.5 t -169.01 84.57 0.15 Allowed 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 125.052 1.47 . . . . 0.0 112.345 -179.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.49 -83.37 1.23 Allowed Glycine 0 N--CA 1.442 -0.934 0 O-C-N 127.993 3.308 . . . . 0.0 112.809 179.885 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -113.04 -20.04 11.66 Favored 'General case' 0 CA--C 1.497 -1.064 0 O-C-N 126.736 2.08 . . . . 0.0 112.082 179.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 54.8 mm-40 -91.73 163.65 14.0 Favored 'General case' 0 C--O 1.201 -1.488 0 O-C-N 126.995 2.684 . . . . 0.0 110.435 179.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.6 p -142.8 94.86 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.794 0 CA-C-N 110.006 -3.27 . . . . 0.0 112.077 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 32.0 m -82.67 135.06 35.13 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-O 117.201 -1.38 . . . . 0.0 112.064 -179.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . 0.434 ' N ' ' HB2' ' A' ' 15' ' ' GLU . 1.5 ttp180 -117.93 113.49 21.79 Favored 'General case' 0 CA--C 1.486 -1.492 0 O-C-N 128.276 3.485 . . . . 0.0 115.902 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -88.25 157.52 18.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 115.977 -2.289 . . . . 0.0 112.037 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.5 t -140.13 131.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 N-CA-C 103.01 -2.959 . . . . 0.0 103.01 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.577 ' CD2' ' CB ' ' A' ' 9' ' ' TRP 0.25 4.3 m-30 -119.73 -178.3 3.6 Favored 'General case' 0 CA--C 1.502 -0.89 1 O-C-N 129.247 4.092 . . . . 0.0 113.418 -179.981 . . . . . . . . 4 3 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.435 ' N ' ' HB2' ' A' ' 115' ' ' LYS 0.274 0.0 OUTLIER -167.21 41.56 0.05 OUTLIER 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 114.558 -2.639 . . . . 0.0 104.479 179.516 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.613 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 44.59 -151.87 0.04 OUTLIER 'General case' 0 CA--C 1.49 -1.33 1 O-C-N 131.071 5.232 . . . . 0.0 112.881 -179.387 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.513 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.853 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.673 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.108 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.42 ' HA ' ' NE2' ' A' ' 45' ' ' GLN . 2.2 m-20 56.63 77.53 0.25 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.97 98.61 3.2 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 116.17 -2.212 . . . . 0.0 109.426 179.895 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -65.77 153.66 41.2 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 130.242 3.417 . . . . 0.0 110.606 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 169.02 -148.46 12.27 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-O 114.41 -3.439 . . . . 0.0 109.796 -179.904 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -158.8 136.8 10.49 Favored 'General case' 0 C--N 1.315 -0.927 1 O-C-N 130.773 4.455 . . . . 0.0 103.695 179.919 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.545 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.8 OUTLIER -120.99 124.84 45.84 Favored 'General case' 0 CA--C 1.495 -1.158 1 O-C-N 131.88 5.738 . . . . 0.0 117.854 -179.765 . . . . . . . . 4 4 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 132' ' ' LYS . 9.3 mt-10 -83.0 109.76 17.38 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 116.546 -2.062 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.278 8.4 ttm -67.69 81.62 0.18 Allowed 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 125.131 1.52 . . . . 0.0 108.266 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -37.42 -48.67 0.96 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.989 2.915 . . . . 0.0 110.187 179.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.276 4.0 m -165.8 153.84 10.89 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 108.663 -3.88 . . . . 0.0 110.532 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -105.62 137.93 42.65 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-N 110.31 -3.132 . . . . 0.0 114.293 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.41 -62.48 1.6 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 128.446 3.591 . . . . 0.0 111.562 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.433 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -135.71 138.69 43.0 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 125.623 1.569 . . . . 0.0 108.735 179.803 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 37.0 p90 -123.52 -41.88 2.25 Favored 'General case' 0 C--O 1.207 -1.148 0 CA-C-O 124.502 2.096 . . . . 0.0 112.002 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.574 ' N ' ' CD1' ' A' ' 17' ' ' PHE . 1.8 tm-20 -75.55 -34.06 60.7 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-O 115.065 -2.398 . . . . 0.0 112.216 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.519 ' HA2' ' CG ' ' A' ' 22' ' ' LYS . . . -63.96 -29.65 75.45 Favored Glycine 0 N--CA 1.48 1.578 1 O-C-N 133.469 6.73 . . . . 0.0 111.968 -179.941 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.481 ' CD1' HD22 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -80.05 -43.25 22.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-O 125.935 2.779 . . . . 0.0 109.945 179.716 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.403 ' HB3' ' CG2' ' A' ' 26' ' ' ILE . 19.5 mtt -55.66 -42.95 75.8 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 113.812 -1.54 . . . . 0.0 113.685 -179.579 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.519 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.36 -20.38 59.02 Favored 'General case' 0 C--O 1.213 -0.827 1 O-C-N 129.828 4.455 . . . . 0.0 114.768 179.131 . . . . . . . . 4 4 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.418 ' HB2' HD21 ' A' ' 24' ' ' LEU . . . -65.44 -42.46 92.4 Favored 'General case' 0 C--O 1.212 -0.897 1 O-C-N 132.304 6.003 . . . . 0.0 113.314 -179.979 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.481 HD22 ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -89.12 -10.62 46.62 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 108.897 -3.774 . . . . 0.0 106.656 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 66.52 72.71 0.37 Allowed 'General case' 0 N--CA 1.436 -1.14 0 C-N-CA 129.805 3.242 . . . . 0.0 112.973 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.403 ' CG2' ' HB3' ' A' ' 21' ' ' MET . 8.2 tp -107.48 13.62 8.32 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-O 128.475 3.988 . . . . 0.0 109.456 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -50.25 100.38 0.02 OUTLIER 'General case' 0 C--N 1.357 0.915 0 CA-C-N 109.696 -3.411 . . . . 0.0 111.148 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -144.12 24.67 1.62 Allowed 'General case' 0 CA--C 1.501 -0.907 0 O-C-N 126.604 2.44 . . . . 0.0 112.263 179.71 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.38 49.88 8.31 Favored 'General case' 0 C--O 1.201 -1.481 0 O-C-N 126.966 2.666 . . . . 0.0 110.018 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.57 -26.77 13.72 Favored 'General case' 0 N--CA 1.48 1.032 2 CA-C-N 105.782 -5.19 . . . . 0.0 110.307 -179.855 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.42 ' HG2' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -74.21 -166.99 0.46 Allowed 'General case' 0 C--N 1.315 -0.918 1 O-C-N 129.83 4.456 . . . . 0.0 109.695 -179.763 . . . . . . . . 4 4 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 90.06 -28.06 0.04 OUTLIER 'General case' 0 C--O 1.202 -1.431 1 O-C-N 130.084 4.615 . . . . 0.0 113.676 179.815 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -131.37 8.1 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 O-C-N 127.629 3.081 . . . . 0.0 110.317 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.72 37.08 2.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.102 179.657 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 66.9 t -50.04 -48.75 22.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 126.257 2.223 . . . . 0.0 109.57 179.665 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.497 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 6.8 tpp85 -141.89 144.09 33.64 Favored 'General case' 0 C--O 1.211 -0.938 2 O-C-N 129.908 4.505 . . . . 0.0 108.29 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.637 ' O ' ' N ' ' A' ' 39' ' ' GLN . 1.2 mp -89.02 96.08 10.58 Favored 'General case' 0 C--O 1.209 -1.046 2 O-C-N 132.892 6.37 . . . . 0.0 103.736 177.06 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.522 ' CG2' ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER 5.23 -51.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 1 O-C-N 137.34 9.15 . . . . 0.0 109.865 -177.879 . . . . . . . . 4 4 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.637 ' N ' ' O ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.72 -166.42 2.52 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 118.96 2.948 . . . . 0.0 118.96 179.658 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.579 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 17.6 m -42.26 149.08 0.17 Allowed 'General case' 0 N--CA 1.426 -1.659 1 C-N-CA 132.782 4.433 . . . . 0.0 115.359 179.293 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.513 ' HD3' ' C ' ' A' ' 41' ' ' LYS 0.289 0.1 OUTLIER -109.28 149.86 28.81 Favored 'General case' 0 N--CA 1.49 1.529 2 O-C-N 131.27 5.356 . . . . 0.0 101.421 178.185 . . . . . . . . 5 4 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.486 ' N ' ' O ' ' A' ' 53' ' ' LYS . 2.3 mp -127.02 163.14 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 125.102 1.501 . . . . 0.0 111.534 179.342 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -132.77 143.16 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 CA-C-N 111.181 -2.736 . . . . 0.0 109.568 179.615 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.265 86.9 t -151.77 118.12 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 116.612 -2.035 . . . . 0.0 111.286 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.447 ' HG2' ' CD1' ' A' ' 50' ' ' PHE . 36.9 mt-30 -118.62 111.56 18.71 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -100.32 26.53 6.49 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 128.856 3.847 . . . . 0.0 111.37 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 109.51 -121.59 6.15 Favored Glycine 0 C--O 1.213 -1.156 0 O-C-N 120.844 -1.16 . . . . 0.0 115.345 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -59.69 -27.25 66.27 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 117.469 -1.692 . . . . 0.0 113.883 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -100.79 109.99 22.03 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 128.855 3.847 . . . . 0.0 110.593 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.541 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 0.5 OUTLIER -113.61 111.95 22.7 Favored 'General case' 0 C--N 1.311 -1.088 1 O-C-N 129.119 4.012 . . . . 0.0 110.78 179.9 . . . . . . . . 4 4 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -123.48 102.28 7.79 Favored 'General case' 0 C--O 1.196 -1.754 1 O-C-N 129.473 4.233 . . . . 0.0 117.8 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.486 ' CB ' ' HB3' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.3 160.71 28.64 Favored 'General case' 0 N--CA 1.473 0.676 1 O-C-N 130.256 4.722 . . . . 0.0 106.176 179.172 . . . . . . . . 4 4 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -166.16 146.56 6.38 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 179.738 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.8 t -111.64 162.91 14.68 Favored 'General case' 0 C--N 1.31 -1.131 0 O-C-N 126.707 2.504 . . . . 0.0 113.406 -179.725 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.413 ' HB3' ' NE2' ' A' ' 39' ' ' GLN . 1.7 t-20 -106.8 -12.42 15.51 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 115.622 -2.132 . . . . 0.0 112.287 -179.764 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.455 ' HB2' ' HB3' ' A' ' 37' ' ' LEU . 98.8 p -23.61 120.36 0.04 OUTLIER 'General case' 0 CA--C 1.509 -0.63 1 O-C-N 131.634 5.584 . . . . 0.0 107.687 178.409 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.522 ' HB ' ' CG2' ' A' ' 38' ' ' THR . 0.6 OUTLIER -51.31 -31.3 21.09 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 128.031 3.332 . . . . 0.0 107.472 179.816 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.468 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 13.6 m-85 -57.09 -73.45 0.07 Allowed 'General case' 0 C--N 1.351 0.658 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 179.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -155.78 129.93 8.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 113.415 -1.721 . . . . 0.0 111.084 -179.655 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -105.53 54.75 0.7 Allowed 'General case' 0 C--O 1.211 -0.942 0 O-C-N 127.82 3.2 . . . . 0.0 111.992 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -75.02 73.93 2.2 Favored 'General case' 0 N--CA 1.47 0.556 1 O-C-N 129.766 4.416 . . . . 0.0 106.85 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.416 ' CB ' ' HB3' ' A' ' 53' ' ' LYS . 5.0 p30 -45.54 114.22 0.72 Allowed 'General case' 0 C--O 1.202 -1.412 0 O-C-N 128.379 3.549 . . . . 0.0 116.05 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.547 ' CD2' ' CZ ' ' A' ' 65' ' ' PHE . 4.0 tp -65.86 79.69 0.08 Allowed 'General case' 0 C--O 1.214 -0.791 1 O-C-N 129.65 4.344 . . . . 0.0 110.579 179.32 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.413 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 5.7 m-20 -111.01 96.95 6.46 Favored 'General case' 0 CA--C 1.486 -1.483 0 C-N-CA 115.917 -2.313 . . . . 0.0 113.568 -178.348 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.551 ' CE2' ' CZ2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -130.12 -176.05 3.82 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 125.875 2.75 . . . . 0.0 106.5 178.665 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.452 ' CG2' HG22 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -137.33 156.01 48.74 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.447 ' HA ' ' CG1' ' A' ' 87' ' ' VAL . 20.5 t -64.5 149.26 11.24 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.203 0 O-C-N 128.923 3.889 . . . . 0.0 115.515 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 32.53 31.93 0.01 OUTLIER Glycine 0 N--CA 1.468 0.803 1 O-C-N 130.445 4.841 . . . . 0.0 117.359 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.452 HG22 ' CG2' ' A' ' 66' ' ' THR . 0.9 OUTLIER -91.14 -16.38 8.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.609 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 68.03 90.91 0.09 Allowed 'General case' 0 C--N 1.355 0.816 1 O-C-N 129.121 4.013 . . . . 0.0 109.787 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.448 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.1 OUTLIER -80.46 82.22 6.54 Favored 'General case' 0 CA--C 1.494 -1.194 0 O-C-N 127.13 2.769 . . . . 0.0 114.882 179.834 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.04 88.58 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 113.618 -1.628 . . . . 0.0 111.33 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.48 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 60.8 161.76 0.06 Allowed 'General case' 0 C--O 1.209 -1.055 0 C-N-CA 126.638 1.975 . . . . 0.0 112.821 179.994 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 149.8 73.58 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 128.387 3.554 . . . . 0.0 113.983 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.295 0.8 OUTLIER -132.3 97.27 4.07 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 116.072 -1.918 . . . . 0.0 109.504 179.931 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -151.01 124.62 9.03 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 128.684 3.74 . . . . 0.0 111.776 179.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.44 -41.09 1.89 Allowed Glycine 0 C--O 1.216 -1.027 0 CA-C-N 109.717 -3.401 . . . . 0.0 112.889 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.1 tp -106.01 -9.45 17.05 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 129.619 3.776 . . . . 0.0 114.629 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -149.18 -62.74 0.23 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.824 -179.85 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.75 52.18 3.59 Favored Glycine 0 C--O 1.214 -1.132 0 CA-C-O 126.442 3.246 . . . . 0.0 112.611 -179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.98 -156.86 0.71 Allowed 'General case' 0 C--N 1.354 0.792 0 CA-C-N 110.616 -2.792 . . . . 0.0 113.847 -179.773 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.48 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -151.92 109.58 3.63 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.805 1.288 . . . . 0.0 107.88 178.265 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.493 ' CG1' ' HB3' ' A' ' 98' ' ' GLN . 72.6 t -140.48 127.78 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.524 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -176.811 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -59.79 88.28 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 112.467 -2.152 . . . . 0.0 109.608 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.448 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 52.5 m -85.88 67.22 9.95 Favored 'General case' 0 C--O 1.196 -1.711 0 O-C-N 128.504 3.628 . . . . 0.0 116.214 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -58.59 146.97 34.01 Favored 'General case' 0 C--O 1.211 -0.925 1 CA-C-N 107.713 -4.312 . . . . 0.0 115.73 -179.744 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.447 ' CG1' ' HA ' ' A' ' 67' ' ' VAL . 59.7 t -130.54 132.4 64.55 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.29 0 C-N-CA 127.499 2.32 . . . . 0.0 107.268 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.417 ' HB ' HG13 ' A' ' 95' ' ' VAL 0.358 27.8 m -142.57 -156.62 0.7 Allowed 'General case' 0 CA--C 1.48 -1.729 0 CA-C-N 112.698 -2.046 . . . . 0.0 105.698 -179.554 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.714 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.279 10.9 m95 -154.18 143.51 21.38 Favored 'General case' 0 CA--C 1.51 -0.595 0 O-C-N 118.349 -2.72 . . . . 0.0 105.492 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -111.21 -146.38 0.41 Allowed 'General case' 0 CA--C 1.483 -1.605 0 O-C-N 126.583 2.427 . . . . 0.0 111.268 179.39 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -74.28 -30.93 59.92 Favored Glycine 0 N--CA 1.487 2.072 1 N-CA-C 101.144 -4.782 . . . . 0.0 101.144 179.741 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.29 69.3 0.18 Allowed 'General case' 0 C--O 1.197 -1.695 1 O-C-N 133.2 5.883 . . . . 0.0 111.625 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.645 ' O ' ' N ' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.94 133.09 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 119.395 3.109 . . . . 0.0 119.395 178.049 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.586 ' N ' ' CZ3' ' A' ' 89' ' ' TRP . 0.5 OUTLIER -61.06 10.84 0.02 OUTLIER 'General case' 0 CA--C 1.478 -1.807 0 N-CA-C 120.246 3.424 . . . . 0.0 120.246 -178.293 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.417 HG13 ' HB ' ' A' ' 88' ' ' THR . 15.0 t 3.92 114.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.482 -1.656 0 N-CA-C 119.318 3.081 . . . . 0.0 119.318 -178.603 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.432 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 7.0 p -132.94 140.39 47.81 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 124.847 2.26 . . . . 0.0 108.313 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.421 ' O ' ' N ' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -135.32 80.75 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 CA-C-N 110.013 -3.267 . . . . 0.0 116.533 179.794 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.493 ' HB3' ' CG1' ' A' ' 83' ' ' VAL . 10.8 mt-30 -50.21 93.8 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 123.937 1.827 . . . . 0.0 108.358 -179.942 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.421 ' N ' ' O ' ' A' ' 97' ' ' VAL . 0.0 OUTLIER -88.98 106.7 18.6 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 109.258 -3.61 . . . . 0.0 111.395 -179.767 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.457 ' CA ' HG23 ' A' ' 83' ' ' VAL . . . -105.57 -83.98 1.7 Allowed Glycine 0 C--O 1.197 -2.188 1 CA-C-O 127.9 4.056 . . . . 0.0 110.141 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -176.4 -54.2 0.01 OUTLIER 'General case' 0 C--N 1.355 0.819 1 CA-C-N 107.051 -4.575 . . . . 0.0 112.765 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -87.25 -52.62 5.29 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 125.971 2.796 . . . . 0.0 115.666 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -102.28 158.76 15.96 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 110.362 -3.108 . . . . 0.0 116.424 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -117.2 85.08 2.26 Favored 'General case' 0 N--CA 1.49 1.565 1 CA-C-N 107.309 -4.496 . . . . 0.0 102.158 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -79.13 7.4 7.57 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 126.366 2.291 . . . . 0.0 115.921 -179.188 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -49.75 131.62 27.27 Favored Glycine 0 C--O 1.204 -1.756 1 O-C-N 129.372 4.17 . . . . 0.0 110.582 179.25 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.551 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE . 6.5 p90 -117.17 8.78 13.34 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 129.723 3.837 . . . . 0.0 119.387 -179.593 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -28.47 142.81 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 1 CA-C-N 108.26 -4.064 . . . . 0.0 112.757 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.515 ' CG ' ' CD2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -123.16 148.65 45.52 Favored 'General case' 0 C--N 1.362 1.127 0 CA-C-O 113.709 -3.043 . . . . 0.0 108.954 179.876 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.488 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.2 OUTLIER -145.64 84.6 1.68 Allowed 'General case' 0 C--N 1.303 -1.44 1 O-C-N 132.097 5.873 . . . . 0.0 115.066 179.59 . . . . . . . . 4 4 . 1 . 022 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 18.5 t -22.75 104.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.491 -1.311 0 C-N-CA 126.671 1.988 . . . . 0.0 115.802 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -134.85 153.77 51.91 Favored 'General case' 0 CA--C 1.481 -1.678 0 CA-C-N 111.137 -2.756 . . . . 0.0 118.183 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 50.29 -93.14 0.01 OUTLIER Glycine 0 C--O 1.198 -2.1 0 CA-C-O 123.599 1.666 . . . . 0.0 113.813 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -147.63 31.86 0.88 Allowed 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.18 -169.23 2.86 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 128.164 3.415 . . . . 0.0 111.189 -179.611 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 37.1 tp -128.62 88.06 2.68 Favored 'General case' 0 C--O 1.201 -1.493 0 CA-C-O 127.226 3.393 . . . . 0.0 111.435 179.795 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -44.86 97.11 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.731 1 CA-C-N 107.823 -4.262 . . . . 0.0 117.383 -179.177 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.41 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -78.87 120.63 23.76 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 113.545 -3.121 . . . . 0.0 105.403 178.26 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.488 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 7.6 mt-10 -134.13 85.63 2.21 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 126.923 2.639 . . . . 0.0 106.682 -178.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.426 ' CB ' ' HA ' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -98.48 148.04 24.14 Favored 'General case' 0 CA--C 1.483 -1.61 1 O-C-N 129.757 4.41 . . . . 0.0 108.857 -179.956 . . . . . . . . 4 4 . 1 . 022 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -110.09 160.54 16.37 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 111.429 -2.623 . . . . 0.0 105.135 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -159.96 47.24 0.26 Allowed 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 125.899 2.761 . . . . 0.0 112.275 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.13 -98.33 1.96 Allowed Glycine 0 N--CA 1.438 -1.195 0 CA-C-N 111.739 -2.482 . . . . 0.0 110.709 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -83.61 -29.61 27.6 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 109.305 -3.448 . . . . 0.0 111.026 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -103.15 160.45 14.64 Favored 'General case' 0 C--O 1.207 -1.174 0 O-C-N 127.531 3.02 . . . . 0.0 109.75 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.57 101.14 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.5 -0.97 1 CA-C-N 108.303 -4.044 . . . . 0.0 112.327 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.2 m -79.67 149.7 31.16 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 113.307 -1.769 . . . . 0.0 109.726 179.789 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -140.58 76.14 1.54 Allowed 'General case' 0 N--CA 1.476 0.866 0 O-C-N 127.74 3.15 . . . . 0.0 110.491 179.953 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.86 176.1 0.58 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 117.747 -1.581 . . . . 0.0 114.501 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.259 83.9 t -149.64 87.55 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.563 0 CA-C-O 125.037 2.351 . . . . 0.0 105.624 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 3.4 m-85 -70.57 -178.67 1.86 Allowed 'General case' 0 CA--C 1.486 -1.496 0 CA-C-N 109.015 -3.72 . . . . 0.0 117.625 -179.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 10' ' ' GLU . 0.8 OUTLIER -163.96 117.01 1.43 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 111.461 -2.609 . . . . 0.0 108.067 -179.907 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.545 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -56.14 49.85 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 119.918 3.303 . . . . 0.0 119.918 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.444 ' HA ' ' HG3' ' A' ' 10' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.788 0 CA-C-O 113.062 -3.351 . . . . 0.0 118.352 -178.697 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm . . . . . 0 N--CA 1.441 -0.879 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -96.82 84.45 3.6 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 116.577 -1.678 . . . . 0.0 107.284 -179.853 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -117.79 145.85 44.24 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 103.85 -2.648 . . . . 0.0 103.85 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -154.54 149.35 26.61 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 129.43 3.092 . . . . 0.0 110.933 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.64 -173.56 44.09 Favored Glycine 0 C--O 1.21 -1.349 0 CA-C-O 116.15 -2.472 . . . . 0.0 110.722 179.788 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.485 HG21 ' CG ' ' A' ' 134' ' ' LYS . 5.6 t -139.29 22.2 2.57 Favored 'General case' 0 C--O 1.208 -1.114 0 O-C-N 129.859 3.917 . . . . 0.0 109.83 179.858 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.602 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.291 0.0 OUTLIER -23.66 124.45 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.443 1 O-C-N 133.768 6.917 . . . . 0.0 112.081 179.552 . . . . . . . . 5 4 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -74.09 -3.21 28.11 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -179.172 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.487 ' HB3' ' CG ' ' A' ' 39' ' ' GLN 0.313 1.0 OUTLIER 49.59 35.97 9.56 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 114.074 -2.87 . . . . 0.0 103.269 179.707 . . . . . . . . 4 4 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.468 ' HB2' ' CB ' ' A' ' 132' ' ' LYS . 4.8 tt0 -26.77 -46.92 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.256 2 O-C-N 132.542 6.152 . . . . 0.0 113.919 -178.876 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.2 t -121.72 -152.22 0.5 Allowed 'General case' 0 C--O 1.245 0.817 0 C-N-CA 117.894 -1.522 . . . . 0.0 112.312 -178.522 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.51 ' ND2' ' N ' ' A' ' 15' ' ' GLU . 2.4 t-20 157.34 136.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 O-C-N 125.371 1.669 . . . . 0.0 111.797 179.437 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.51 ' N ' ' ND2' ' A' ' 14' ' ' ASN . 8.5 mm-40 -91.71 -70.16 0.7 Allowed 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 127.795 3.184 . . . . 0.0 108.16 179.505 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -96.15 157.74 15.76 Favored 'General case' 0 C--O 1.202 -1.413 0 O-C-N 120.812 -1.18 . . . . 0.0 112.872 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -149.01 -48.39 0.15 Allowed 'General case' 0 C--O 1.22 -0.49 0 O-C-N 125.257 1.598 . . . . 0.0 111.284 -179.942 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.465 ' CG ' ' HB2' ' A' ' 31' ' ' ARG . 1.3 mt-10 -67.58 -45.69 74.83 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 111.924 -2.398 . . . . 0.0 115.848 179.782 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.23 -22.92 65.76 Favored Glycine 0 N--CA 1.483 1.77 0 O-C-N 129.1 4.0 . . . . 0.0 111.345 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.5 ' CE1' HD23 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -78.78 -43.67 24.96 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-O 124.962 2.315 . . . . 0.0 107.666 179.992 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.434 ' CB ' HG23 ' A' ' 26' ' ' ILE . 17.8 mtt -66.42 -33.08 74.9 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.69 179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -73.4 -25.54 60.59 Favored 'General case' 0 C--O 1.214 -0.773 0 O-C-N 128.053 3.346 . . . . 0.0 114.436 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.34 -52.49 32.77 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.968 3.918 . . . . 0.0 111.029 179.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.5 HD23 ' CE1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -86.18 -6.39 59.0 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 110.056 -3.247 . . . . 0.0 108.633 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 39.64 73.91 0.11 Allowed 'General case' 0 CA--C 1.484 -1.566 0 O-C-N 127.653 3.095 . . . . 0.0 108.115 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.45 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 10.8 tt -65.68 -26.34 38.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.029 1 CA-C-N 108.191 -4.095 . . . . 0.0 109.069 -179.964 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 145.97 134.58 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 111.277 -2.692 . . . . 0.0 109.208 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -94.45 87.61 5.22 Favored 'General case' 0 N--CA 1.483 1.182 1 O-C-N 129.913 4.508 . . . . 0.0 108.477 179.358 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 150.31 65.84 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 1 O-C-N 129.493 4.246 . . . . 0.0 104.229 -179.363 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.8 m 142.28 66.58 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.247 2 O-C-N 132.815 6.322 . . . . 0.0 109.009 -179.894 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.465 ' HB2' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -138.08 -56.24 0.66 Allowed 'General case' 0 N--CA 1.447 -0.61 2 O-C-N 130.254 4.721 . . . . 0.0 108.987 -179.711 . . . . . . . . 4 4 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.44 1.27 55.11 Favored 'General case' 0 C--O 1.205 -1.255 0 O-C-N 127.156 2.785 . . . . 0.0 113.715 179.886 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.476 ' CD1' ' N ' ' A' ' 33' ' ' ILE . 1.7 mp -108.23 -47.63 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 2 O-C-N 129.394 4.184 . . . . 0.0 114.681 -179.621 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.478 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -54.73 -44.42 73.53 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 122.491 1.139 . . . . 0.0 113.214 179.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 78.4 t 25.81 -74.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.204 -1.342 0 CA-C-N 110.388 -3.096 . . . . 0.0 115.123 -179.806 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 34' ' ' ALA . 2.8 tmm_? -176.3 100.56 0.06 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.683 -1.599 . . . . 0.0 111.012 179.856 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.503 ' HB3' ' CE2' ' A' ' 58' ' ' PHE . 0.8 OUTLIER -94.84 -0.6 53.94 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 129.05 3.969 . . . . 0.0 110.59 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 16.6 m 133.84 88.33 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.752 1 O-C-N 132.964 6.415 . . . . 0.0 111.503 -179.662 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.487 ' CG ' ' HB3' ' A' ' 11' ' ' MET . 0.0 OUTLIER -88.25 -179.05 6.06 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 116.288 -2.165 . . . . 0.0 115.581 -179.584 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.6 m -178.6 137.39 0.16 Allowed 'General case' 0 N--CA 1.431 -1.384 1 O-C-N 129.913 4.508 . . . . 0.0 112.498 179.583 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.567 ' HD2' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -122.54 157.13 32.73 Favored 'General case' 0 N--CA 1.489 1.494 1 O-C-N 129.321 4.138 . . . . 0.0 102.523 179.694 . . . . . . . . 4 4 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.51 ' N ' ' O ' ' A' ' 53' ' ' LYS . 6.7 mt -149.82 104.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.433 0 O-C-N 127.547 3.03 . . . . 0.0 112.287 -178.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.495 HD12 ' CE1' ' A' ' 50' ' ' PHE 0.258 0.1 OUTLIER -83.39 135.4 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 2 CA-C-N 106.444 -4.889 . . . . 0.0 110.525 -179.855 . . . . . . . . 5 4 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -143.95 96.58 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 CA-C-N 111.77 -2.468 . . . . 0.0 116.419 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -94.84 126.73 40.35 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.154 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -132.83 31.85 3.88 Favored 'General case' 0 CA--C 1.49 -1.328 1 O-C-N 130.373 4.795 . . . . 0.0 111.99 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.85 120.36 0.66 Allowed Glycine 0 C--O 1.204 -1.764 0 O-C-N 126.061 2.101 . . . . 0.0 112.685 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 70.43 -69.69 0.17 Allowed 'General case' 0 C--O 1.212 -0.869 0 CA-C-O 116.683 -1.627 . . . . 0.0 112.015 179.854 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.2 m-20 -95.91 114.14 25.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 128.074 3.359 . . . . 0.0 111.493 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.522 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 3.0 t80 -115.39 139.98 49.53 Favored 'General case' 0 CA--C 1.489 -1.385 1 O-C-N 129.52 4.262 . . . . 0.0 114.968 -179.806 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.522 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 67.5 mttt -144.86 102.19 3.75 Favored 'General case' 0 CA--C 1.489 -1.378 0 N-CA-C 118.952 2.945 . . . . 0.0 118.952 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.511 ' CB ' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.29 160.96 28.35 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 128.652 3.72 . . . . 0.0 105.67 178.449 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 42' ' ' ILE 0.25 0.0 OUTLIER -158.03 127.4 5.82 Favored 'General case' 0 CA--C 1.482 -1.669 1 O-C-N 130.449 4.843 . . . . 0.0 112.08 -175.681 . . . . . . . . 5 4 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.4 ' N ' ' HE3' ' A' ' 53' ' ' LYS 0.283 0.4 OUTLIER -94.88 147.65 23.14 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 124.277 1.989 . . . . 0.0 112.853 179.708 . . . . . . . . 4 4 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -132.36 59.33 1.72 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 110.282 -3.145 . . . . 0.0 116.958 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 m -93.85 -176.39 4.02 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 130.695 3.598 . . . . 0.0 106.214 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.447 ' HB ' ' CD2' ' A' ' 37' ' ' LEU . 92.2 m -113.27 -50.39 2.87 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 128.902 3.876 . . . . 0.0 107.659 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.503 ' CE2' ' HB3' ' A' ' 37' ' ' LEU . 9.0 m-85 -50.06 -57.36 7.79 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 128.579 3.675 . . . . 0.0 110.368 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -154.34 105.82 2.71 Favored 'General case' 0 C--O 1.213 -0.836 1 O-C-N 130.812 5.07 . . . . 0.0 114.112 -179.729 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -86.63 80.84 8.45 Favored 'General case' 0 C--O 1.205 -1.276 1 O-C-N 130.563 4.915 . . . . 0.0 112.066 -179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -68.06 166.86 15.11 Favored 'General case' 0 C--O 1.219 -0.521 0 O-C-N 128.79 3.806 . . . . 0.0 107.174 179.627 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -140.2 89.37 2.29 Favored 'General case' 0 C--O 1.207 -1.145 1 O-C-N 129.819 4.45 . . . . 0.0 113.014 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.529 ' HG ' ' CD2' ' A' ' 65' ' ' PHE . 4.6 tp -72.85 64.35 0.67 Allowed 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.62 -1.627 . . . . 0.0 112.4 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.413 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 2.9 t0 -95.5 104.9 16.82 Favored 'General case' 0 C--O 1.21 -0.983 0 CA-C-N 112.636 -2.075 . . . . 0.0 105.551 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.529 ' CD2' ' HG ' ' A' ' 63' ' ' LEU . 9.6 m-85 -123.03 -178.48 3.97 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.354 2.262 . . . . 0.0 110.716 179.824 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.412 ' CG2' HG21 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -150.68 133.3 15.73 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 179.34 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 54.8 t -52.75 137.77 12.36 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 O-C-N 126.994 2.684 . . . . 0.0 114.973 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 87' ' ' VAL . . . 33.12 45.23 0.26 Allowed Glycine 0 N--CA 1.468 0.831 1 O-C-N 130.969 5.168 . . . . 0.0 117.363 179.94 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.412 HG21 ' CG2' ' A' ' 66' ' ' THR 0.319 0.4 OUTLIER -88.72 -14.04 9.58 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.62 179.928 . . . . . . . . 4 4 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 65.41 71.33 0.44 Allowed 'General case' 0 C--N 1.364 1.235 1 O-C-N 129.568 4.293 . . . . 0.0 109.547 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.407 ' HB3' HG23 ' A' ' 85' ' ' THR . 2.3 t80 -65.46 72.22 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.86 2 O-C-N 130.835 5.085 . . . . 0.0 112.763 -179.805 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.43 101.72 0.05 OUTLIER 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 113.127 -1.851 . . . . 0.0 115.427 179.784 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.503 ' HG3' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 63.07 -164.26 0.26 Allowed 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 123.694 1.712 . . . . 0.0 113.224 179.328 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 75.28 88.23 0.09 Allowed 'General case' 0 C--O 1.203 -1.378 0 CA-C-N 109.086 -3.688 . . . . 0.0 113.411 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.26 72.8 p -116.67 -8.38 11.45 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 111.132 -2.758 . . . . 0.0 116.1 -179.74 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.36 151.67 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.925 1 O-C-N 129.214 4.071 . . . . 0.0 116.411 -179.684 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.19 -55.04 4.93 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 110.165 -3.198 . . . . 0.0 113.565 179.712 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.45 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 12.9 tp -80.93 -47.88 13.09 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.017 2.834 . . . . 0.0 113.158 179.911 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.454 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . 0.9 OUTLIER -112.56 -58.97 2.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 125.772 2.701 . . . . 0.0 112.142 179.847 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.59 49.6 5.69 Favored Glycine 0 C--O 1.207 -1.593 0 CA-C-N 111.748 -2.478 . . . . 0.0 111.968 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.44 ' CG ' ' N ' ' A' ' 82' ' ' ASN . 2.0 ttm-85 -121.04 -104.58 0.39 Allowed 'General case' 0 C--N 1.366 1.315 0 CA-C-N 109.968 -3.116 . . . . 0.0 114.644 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.503 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 6.5 m-20 156.02 103.31 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.836 0 O-C-N 125.729 1.893 . . . . 0.0 108.341 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.423 ' N ' ' HG3' ' A' ' 73' ' ' GLU . 1.5 t -153.72 145.31 14.47 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.372 0 O-C-N 126.852 2.595 . . . . 0.0 117.267 -179.332 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.17 161.24 2.53 Favored 'General case' 0 C--O 1.235 0.335 1 O-C-N 129.455 4.222 . . . . 0.0 106.87 178.791 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.407 HG23 ' HB3' ' A' ' 71' ' ' PHE . 1.2 m -161.28 95.23 1.02 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-O 126.389 2.995 . . . . 0.0 110.77 -179.936 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tp -101.7 111.76 24.12 Favored 'General case' 0 N--CA 1.429 -1.483 1 CA-C-N 108.106 -4.134 . . . . 0.0 116.993 -179.176 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.458 HG23 ' CG ' ' A' ' 65' ' ' PHE . 81.0 t -82.5 144.48 10.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 179.272 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.43 ' N ' HG11 ' A' ' 87' ' ' VAL 0.315 1.1 m -162.17 168.75 21.97 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-O 126.734 3.159 . . . . 0.0 110.732 -179.774 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.688 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 56.4 m95 -98.17 139.4 34.02 Favored 'General case' 0 C--N 1.361 1.078 0 CA-C-O 114.755 -2.545 . . . . 0.0 106.658 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.53 -49.49 8.01 Favored 'General case' 0 CA--C 1.483 -1.609 1 CA-C-O 132.231 5.777 . . . . 0.0 112.41 179.797 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -170.56 -56.4 0.04 OUTLIER Glycine 0 C--O 1.213 -1.189 1 CA-C-N 108.119 -4.128 . . . . 0.0 103.285 -179.763 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -141.38 49.37 1.63 Allowed 'General case' 0 N--CA 1.444 -0.731 1 O-C-N 131.949 5.147 . . . . 0.0 109.694 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.1 t -176.45 155.99 1.48 Allowed 'General case' 0 C--O 1.203 -1.385 0 N-CA-C 118.063 2.616 . . . . 0.0 118.063 -179.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.474 ' CD1' ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -85.6 98.83 10.87 Favored 'General case' 0 CA--C 1.487 -1.47 0 O-C-N 127.907 3.254 . . . . 0.0 115.168 -179.798 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.425 ' HA ' ' HB3' ' A' ' 108' ' ' LYS . 49.9 t -99.68 120.96 49.78 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.377 0 CA-C-N 110.897 -2.865 . . . . 0.0 114.017 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.588 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 12.1 m -132.5 134.26 44.8 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 103.373 -2.825 . . . . 0.0 103.373 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -120.1 116.3 49.96 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 108.715 -3.857 . . . . 0.0 119.268 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.424 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -87.99 109.26 19.69 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-N 112.459 -2.155 . . . . 0.0 107.436 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.12 116.18 27.98 Favored 'General case' 0 C--O 1.195 -1.773 0 O-C-N 128.05 3.344 . . . . 0.0 113.619 -179.017 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.422 ' O ' ' N ' ' A' ' 102' ' ' LYS . . . 172.41 176.5 41.19 Favored Glycine 0 C--O 1.199 -2.062 0 CA-C-N 113.172 -1.831 . . . . 0.0 112.402 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.403 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 4.5 tt0 3.45 -61.15 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.275 2 O-C-N 130.996 4.586 . . . . 0.0 114.537 179.645 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER -149.51 -37.21 0.16 Allowed 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 179.474 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -52.19 124.39 12.98 Favored 'General case' 0 N--CA 1.441 -0.918 0 O-C-N 126.544 2.403 . . . . 0.0 116.349 -179.771 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -112.02 67.97 0.66 Allowed 'General case' 0 N--CA 1.484 1.268 2 O-C-N 130.039 4.587 . . . . 0.0 102.148 179.781 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.424 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 23.5 mmm-85 -94.84 36.73 1.17 Allowed 'General case' 0 C--O 1.203 -1.364 1 O-C-N 129.321 4.138 . . . . 0.0 110.167 179.772 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -77.58 67.82 2.81 Favored Glycine 0 N--CA 1.445 -0.759 0 O-C-N 128.297 3.498 . . . . 0.0 111.445 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.588 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -80.98 141.65 34.22 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 129.699 3.823 . . . . 0.0 110.553 179.397 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.425 ' HB3' ' HA ' ' A' ' 95' ' ' VAL . 3.0 ptpt -164.61 165.78 20.76 Favored 'General case' 0 N--CA 1.443 -0.786 1 O-C-N 129.265 4.103 . . . . 0.0 114.159 -178.728 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -116.28 175.27 5.63 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 109.729 -3.396 . . . . 0.0 106.415 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -125.78 -56.24 1.48 Allowed 'General case' 0 C--N 1.306 -1.311 1 O-C-N 130.659 4.974 . . . . 0.0 116.242 179.713 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.9 t 78.31 44.27 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-O 127.453 3.501 . . . . 0.0 108.485 -176.06 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.545 ' HG3' ' CZ ' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -103.07 129.88 50.03 Favored 'General case' 0 CA--C 1.477 -1.841 1 CA-C-N 107.081 -4.6 . . . . 0.0 110.823 -178.388 . . . . . . . . 4 4 . 1 . 023 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . 0.423 ' O ' ' NZ ' ' A' ' 115' ' ' LYS . . . 48.14 67.42 1.61 Allowed Glycine 0 C--O 1.194 -2.352 0 C-N-CA 125.026 1.298 . . . . 0.0 115.711 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 72.67 -43.4 0.56 Allowed 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 129.027 2.931 . . . . 0.0 118.679 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.429 ' CG ' ' CD1' ' A' ' 117' ' ' TYR . 4.6 ptpp? -100.78 -174.91 2.74 Favored 'General case' 0 C--N 1.312 -1.062 0 O-C-N 128.831 3.832 . . . . 0.0 108.064 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.565 ' HG ' ' CZ3' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -138.09 62.24 1.57 Allowed 'General case' 0 C--O 1.194 -1.838 0 O-C-N 126.914 2.634 . . . . 0.0 108.672 178.928 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.567 ' CB ' ' HB3' ' A' ' 129' ' ' GLN . 0.0 OUTLIER -32.27 131.81 0.14 Allowed 'General case' 0 C--N 1.365 1.258 1 O-C-N 130.521 4.888 . . . . 0.0 116.005 -177.093 . . . . . . . . 4 4 . 1 . 023 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.605 ' HB2' ' CE2' ' A' ' 131' ' ' PHE . 0.7 OUTLIER -87.83 65.84 8.53 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 128.661 3.726 . . . . 0.0 111.628 -178.87 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -77.8 122.5 25.5 Favored 'General case' 0 CA--C 1.485 -1.541 0 O-C-N 127.692 3.12 . . . . 0.0 108.014 -179.629 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.447 HD22 ' CB ' ' A' ' 127' ' ' CYS . 0.9 OUTLIER -146.15 -179.79 6.97 Favored 'General case' 0 CA--C 1.486 -1.512 0 C-N-CA 117.213 -1.795 . . . . 0.0 114.092 -179.791 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 44.8 m -128.36 160.89 30.8 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . 0.263 0.3 OUTLIER -173.6 107.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.953 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 12.12 76.9 0.01 OUTLIER Glycine 0 C--O 1.218 -0.849 1 O-C-N 129.896 4.498 . . . . 0.0 114.725 179.593 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 38.9 m-20 101.15 -53.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.391 0 O-C-N 129.048 3.44 . . . . 0.0 111.032 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -77.35 171.06 15.45 Favored 'General case' 0 C--O 1.2 -1.543 1 O-C-N 130.611 4.944 . . . . 0.0 110.323 -179.8 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.1 m -145.17 102.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 1 CA-C-N 107.28 -4.509 . . . . 0.0 111.31 179.454 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.447 ' CB ' HD22 ' A' ' 120' ' ' LEU . 0.1 OUTLIER -64.45 175.18 1.43 Allowed 'General case' 0 CA--C 1.494 -1.208 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 -179.625 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . 0.523 ' C ' ' HG3' ' A' ' 129' ' ' GLN . 0.0 OUTLIER -142.04 64.63 1.38 Allowed 'General case' 0 C--N 1.346 0.446 0 C-N-CA 114.165 -3.014 . . . . 0.0 116.679 179.647 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.567 ' HB3' ' CB ' ' A' ' 117' ' ' TYR . 8.9 mt-30 57.24 -169.09 0.11 Allowed 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 120.815 3.635 . . . . 0.0 120.815 175.616 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.501 HG11 ' CA ' ' A' ' 14' ' ' ASN 0.256 1.5 m -173.5 -46.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 O-C-N 126.568 2.418 . . . . 0.0 113.448 -178.775 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.605 ' CE2' ' HB2' ' A' ' 118' ' ' LEU . 43.7 m-85 -29.94 158.94 0.0 OUTLIER 'General case' 0 CA--C 1.477 -1.853 0 N-CA-C 120.929 3.677 . . . . 0.0 120.929 -174.913 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.468 ' CB ' ' HB2' ' A' ' 12' ' ' GLU 0.338 0.0 OUTLIER -169.46 108.67 0.42 Allowed 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 108.729 -3.85 . . . . 0.0 104.964 -178.86 . . . . . . . . 4 4 . 1 . 023 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.602 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 31.6 ttpt -64.93 73.01 0.04 OUTLIER 'General case' 0 CA--C 1.478 -1.79 0 C-N-CA 117.717 -1.593 . . . . 0.0 113.7 -179.331 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.485 ' CG ' HG21 ' A' ' 8' ' ' THR . 14.9 mttt . . . . . 0 CA--C 1.496 -1.119 0 O-C-N 119.981 -1.699 . . . . 0.0 114.782 179.812 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.493 -1.22 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.68 -173.73 0.8 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.87 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -122.39 -144.2 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 104.368 -2.456 . . . . 0.0 104.368 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.47 131.72 12.8 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 128.317 2.647 . . . . 0.0 110.713 179.713 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 178.16 -119.43 0.67 Allowed Glycine 0 C--O 1.22 -0.758 0 C-N-CA 115.832 -3.08 . . . . 0.0 115.864 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.446 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -179.75 151.07 0.42 Allowed 'General case' 0 C--O 1.211 -0.926 1 O-C-N 133.457 6.034 . . . . 0.0 105.441 -178.85 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.552 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -145.12 114.14 6.94 Favored 'General case' 0 CA--C 1.495 -1.153 1 O-C-N 129.298 4.124 . . . . 0.0 116.117 -179.446 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.61 95.08 7.67 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 114.846 -2.742 . . . . 0.0 106.94 179.643 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.486 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 32.5 ttm -28.28 -46.54 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 O-C-N 128.351 3.532 . . . . 0.0 107.148 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 93.35 -63.34 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.728 1 O-C-N 129.301 4.125 . . . . 0.0 111.729 179.291 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.98 -178.53 4.93 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 108.901 -3.772 . . . . 0.0 111.416 -179.568 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.475 ' ND2' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -165.5 154.94 12.43 Favored 'General case' 0 C--O 1.2 -1.51 0 O-C-N 126.289 2.243 . . . . 0.0 115.799 179.975 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 16' ' ' ASN . 3.1 tt0 -125.7 145.48 50.16 Favored 'General case' 0 N--CA 1.476 0.854 2 O-C-N 132.825 6.328 . . . . 0.0 110.738 -179.986 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.417 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 53.3 t30 36.82 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.138 0 CA-C-O 124.252 1.977 . . . . 0.0 115.744 -179.713 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -112.43 -39.5 4.37 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 111.636 -2.529 . . . . 0.0 109.562 -179.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -75.17 -35.02 61.62 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.956 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.02 -27.15 58.81 Favored Glycine 0 C--N 1.351 1.379 0 O-C-N 128.909 3.881 . . . . 0.0 107.028 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.31 -29.6 64.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 123.483 1.611 . . . . 0.0 108.576 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.8 mtt -77.76 -25.31 49.06 Favored 'General case' 0 CA--C 1.494 -1.208 0 C-N-CA 116.594 -2.042 . . . . 0.0 111.004 179.901 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -75.5 -27.01 58.6 Favored 'General case' 0 C--O 1.204 -1.304 0 O-C-N 127.799 3.187 . . . . 0.0 115.02 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.447 ' CB ' ' HG3' ' A' ' 125' ' ' GLN . . . -71.48 -44.93 63.82 Favored 'General case' 0 C--O 1.215 -0.718 1 O-C-N 134.461 7.351 . . . . 0.0 112.807 -179.859 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.502 ' CD1' ' HB ' ' A' ' 26' ' ' ILE . 2.6 pp -90.46 -6.05 55.33 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 110.24 -3.164 . . . . 0.0 108.202 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.6 t0 32.12 91.28 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 127.606 3.574 . . . . 0.0 113.01 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.502 ' HB ' ' CD1' ' A' ' 24' ' ' LEU . 9.9 tt -106.03 41.11 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.959 1 CA-C-N 107.472 -4.422 . . . . 0.0 111.17 179.69 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 80.47 134.54 0.06 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 109.887 -3.324 . . . . 0.0 113.323 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -67.59 137.03 55.36 Favored 'General case' 0 CA--C 1.505 -0.751 0 O-C-N 125.626 1.829 . . . . 0.0 111.795 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 73.99 74.29 0.12 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 125.811 2.72 . . . . 0.0 109.155 179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 34.1 m -140.76 40.73 1.84 Allowed 'General case' 0 N--CA 1.478 0.974 1 CA-C-N 106.85 -4.704 . . . . 0.0 110.794 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.79 -170.21 3.47 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 111.231 -2.713 . . . . 0.0 109.329 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.495 ' C ' ' CG1' ' A' ' 33' ' ' ILE . 4.6 tttp 76.38 30.69 0.65 Allowed 'General case' 0 C--N 1.314 -0.96 1 O-C-N 129.498 4.249 . . . . 0.0 112.425 -179.62 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.495 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -162.11 -55.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 2 O-C-N 129.834 4.459 . . . . 0.0 111.539 -179.959 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -87.62 50.3 1.97 Allowed 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 124.887 2.28 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.0 t -71.76 -44.21 68.78 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.578 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.186 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.428 ' C ' ' CD2' ' A' ' 37' ' ' LEU . 0.0 OUTLIER 160.04 132.51 0.0 OUTLIER 'General case' 0 N--CA 1.433 -1.299 1 O-C-N 130.684 4.99 . . . . 0.0 111.664 179.706 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -150.11 117.35 6.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 108.738 -3.847 . . . . 0.0 106.351 -179.981 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.431 ' HB ' ' HB ' ' A' ' 57' ' ' THR . 7.8 m 47.32 46.57 16.93 Favored 'General case' 0 CA--C 1.506 -0.742 1 O-C-N 131.096 5.247 . . . . 0.0 112.755 179.872 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.486 ' HG2' ' CB ' ' A' ' 11' ' ' MET . 0.4 OUTLIER -56.84 123.23 14.32 Favored 'General case' 0 CA--C 1.494 -1.174 0 O-C-N 125.135 1.522 . . . . 0.0 113.555 179.873 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.443 HG21 HG21 ' A' ' 8' ' ' THR . 45.3 m -147.95 67.85 1.1 Allowed 'General case' 0 C--N 1.313 -0.994 1 O-C-N 130.114 4.634 . . . . 0.0 117.457 -179.114 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 55' ' ' ASN . 0.1 OUTLIER -66.47 144.82 56.26 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 115.29 -2.29 . . . . 0.0 104.921 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.536 ' CD1' ' HB ' ' A' ' 54' ' ' THR . 2.6 mt -125.83 166.17 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 1 O-C-N 131.806 5.692 . . . . 0.0 113.263 -177.343 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.532 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.274 0.5 OUTLIER -149.85 143.37 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-N 110.829 -2.896 . . . . 0.0 112.484 179.405 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 41.1 t -111.68 -71.1 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.322 0 CA-C-N 111.799 -2.455 . . . . 0.0 114.445 -179.786 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 60.8 116.5 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 124.099 1.905 . . . . 0.0 113.206 -179.899 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -137.98 -4.12 1.76 Allowed 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 110.365 -3.107 . . . . 0.0 116.326 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.72 114.24 3.39 Favored Glycine 0 CA--C 1.493 -1.343 0 CA-C-N 121.16 1.8 . . . . 0.0 112.2 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 52.46 30.6 8.54 Favored 'General case' 0 C--O 1.212 -0.876 0 O-C-N 125.39 1.288 . . . . 0.0 111.693 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.5 t30 177.79 90.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.504 2.322 . . . . 0.0 109.218 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.414 ' O ' ' CG ' ' A' ' 50' ' ' PHE . 32.9 t80 -103.3 95.4 6.07 Favored 'General case' 0 CA--C 1.482 -1.657 1 O-C-N 130.25 4.719 . . . . 0.0 116.648 -179.551 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -106.9 173.29 6.39 Favored 'General case' 0 C--O 1.197 -1.66 0 C-N-CA 114.899 -2.72 . . . . 0.0 111.438 178.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.443 HG23 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -138.28 136.79 36.82 Favored 'General case' 0 N--CA 1.472 0.647 2 O-C-N 132.542 6.151 . . . . 0.0 104.921 177.592 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.603 ' CE ' ' O ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -156.42 115.38 3.43 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 127.722 3.139 . . . . 0.0 113.887 -176.704 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.566 ' HA ' ' CB ' ' A' ' 60' ' ' ASN . 3.0 m 96.93 147.08 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 130.033 3.333 . . . . 0.0 105.276 177.393 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.563 ' HA ' ' HA ' ' A' ' 41' ' ' LYS . 5.9 p30 -171.76 47.2 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.378 1 O-C-N 129.667 4.354 . . . . 0.0 116.513 -176.832 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 m 148.5 168.46 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 O-C-N 128.867 3.855 . . . . 0.0 107.884 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.431 ' HB ' ' HB ' ' A' ' 38' ' ' THR . 5.1 t -83.1 -36.97 24.42 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 111.853 -2.431 . . . . 0.0 106.204 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.435 ' N ' HD13 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -61.15 -29.83 70.02 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 125.682 1.864 . . . . 0.0 110.622 -179.937 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.505 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.1 OUTLIER -178.2 162.4 1.56 Allowed 'General case' 0 CA--C 1.504 -0.818 1 O-C-N 131.375 5.422 . . . . 0.0 116.392 -179.938 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.566 ' CB ' ' HA ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -138.47 86.58 2.17 Favored 'General case' 0 CA--C 1.503 -0.853 2 O-C-N 130.778 5.049 . . . . 0.0 114.078 -177.546 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -81.53 93.03 6.6 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 127.186 2.804 . . . . 0.0 110.186 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -43.42 148.25 0.33 Allowed 'General case' 0 C--O 1.206 -1.206 1 O-C-N 129.877 4.486 . . . . 0.0 111.406 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.514 ' HG ' ' CD2' ' A' ' 65' ' ' PHE . 4.7 tp -128.9 62.25 1.5 Allowed 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.321 4.138 . . . . 0.0 110.791 179.903 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -79.97 94.24 5.86 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 127.748 3.155 . . . . 0.0 110.363 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.634 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 6.9 m-85 -129.59 137.75 50.89 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 127.103 3.335 . . . . 0.0 109.854 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -125.4 108.8 12.03 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 109.039 -3.71 . . . . 0.0 103.027 179.594 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.516 HG23 ' CD1' ' A' ' 89' ' ' TRP . 12.5 t -41.77 129.79 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.419 1 O-C-N 130.854 5.096 . . . . 0.0 114.716 -179.771 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.18 12.81 69.9 Favored Glycine 0 N--CA 1.48 1.583 1 O-C-N 129.277 4.111 . . . . 0.0 116.287 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.275 1.7 t -73.82 -34.01 39.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.864 -179.792 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 72' ' ' ASP . 27.2 tt0 65.43 73.81 0.39 Allowed 'General case' 0 C--N 1.366 1.306 0 C-N-CA 112.489 -3.685 . . . . 0.0 108.442 -179.374 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.462 ' CB ' HG23 ' A' ' 85' ' ' THR . 0.2 OUTLIER -63.16 77.92 0.02 OUTLIER 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 126.905 3.24 . . . . 0.0 112.569 -179.488 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 70' ' ' GLU . 77.8 m-20 -61.72 78.21 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -179.82 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.492 ' HG2' ' CA ' ' A' ' 83' ' ' VAL . 21.4 mt-10 56.35 108.98 0.01 OUTLIER 'General case' 0 CA--C 1.49 -1.352 1 CA-C-O 129.061 4.267 . . . . 0.0 114.642 179.679 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.62 97.84 0.05 Allowed 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 109.772 -3.376 . . . . 0.0 115.641 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.92 130.8 5.75 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 111.391 -2.641 . . . . 0.0 111.336 -179.932 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.93 148.79 20.95 Favored 'General case' 0 CA--C 1.508 -0.656 0 O-C-N 128.448 3.592 . . . . 0.0 111.899 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.54 -3.99 72.41 Favored Glycine 0 C--O 1.21 -1.369 0 CA-C-N 109.405 -3.543 . . . . 0.0 113.067 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.463 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 0.9 OUTLIER -146.93 19.87 1.27 Allowed 'General case' 0 C--N 1.347 0.494 0 O-C-N 127.868 2.746 . . . . 0.0 116.982 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.7 t0 174.66 -59.5 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.53 0.519 . . . . 0.0 110.96 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.51 72.95 0.97 Allowed Glycine 0 CA--C 1.503 -0.668 0 CA-C-O 126.545 3.303 . . . . 0.0 111.989 -179.797 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.54 -177.63 3.87 Favored 'General case' 0 C--N 1.363 1.194 1 CA-C-N 107.965 -4.118 . . . . 0.0 111.239 179.954 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.472 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.11 82.68 1.2 Allowed 'General case' 0 C--O 1.202 -1.407 0 O-C-N 127.533 3.021 . . . . 0.0 108.145 179.643 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . 0.492 ' CA ' ' HG2' ' A' ' 73' ' ' GLU . 2.3 t -134.19 143.79 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 CA-C-N 111.194 -2.73 . . . . 0.0 117.926 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -50.89 155.3 1.22 Allowed 'General case' 0 N--CA 1.465 0.291 1 O-C-N 130.139 4.649 . . . . 0.0 106.999 179.299 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.462 HG23 ' CB ' ' A' ' 71' ' ' PHE . 1.1 m -158.47 78.46 0.79 Allowed 'General case' 0 C--O 1.194 -1.848 0 CA-C-O 127.764 3.65 . . . . 0.0 111.823 -179.452 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.5 tt -68.9 139.13 55.12 Favored 'General case' 0 N--CA 1.431 -1.381 1 CA-C-N 107.412 -4.449 . . . . 0.0 111.864 -179.953 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -132.73 132.45 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 C-N-CA 126.085 1.754 . . . . 0.0 110.759 179.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -155.21 175.13 14.24 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 126.886 3.231 . . . . 0.0 110.92 179.847 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' TRP . . . . . 0.681 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 42.0 m95 -96.22 144.25 26.6 Favored 'General case' 0 CA--C 1.506 -0.732 0 C-N-CA 127.569 2.347 . . . . 0.0 107.874 180.0 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.433 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 6.6 tp10 -91.98 -45.46 8.32 Favored 'General case' 0 C--O 1.21 -1.016 1 CA-C-O 131.706 5.527 . . . . 0.0 111.324 179.878 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -178.95 -49.21 0.08 OUTLIER Glycine 0 C--N 1.359 1.85 1 CA-C-N 105.586 -5.279 . . . . 0.0 105.405 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.64 30.42 1.7 Allowed 'General case' 0 C--O 1.212 -0.9 1 O-C-N 131.678 4.987 . . . . 0.0 111.225 179.912 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.411 ' O ' ' N ' ' A' ' 90' ' ' GLU . 2.6 t -161.54 154.05 20.16 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -179.964 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.497 ' HB3' ' CG ' ' A' ' 109' ' ' GLN . 2.0 tp -89.61 88.14 7.3 Favored 'General case' 0 CA--C 1.486 -1.496 0 O-C-N 129.048 3.968 . . . . 0.0 118.101 179.742 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.433 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.359 40.9 t -86.29 114.97 26.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.251 0 CA-C-N 110.403 -3.09 . . . . 0.0 112.556 179.681 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.402 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -138.55 137.4 37.0 Favored 'General case' 0 C--O 1.2 -1.532 0 CA-C-O 122.227 1.013 . . . . 0.0 108.362 -179.491 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.6 t -122.92 137.28 56.92 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 179.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.455 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -94.06 94.21 8.28 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 125.369 2.509 . . . . 0.0 107.921 179.399 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -91.19 128.73 37.12 Favored 'General case' 0 C--O 1.201 -1.467 1 CA-C-N 107.501 -4.409 . . . . 0.0 113.236 -179.9 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 102' ' ' LYS . . . 157.4 171.26 23.2 Favored Glycine 0 C--O 1.203 -1.836 0 CA-C-N 112.964 -1.925 . . . . 0.0 108.538 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 14.09 -70.23 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.959 2 O-C-N 130.254 4.149 . . . . 0.0 114.414 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.496 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -153.1 -43.01 0.1 Allowed 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 127.37 2.268 . . . . 0.0 115.028 179.636 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.496 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 2.8 mp0 -35.91 105.96 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.221 3.045 . . . . 0.0 119.221 -179.527 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.419 ' O ' ' N ' ' A' ' 122' ' ' CYS . 5.9 m120 -94.52 71.57 3.68 Favored 'General case' 0 N--CA 1.492 1.671 3 CA-C-N 106.96 -4.655 . . . . 0.0 99.436 177.415 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.405 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 14.5 tpt85 -107.17 12.64 28.16 Favored 'General case' 0 C--N 1.31 -1.136 1 O-C-N 134.314 7.259 . . . . 0.0 111.623 -176.908 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.455 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -75.52 141.71 28.02 Favored Glycine 0 C--O 1.203 -1.783 2 O-C-N 130.98 5.175 . . . . 0.0 111.42 179.949 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 107' ' ' TRP . . . . . 0.634 ' CH2' ' CE2' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -123.93 145.47 49.12 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 129.832 3.901 . . . . 0.0 111.112 179.532 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 6.4 ptpp? -156.11 172.58 18.18 Favored 'General case' 0 C--O 1.202 -1.411 0 O-C-N 128.283 3.489 . . . . 0.0 111.975 -179.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.497 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -133.54 175.47 9.39 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 110.279 -3.146 . . . . 0.0 109.565 -179.627 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 110' ' ' TRP . . . . . 0.506 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -172.27 84.29 0.07 Allowed 'General case' 0 CA--C 1.502 -0.891 1 O-C-N 130.05 4.594 . . . . 0.0 115.208 179.73 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.5 t -37.32 90.8 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.83 0 CA-C-O 124.654 2.168 . . . . 0.0 111.859 179.399 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -91.87 47.49 1.35 Allowed 'General case' 0 CA--C 1.486 -1.492 0 CA-C-N 110.079 -3.237 . . . . 0.0 116.662 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.23 -103.36 1.22 Allowed Glycine 0 C--O 1.212 -1.239 0 O-C-N 121.034 -1.041 . . . . 0.0 115.483 179.752 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -100.08 -8.09 24.16 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -135.21 177.84 7.5 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 128.898 3.874 . . . . 0.0 108.345 179.884 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.12 117.99 13.28 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 126.734 2.521 . . . . 0.0 113.146 179.723 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.506 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.3 m-85 -71.06 151.36 44.62 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 111.514 -2.584 . . . . 0.0 114.432 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -121.18 52.53 1.2 Allowed 'General case' 0 CA--C 1.5 -0.946 2 O-C-N 131.729 5.643 . . . . 0.0 108.733 -179.991 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.91 146.29 32.62 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 127.876 2.47 . . . . 0.0 108.43 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -156.5 162.14 39.97 Favored 'General case' 0 CA--C 1.486 -1.517 0 O-C-N 126.263 2.227 . . . . 0.0 111.231 -179.755 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.2 m -118.15 162.98 17.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 127.52 3.012 . . . . 0.0 105.134 -179.661 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.419 ' N ' ' O ' ' A' ' 104' ' ' ASN . 0.6 OUTLIER -166.32 47.72 0.07 Allowed 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 126.245 2.926 . . . . 0.0 110.918 179.52 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.19 61.48 2.64 Favored Glycine 0 C--O 1.238 0.38 0 CA-C-N 110.269 -3.15 . . . . 0.0 110.952 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 66.36 41.83 3.19 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 128.112 2.89 . . . . 0.0 111.774 179.69 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.447 ' HG3' ' CB ' ' A' ' 23' ' ' ALA . 5.4 mm-40 -131.58 31.53 4.28 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.569 3.043 . . . . 0.0 104.586 179.828 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 9.7 p -22.44 75.32 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 O-C-N 127.739 3.149 . . . . 0.0 114.764 179.819 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 13.1 t -68.31 139.77 55.92 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 119.51 -1.994 . . . . 0.0 111.19 -179.847 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.28 147.5 44.21 Favored 'General case' 0 N--CA 1.47 0.542 1 O-C-N 129.266 4.104 . . . . 0.0 110.667 179.657 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -132.48 178.87 6.5 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 128.267 3.479 . . . . 0.0 110.92 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.27 141.52 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 103.282 -2.858 . . . . 0.0 103.282 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.5 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 42.6 m-85 -127.18 171.04 11.78 Favored 'General case' 0 CA--C 1.486 -1.511 0 O-C-N 128.399 3.562 . . . . 0.0 114.861 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.404 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.322 0.1 OUTLIER -157.27 117.97 3.56 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 112.723 -3.513 . . . . 0.0 103.296 179.997 . . . . . . . . 4 4 . 1 . 024 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.545 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 10.9 pttt -52.94 130.61 34.05 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 130.292 4.745 . . . . 0.0 110.268 179.373 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.799 0 O-C-N 126.212 2.195 . . . . 0.0 115.902 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.103 0 CA-C-O 123.323 1.535 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -150.74 151.01 31.76 Favored 'General case' 0 C--O 1.211 -0.972 0 O-C-N 120.995 -1.066 . . . . 0.0 109.978 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 65.27 0.01 OUTLIER 'General case' 0 C--N 1.358 0.937 0 O-C-N 127.768 3.167 . . . . 0.0 117.851 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -157.75 76.66 0.81 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -108.43 12.25 26.37 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 116.031 -1.938 . . . . 0.0 107.607 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -9.52 119.09 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.954 1 O-C-N 132.835 6.334 . . . . 0.0 115.382 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -170.26 -135.12 1.85 Allowed Glycine 0 C--O 1.21 -1.386 0 CA-C-O 116.693 -2.17 . . . . 0.0 110.259 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.475 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 1.3 p -155.56 163.75 39.56 Favored 'General case' 0 C--O 1.208 -1.093 1 O-C-N 132.168 5.275 . . . . 0.0 107.201 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.539 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.254 0.0 OUTLIER -156.92 101.59 1.95 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 128.063 3.352 . . . . 0.0 111.391 179.965 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -56.48 -18.25 10.85 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.493 ' HG3' ' CE2' ' A' ' 131' ' ' PHE . 27.7 ttm 68.28 84.98 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 103.364 -2.828 . . . . 0.0 103.364 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB3' ' HG2' ' A' ' 132' ' ' LYS . 0.2 OUTLIER -44.01 -29.67 0.62 Allowed 'General case' 0 C--N 1.312 -1.029 0 O-C-N 128.802 3.814 . . . . 0.0 111.698 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.415 ' N ' ' HG3' ' A' ' 12' ' ' GLU 0.265 1.5 m -176.15 162.9 2.55 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-N 113.718 -1.583 . . . . 0.0 112.052 -179.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.426 ' ND2' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.96 121.25 27.61 Favored 'General case' 0 CA--C 1.501 -0.94 0 CA-C-N 111.194 -2.73 . . . . 0.0 114.354 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -70.74 -63.45 1.09 Allowed 'General case' 0 CA--C 1.491 -1.325 1 O-C-N 129.654 4.346 . . . . 0.0 109.288 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -115.13 135.21 54.44 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -128.44 -56.42 1.23 Allowed 'General case' 0 CA--C 1.495 -1.173 0 CA-C-O 124.183 1.944 . . . . 0.0 110.936 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.547 ' HB2' ' CB ' ' A' ' 31' ' ' ARG . 5.3 tp10 -76.71 -37.02 56.81 Favored 'General case' 0 CA--C 1.499 -0.992 0 O-C-N 120.391 -1.443 . . . . 0.0 113.204 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.501 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.15 -25.01 46.03 Favored Glycine 0 CA--C 1.5 -0.882 0 O-C-N 128.537 3.648 . . . . 0.0 112.609 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -75.0 -37.79 61.76 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 119.136 1.468 . . . . 0.0 107.934 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 mtm -77.23 -20.95 54.54 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 112.368 -2.196 . . . . 0.0 107.628 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.501 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 3.0 ttmt -75.09 -38.42 61.23 Favored 'General case' 0 C--O 1.199 -1.572 0 C-N-CA 128.845 2.858 . . . . 0.0 114.595 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.0 -36.39 83.41 Favored 'General case' 0 C--O 1.203 -1.379 1 O-C-N 130.971 5.169 . . . . 0.0 114.163 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.413 HD13 ' N ' ' A' ' 26' ' ' ILE . 3.7 pp -94.58 -2.48 51.41 Favored 'General case' 0 C--O 1.215 -0.763 1 O-C-N 129.364 4.165 . . . . 0.0 107.969 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.7 t0 45.7 79.53 0.05 Allowed 'General case' 0 CA--C 1.483 -1.631 0 CA-C-O 128.159 3.838 . . . . 0.0 111.093 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.413 ' N ' HD13 ' A' ' 24' ' ' LEU . 15.6 tt -84.0 -50.15 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.685 0 CA-C-N 109.452 -3.522 . . . . 0.0 108.274 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -175.94 26.23 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 115.016 -2.421 . . . . 0.0 112.678 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 31.79 37.47 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.303 0 O-C-N 126.308 2.255 . . . . 0.0 117.039 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.0 172.82 17.48 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 112.363 -2.199 . . . . 0.0 106.729 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.287 0.6 OUTLIER 97.71 -7.01 0.06 Allowed 'General case' 0 N--CA 1.484 1.235 1 O-C-N 131.126 5.266 . . . . 0.0 112.667 -179.749 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.547 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -75.51 -16.82 60.25 Favored 'General case' 0 C--O 1.238 0.451 1 O-C-N 131.594 5.559 . . . . 0.0 107.524 179.475 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.426 ' HG2' ' HG2' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -103.8 -11.85 17.31 Favored 'General case' 0 C--O 1.213 -0.854 0 O-C-N 127.534 3.021 . . . . 0.0 111.476 -179.638 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.3 mp -116.1 -53.36 4.55 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.194 1 O-C-N 130.349 4.781 . . . . 0.0 114.121 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HB3' ' CE2' ' A' ' 58' ' ' PHE . . . -67.78 -10.38 52.26 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.9 t -15.82 -48.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.557 0 N-CA-C 116.866 2.173 . . . . 0.0 116.866 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.406 ' N ' ' O ' ' A' ' 34' ' ' ALA . 0.1 OUTLIER 162.2 115.38 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.604 2 O-C-N 129.814 4.446 . . . . 0.0 115.311 179.762 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HB2' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -142.42 68.79 1.31 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 110.825 -2.898 . . . . 0.0 106.906 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.4 m 93.49 -17.96 0.11 Allowed 'General case' 0 C--O 1.24 0.557 0 O-C-N 128.357 3.535 . . . . 0.0 117.42 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -12.7 89.16 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.007 0 O-C-N 127.678 3.111 . . . . 0.0 117.695 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -111.21 102.16 10.61 Favored 'General case' 0 N--CA 1.434 -1.273 1 O-C-N 132.169 5.918 . . . . 0.0 111.815 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.476 ' CD ' ' CD1' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -75.18 141.98 43.55 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 128.196 3.435 . . . . 0.0 107.425 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.462 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 3.7 mt -140.01 160.17 26.39 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 CA-C-O 123.291 1.519 . . . . 0.0 111.779 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.462 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.316 9.1 tt -132.3 142.99 41.28 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.476 0 CA-C-N 110.989 -2.823 . . . . 0.0 107.652 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.442 ' CG1' ' N ' ' A' ' 45' ' ' GLN . 2.1 t -115.98 -68.16 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 CA-C-N 113.888 -1.506 . . . . 0.0 114.661 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.442 ' N ' ' CG1' ' A' ' 44' ' ' VAL . 2.1 mt-30 69.12 133.19 0.03 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 O-C-N 124.832 1.332 . . . . 0.0 113.317 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -132.58 -24.51 1.99 Allowed 'General case' 0 C--N 1.359 0.98 1 O-C-N 130.213 4.696 . . . . 0.0 117.124 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.11 -69.85 0.4 Allowed Glycine 0 C--O 1.218 -0.905 0 CA-C-O 122.958 1.31 . . . . 0.0 111.243 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -102.61 -8.25 21.11 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-N 111.227 -2.487 . . . . 0.0 112.037 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -118.48 177.77 4.7 Favored 'General case' 0 C--N 1.354 0.793 0 CA-C-O 114.45 -2.69 . . . . 0.0 111.316 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.478 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 5.9 t80 -172.22 113.68 0.31 Allowed 'General case' 0 C--N 1.313 -1.01 1 O-C-N 132.062 5.851 . . . . 0.0 115.828 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.408 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -133.72 79.92 1.85 Allowed 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 118.594 2.813 . . . . 0.0 118.594 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.41 149.71 33.16 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 112.458 -2.155 . . . . 0.0 107.153 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -146.06 162.6 37.53 Favored 'General case' 0 CA--C 1.49 -1.365 0 O-C-N 127.259 2.849 . . . . 0.0 111.516 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.02 123.03 49.36 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 127.602 3.064 . . . . 0.0 107.647 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.438 ' HB2' ' CD1' ' A' ' 42' ' ' ILE . 0.1 OUTLIER -91.68 29.35 1.55 Allowed 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.544 ' HB3' ' CD1' ' A' ' 58' ' ' PHE . 0.6 OUTLIER -53.08 157.74 1.7 Allowed 'General case' 0 C--O 1.209 -1.051 0 O-C-N 128.853 3.845 . . . . 0.0 105.792 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.408 ' HB ' ' HB2' ' A' ' 37' ' ' LEU . 46.2 m -84.54 -7.6 59.21 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 109.212 -3.631 . . . . 0.0 109.163 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.544 ' CD1' ' HB3' ' A' ' 56' ' ' SER . 0.3 OUTLIER -101.75 -39.12 7.57 Favored 'General case' 0 C--N 1.366 1.296 0 CA-C-O 125.095 2.379 . . . . 0.0 110.466 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.79 149.56 27.55 Favored 'General case' 0 C--N 1.361 1.083 1 CA-C-N 107.794 -4.276 . . . . 0.0 117.93 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 79.71 1.62 Allowed 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 109.185 -3.643 . . . . 0.0 109.295 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -170.95 71.49 0.05 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 108.932 -3.758 . . . . 0.0 107.477 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.437 ' HB3' ' HA ' ' A' ' 53' ' ' LYS . 2.8 t0 -106.57 -127.13 0.25 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.6 2.438 . . . . 0.0 115.648 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.532 HD13 ' CZ2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -56.07 101.52 0.06 Allowed 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.368 -179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -132.2 88.91 2.6 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 127.086 2.741 . . . . 0.0 112.369 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.519 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -166.52 179.62 5.41 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 124.088 1.899 . . . . 0.0 112.785 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.59 152.23 30.6 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.76 144.01 13.68 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.866 0 O-C-N 128.915 3.884 . . . . 0.0 115.202 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.71 7.54 22.24 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 128.607 3.692 . . . . 0.0 116.936 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 1.1 t -72.84 -26.46 23.49 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.575 0 O-C-N 125.312 1.242 . . . . 0.0 109.136 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 65.68 89.86 0.09 Allowed 'General case' 0 C--O 1.212 -0.896 2 O-C-N 131.028 5.205 . . . . 0.0 109.383 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.423 ' O ' ' N ' ' A' ' 73' ' ' GLU . 3.4 t80 -74.89 67.35 1.65 Allowed 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 127.265 2.853 . . . . 0.0 112.258 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -50.01 79.12 0.0 OUTLIER 'General case' 0 CA--C 1.484 -1.591 0 CA-C-N 113.593 -1.64 . . . . 0.0 113.625 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.477 ' HB3' ' CA ' ' A' ' 82' ' ' ASN . 11.1 mt-10 52.89 -165.76 0.07 Allowed 'General case' 0 C--O 1.212 -0.89 0 C-N-CA 125.311 1.444 . . . . 0.0 111.848 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.5 t60 72.49 78.8 0.15 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 125.449 2.547 . . . . 0.0 115.843 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.41 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -122.82 170.28 10.25 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 111.925 -2.398 . . . . 0.0 112.945 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.41 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.15 138.22 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 O-C-N 128.34 3.525 . . . . 0.0 113.68 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 125.94 -17.41 6.76 Favored Glycine 0 C--O 1.213 -1.181 0 CA-C-N 112.165 -2.288 . . . . 0.0 110.067 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.7 tp -122.75 -67.85 0.92 Allowed 'General case' 0 N--CA 1.469 0.503 2 CA-C-N 106.734 -4.733 . . . . 0.0 112.869 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -104.51 -72.62 0.7 Allowed 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.2 76.2 1.18 Allowed Glycine 0 C--O 1.217 -0.96 0 CA-C-O 124.676 2.265 . . . . 0.0 111.439 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.432 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 11.6 tpp180 -150.22 -117.77 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.228 1 CA-C-N 107.195 -4.503 . . . . 0.0 113.112 179.682 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.477 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.5 OUTLIER -172.57 97.37 0.14 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.828 1.194 . . . . 0.0 112.256 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 87.8 t -135.77 126.91 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 N-CA-C 117.959 2.577 . . . . 0.0 117.959 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.476 ' CB ' ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -51.8 122.25 7.93 Favored 'General case' 0 C--O 1.218 -0.601 0 O-C-N 128.782 3.801 . . . . 0.0 106.837 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 21.5 m -133.33 83.27 2.04 Favored 'General case' 0 C--O 1.196 -1.735 0 O-C-N 128.417 3.573 . . . . 0.0 112.952 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.432 ' HG ' ' N ' ' A' ' 87' ' ' VAL . 1.1 tp -82.73 138.66 33.98 Favored 'General case' 0 N--CA 1.438 -1.047 1 CA-C-N 107.033 -4.621 . . . . 0.0 111.595 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.432 ' N ' ' HG ' ' A' ' 86' ' ' LEU . 97.3 t -123.31 140.22 47.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 124.888 1.275 . . . . 0.0 110.602 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.9 m -154.68 152.08 29.52 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 112.647 -2.069 . . . . 0.0 110.625 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.665 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 38.8 m95 -89.9 139.23 30.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 129.082 2.953 . . . . 0.0 106.847 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.29 -16.18 27.94 Favored 'General case' 0 CA--C 1.478 -1.811 1 CA-C-O 130.146 4.784 . . . . 0.0 114.925 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.68 -30.88 3.5 Favored Glycine 0 C--N 1.362 1.98 1 CA-C-N 107.542 -4.39 . . . . 0.0 103.411 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -156.16 91.0 1.23 Allowed 'General case' 0 N--CA 1.428 -1.569 1 O-C-N 132.906 5.709 . . . . 0.0 106.296 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.2 t 116.59 160.47 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 128.852 2.861 . . . . 0.0 118.029 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.477 HD11 ' CZ2' ' A' ' 89' ' ' TRP . 6.1 tp -102.81 99.07 8.99 Favored 'General case' 0 CA--C 1.49 -1.339 0 CA-C-O 125.216 2.436 . . . . 0.0 117.326 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.407 HG12 ' NZ ' ' A' ' 108' ' ' LYS 0.357 66.9 t -92.66 121.55 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 114.83 -2.509 . . . . 0.0 112.547 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.418 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -136.39 140.9 43.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 124.189 1.947 . . . . 0.0 109.387 -179.445 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.4 t -107.83 102.94 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.967 0 CA-C-N 109.267 -3.606 . . . . 0.0 118.08 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.408 ' HG3' ' C ' ' A' ' 105' ' ' ARG . 5.0 mm100 -83.09 86.34 7.03 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.128 -1.608 . . . . 0.0 107.959 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.476 ' HB3' ' CB ' ' A' ' 84' ' ' LYS . 0.6 OUTLIER -76.16 100.25 4.95 Favored 'General case' 0 C--O 1.2 -1.526 0 CA-C-N 109.498 -3.501 . . . . 0.0 107.769 -179.321 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -98.68 177.47 30.59 Favored Glycine 0 C--O 1.214 -1.1 0 O-C-N 127.597 3.061 . . . . 0.0 112.271 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -107.96 -39.91 5.39 Favored 'General case' 0 CA--C 1.494 -1.2 1 CA-C-N 106.675 -4.762 . . . . 0.0 111.989 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.43 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -117.06 -41.85 2.98 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 125.067 2.365 . . . . 0.0 115.433 179.68 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' A' ' 105' ' ' ARG . 2.0 pp20? -113.78 167.24 10.79 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 126.582 3.087 . . . . 0.0 112.561 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -126.65 90.11 3.11 Favored 'General case' 0 N--CA 1.489 1.514 1 CA-C-N 107.346 -4.479 . . . . 0.0 102.415 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.441 ' N ' ' OE1' ' A' ' 103' ' ' GLU . 5.8 mmm180 -79.74 -7.76 58.82 Favored 'General case' 0 C--N 1.317 -0.806 1 O-C-N 129.448 4.218 . . . . 0.0 113.011 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -22.51 98.59 0.01 OUTLIER Glycine 0 N--CA 1.442 -0.936 1 O-C-N 133.71 6.881 . . . . 0.0 112.333 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.581 ' HE1' ' NE2' ' A' ' 109' ' ' GLN 0.333 0.0 OUTLIER -116.79 125.27 51.35 Favored 'General case' 0 C--O 1.219 -0.536 1 O-C-N 132.415 5.42 . . . . 0.0 111.34 -179.197 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.481 ' HB2' ' CZ3' ' A' ' 110' ' ' TRP . 0.1 OUTLIER -151.19 153.61 35.28 Favored 'General case' 0 CA--C 1.507 -0.707 0 O-C-N 128.552 3.657 . . . . 0.0 116.318 -178.518 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.581 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 0.7 OUTLIER -116.53 167.51 10.99 Favored 'General case' 0 C--N 1.36 1.055 0 CA-C-N 109.725 -3.398 . . . . 0.0 110.248 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.481 ' CZ3' ' HB2' ' A' ' 108' ' ' LYS . 0.5 OUTLIER -177.36 99.34 0.05 OUTLIER 'General case' 0 C--O 1.211 -0.929 0 O-C-N 128.309 3.505 . . . . 0.0 114.87 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.0 t -47.23 97.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.825 0 CA-C-O 124.948 2.308 . . . . 0.0 112.988 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.466 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 9.2 mm-40 -94.21 50.91 1.42 Allowed 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 109.09 -3.687 . . . . 0.0 112.604 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.19 -130.14 9.14 Favored Glycine 0 C--O 1.201 -1.934 0 O-C-N 119.465 -2.022 . . . . 0.0 113.057 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -90.77 16.26 9.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 127.405 2.282 . . . . 0.0 117.093 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.412 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -142.97 -176.52 4.94 Favored 'General case' 0 C--O 1.223 -0.303 0 O-C-N 128.529 3.643 . . . . 0.0 108.305 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.468 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -140.75 108.17 5.56 Favored 'General case' 0 CA--C 1.485 -1.54 1 O-C-N 130.283 4.739 . . . . 0.0 117.598 -179.904 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.466 ' CD2' ' HB2' ' A' ' 112' ' ' GLU . 17.4 m-30 -72.36 142.72 48.76 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 111.23 -2.714 . . . . 0.0 116.809 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.525 ' HG ' ' CZ ' ' A' ' 131' ' ' PHE . 3.1 mt -130.48 86.37 2.38 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 109.141 -3.663 . . . . 0.0 107.542 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -96.98 92.41 6.07 Favored 'General case' 0 CA--C 1.495 -1.164 0 C-N-CA 128.278 2.631 . . . . 0.0 111.829 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.474 ' CD2' ' HB3' ' A' ' 127' ' ' CYS . 0.3 OUTLIER -110.64 -177.07 3.13 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 128.119 3.387 . . . . 0.0 108.645 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.2 t -150.44 178.32 9.16 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.978 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.5 p -173.09 60.23 0.02 OUTLIER 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 126.066 2.841 . . . . 0.0 113.078 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.97 -74.77 1.09 Allowed Glycine 0 CA--C 1.521 0.439 0 CA-C-N 111.166 -2.743 . . . . 0.0 112.79 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.91 -50.47 3.05 Favored 'General case' 0 CA--C 1.493 -1.214 0 O-C-N 126.19 1.759 . . . . 0.0 110.966 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.28 174.94 1.06 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 128.466 3.604 . . . . 0.0 109.815 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.6 p -153.81 88.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 CA-C-N 109.425 -3.534 . . . . 0.0 111.007 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.474 ' HB3' ' CD2' ' A' ' 120' ' ' LEU . 52.0 t -73.35 118.53 16.41 Favored 'General case' 0 CA--C 1.49 -1.349 0 CA-C-N 112.161 -2.29 . . . . 0.0 112.203 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -106.1 135.5 47.45 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 114.524 -2.655 . . . . 0.0 110.46 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -126.34 154.31 43.69 Favored 'General case' 0 CA--C 1.488 -1.422 1 O-C-N 129.671 4.357 . . . . 0.0 116.159 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.22 136.21 53.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.525 ' CZ ' ' HG ' ' A' ' 118' ' ' LEU . 52.4 m-85 -126.47 -179.43 4.76 Favored 'General case' 0 CA--C 1.477 -1.853 0 CA-C-N 111.709 -2.496 . . . . 0.0 113.916 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.431 ' HG2' ' HB3' ' A' ' 12' ' ' GLU 0.318 0.0 OUTLIER -157.69 45.86 0.36 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 112.369 -3.681 . . . . 0.0 108.825 -179.759 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.539 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 35.6 ttpt 15.18 102.2 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.933 1 O-C-N 130.186 4.679 . . . . 0.0 118.294 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt . . . . . 0 CA--C 1.494 -1.189 0 CA-C-O 114.383 -2.722 . . . . 0.0 112.02 -179.581 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 mmt . . . . . 0 N--CA 1.505 2.317 0 CA-C-O 123.572 1.653 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.37 -56.12 3.05 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-N 114.105 -1.407 . . . . 0.0 110.251 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.434 ' HG2' ' CH2' ' A' ' 89' ' ' TRP . 0.6 OUTLIER -105.21 -50.36 3.25 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 128.157 3.411 . . . . 0.0 118.583 -179.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.28 105.27 0.07 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 125.898 1.679 . . . . 0.0 109.602 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -116.43 -143.57 0.38 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 112.743 -3.503 . . . . 0.0 102.073 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.9 m120 125.42 122.45 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 1 O-C-N 131.026 5.204 . . . . 0.0 115.337 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.02 -169.96 33.16 Favored Glycine 0 C--O 1.204 -1.722 0 CA-C-N 112.108 -2.315 . . . . 0.0 111.885 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.513 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -119.01 152.11 37.0 Favored 'General case' 0 C--O 1.202 -1.412 1 O-C-N 132.15 5.265 . . . . 0.0 104.216 179.735 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.513 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -149.11 108.05 3.88 Favored 'General case' 0 CA--C 1.486 -1.506 1 O-C-N 132.426 6.079 . . . . 0.0 112.517 -179.976 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -76.52 100.73 5.37 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 116.213 -2.195 . . . . 0.0 108.156 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 4.9 ttm -32.53 -42.42 0.07 Allowed 'General case' 0 N--CA 1.474 0.759 0 O-C-N 127.409 2.943 . . . . 0.0 108.78 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 85.25 -55.84 0.09 Allowed 'General case' 0 CA--C 1.51 -0.569 1 O-C-N 131.461 5.475 . . . . 0.0 112.224 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -157.44 -175.67 5.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 124.815 2.245 . . . . 0.0 111.419 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.527 ' N ' ' ND2' ' A' ' 14' ' ' ASN . 1.5 p30 -155.26 168.0 28.51 Favored 'General case' 0 CA--C 1.483 -1.617 0 CA-C-N 111.513 -2.585 . . . . 0.0 114.109 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -89.9 -80.61 0.31 Allowed 'General case' 0 CA--C 1.503 -0.859 0 O-C-N 128.781 3.801 . . . . 0.0 110.01 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -114.14 126.84 55.53 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 123.216 1.484 . . . . 0.0 112.31 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.402 ' CZ ' HG23 ' A' ' 35' ' ' VAL . 5.7 p90 -109.74 -44.81 3.76 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-O 124.095 1.902 . . . . 0.0 107.883 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.429 ' HG3' ' CB ' ' A' ' 31' ' ' ARG . 5.2 tt0 -66.8 -37.22 84.12 Favored 'General case' 0 C--O 1.215 -0.721 0 O-C-N 120.685 -1.259 . . . . 0.0 113.732 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.18 -33.01 81.67 Favored Glycine 0 N--CA 1.475 1.24 1 O-C-N 129.36 4.163 . . . . 0.0 109.73 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -73.69 -44.18 57.29 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-O 124.878 2.275 . . . . 0.0 107.447 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -61.28 -23.47 65.7 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 124.389 2.042 . . . . 0.0 113.282 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -76.58 -27.3 55.77 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 108.441 -3.982 . . . . 0.0 112.684 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.26 -42.24 79.92 Favored 'General case' 0 N--CA 1.477 0.915 1 O-C-N 129.883 4.489 . . . . 0.0 111.679 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.482 ' CD2' ' N ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -84.73 -16.33 42.04 Favored 'General case' 0 N--CA 1.483 1.184 1 O-C-N 130.194 4.684 . . . . 0.0 103.966 -179.698 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.4 t0 55.33 84.0 0.08 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 128.561 3.663 . . . . 0.0 110.587 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.444 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 20.2 tt -124.39 53.59 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 1 CA-C-N 107.988 -4.187 . . . . 0.0 107.237 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.55 -171.74 0.85 Allowed 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 113.239 -1.8 . . . . 0.0 113.584 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 65.75 46.92 2.22 Favored 'General case' 0 CA--C 1.501 -0.924 0 O-C-N 126.288 2.242 . . . . 0.0 116.518 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 88.86 163.04 0.06 Allowed 'General case' 0 C--O 1.2 -1.506 0 O-C-N 127.387 2.929 . . . . 0.0 107.858 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 t 122.38 -31.64 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.016 2 O-C-N 133.214 6.571 . . . . 0.0 109.142 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.429 ' CB ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -105.56 163.96 12.26 Favored 'General case' 0 C--O 1.243 0.725 1 O-C-N 132.357 6.036 . . . . 0.0 108.103 179.34 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 mttt 82.68 10.02 0.65 Allowed 'General case' 0 C--O 1.2 -1.53 0 O-C-N 127.63 3.081 . . . . 0.0 109.922 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.8 mp -145.36 -57.81 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.58 2 O-C-N 132.009 5.818 . . . . 0.0 107.357 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.526 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -82.92 62.15 6.33 Favored 'General case' 0 C--O 1.203 -1.377 0 CA-C-N 112.235 -2.257 . . . . 0.0 113.797 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.402 HG23 ' CZ ' ' A' ' 17' ' ' PHE . 3.2 t -83.81 -45.48 18.38 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.322 0 CA-C-N 111.032 -2.804 . . . . 0.0 109.589 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.474 ' CD ' ' HB2' ' A' ' 39' ' ' GLN . 1.0 OUTLIER 168.0 113.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.664 2 O-C-N 131.416 5.448 . . . . 0.0 109.475 179.793 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.518 ' HG ' ' CD2' ' A' ' 58' ' ' PHE . 0.4 OUTLIER -90.11 -9.08 49.7 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 127.496 2.997 . . . . 0.0 111.449 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.464 ' CG2' ' N ' ' A' ' 39' ' ' GLN . 0.8 OUTLIER 164.31 -65.19 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.135 0 O-C-N 128.158 3.411 . . . . 0.0 112.289 179.886 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.474 ' HB2' ' CD ' ' A' ' 36' ' ' ARG . 14.0 tm0? 66.58 146.5 0.04 OUTLIER 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.406 ' N ' ' CD ' ' A' ' 39' ' ' GLN . 20.1 m -162.01 104.77 1.17 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 130.837 3.655 . . . . 0.0 112.004 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 0.8 OUTLIER -86.98 146.37 26.16 Favored 'General case' 0 N--CA 1.488 1.425 1 O-C-N 129.662 4.351 . . . . 0.0 109.054 -179.433 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.463 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 3.0 mt -134.84 154.91 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-N 114.506 -1.225 . . . . 0.0 110.574 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.533 HG13 ' CE1' ' A' ' 50' ' ' PHE . 13.7 tt -130.27 124.75 58.41 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 O-C-N 128.37 3.544 . . . . 0.0 107.463 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.2 t -98.36 -32.54 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.173 0 CA-C-N 113.303 -1.771 . . . . 0.0 111.501 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.486 ' HB2' ' CD1' ' A' ' 50' ' ' PHE . 25.0 tt0 8.16 91.03 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.02 0 O-C-N 127.38 2.925 . . . . 0.0 118.111 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.82 -35.05 15.03 Favored 'General case' 0 CA--C 1.477 -1.84 2 CA-C-N 106.678 -4.783 . . . . 0.0 114.857 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.17 -111.81 0.5 Allowed Glycine 0 C--O 1.204 -1.774 0 O-C-N 120.457 -1.402 . . . . 0.0 112.493 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -52.51 -28.11 19.2 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 125.964 1.626 . . . . 0.0 111.854 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -117.46 138.75 51.65 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 128.487 2.715 . . . . 0.0 109.279 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.533 ' CE1' HG13 ' A' ' 43' ' ' ILE . 1.7 t80 -149.73 113.54 5.07 Favored 'General case' 0 CA--C 1.483 -1.631 0 O-C-N 127.501 3.001 . . . . 0.0 113.014 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.4 mttm -119.19 82.81 1.93 Allowed 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.413 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -58.8 133.16 55.73 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 128.491 3.62 . . . . 0.0 106.719 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.402 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.5 OUTLIER -144.43 154.3 42.81 Favored 'General case' 0 CA--C 1.488 -1.427 0 C-N-CA 115.087 -2.645 . . . . 0.0 111.453 -179.509 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.77 155.38 18.36 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 127.57 3.044 . . . . 0.0 111.658 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -138.09 49.27 1.95 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.985 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -88.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 1 O-C-N 130.971 5.169 . . . . 0.0 107.93 179.796 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.476 HG23 ' CD2' ' A' ' 37' ' ' LEU . 0.9 OUTLIER 155.88 -33.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.18 1 O-C-N 131.577 5.548 . . . . 0.0 104.313 -179.575 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.526 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 8.6 m-85 -69.03 -49.37 58.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 125.955 2.035 . . . . 0.0 108.098 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -155.23 120.18 4.85 Favored 'General case' 0 C--N 1.364 1.227 2 CA-C-N 106.869 -4.696 . . . . 0.0 112.845 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 m-20 -104.85 21.94 16.08 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 111.232 -2.713 . . . . 0.0 111.724 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -117.29 98.52 6.48 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 128.586 3.679 . . . . 0.0 109.622 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -108.95 -79.7 0.58 Allowed 'General case' 0 C--O 1.205 -1.25 1 O-C-N 129.298 4.124 . . . . 0.0 113.361 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.541 ' HG ' ' CZ ' ' A' ' 65' ' ' PHE . 1.1 tp -125.54 119.53 28.4 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -144.75 88.85 1.93 Allowed 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.541 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -150.12 -163.61 1.82 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 123.451 1.595 . . . . 0.0 110.23 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -145.59 152.24 39.38 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.42 HG22 ' NE1' ' A' ' 89' ' ' TRP . 3.1 t -61.55 130.94 26.35 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.586 0 C-N-CA 116.724 -1.991 . . . . 0.0 113.544 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.14 -0.73 89.33 Favored Glycine 0 N--CA 1.486 1.998 0 CA-C-N 110.763 -2.926 . . . . 0.0 116.461 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.418 HG13 ' N ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -49.85 -39.13 14.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 125.208 1.181 . . . . 0.0 109.66 -179.654 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 57.17 65.14 1.44 Allowed 'General case' 0 C--O 1.211 -0.946 1 O-C-N 130.67 4.981 . . . . 0.0 108.546 -179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.448 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.1 t80 -49.16 92.65 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.68 2 O-C-N 133.421 6.701 . . . . 0.0 110.866 -179.384 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -57.29 63.84 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.997 0 O-C-N 126.403 2.314 . . . . 0.0 113.93 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HB3' ' CA ' ' A' ' 82' ' ' ASN 0.258 5.3 mt-10 56.36 -170.59 0.08 Allowed 'General case' 0 CA--C 1.484 -1.574 0 CA-C-O 125.373 2.511 . . . . 0.0 110.05 179.743 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.75 93.11 0.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 109.225 -3.625 . . . . 0.0 109.004 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.43 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 2.0 p -96.07 -55.86 2.83 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 111.301 -2.681 . . . . 0.0 116.91 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.43 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 48.1 165.31 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.933 1 O-C-N 129.348 4.155 . . . . 0.0 115.562 -179.515 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.18 -51.39 3.42 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 112.36 -2.2 . . . . 0.0 112.497 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.444 ' HA ' ' CD1' ' A' ' 26' ' ' ILE 0.267 2.5 tp -119.8 -0.79 10.63 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 127.975 2.809 . . . . 0.0 117.417 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -154.99 -74.08 0.11 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 116.545 -2.062 . . . . 0.0 113.199 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.93 72.88 1.28 Allowed Glycine 0 C--O 1.212 -1.219 0 CA-C-O 122.578 1.099 . . . . 0.0 111.825 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -136.89 -148.45 0.28 Allowed 'General case' 0 C--N 1.351 0.651 0 CA-C-N 110.185 -3.007 . . . . 0.0 109.107 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.475 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 40.6 m-20 -161.69 100.15 1.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 125.637 1.835 . . . . 0.0 109.516 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 40.4 t -129.13 146.81 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 O-C-N 127.265 2.853 . . . . 0.0 118.534 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.413 ' CB ' ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -79.87 88.23 5.29 Favored 'General case' 0 C--O 1.218 -0.595 1 O-C-N 130.423 4.827 . . . . 0.0 108.254 179.436 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.448 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 8.0 m -99.22 85.83 3.29 Favored 'General case' 0 C--O 1.193 -1.882 1 O-C-N 130.258 4.724 . . . . 0.0 114.034 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.9 tt -89.63 155.71 19.06 Favored 'General case' 0 N--CA 1.442 -0.854 1 CA-C-N 107.509 -4.405 . . . . 0.0 110.238 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.422 HG22 ' CZ ' ' A' ' 65' ' ' PHE . 2.4 p -140.14 132.49 33.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 127.087 2.155 . . . . 0.0 109.692 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.8 t -155.8 -178.69 7.48 Favored 'General case' 0 CA--C 1.485 -1.55 0 CA-C-O 125.419 2.533 . . . . 0.0 111.584 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.693 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 58.5 m95 -99.25 145.6 27.1 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 118.577 -2.577 . . . . 0.0 108.647 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.467 ' CB ' HG21 ' A' ' 93' ' ' THR . 7.2 tp10 -93.09 -44.45 8.37 Favored 'General case' 0 C--O 1.201 -1.455 1 CA-C-O 131.529 5.443 . . . . 0.0 112.15 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 174.93 -46.64 0.13 Allowed Glycine 0 N--CA 1.478 1.491 1 CA-C-N 106.634 -4.803 . . . . 0.0 104.464 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -141.48 36.53 1.67 Allowed 'General case' 0 C--O 1.202 -1.438 1 O-C-N 130.305 4.18 . . . . 0.0 110.881 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.467 HG21 ' CB ' ' A' ' 90' ' ' GLU . 3.6 t -176.09 158.72 2.02 Favored 'General case' 0 C--O 1.203 -1.354 0 N-CA-C 118.048 2.61 . . . . 0.0 118.048 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.4 tp -90.01 94.55 9.84 Favored 'General case' 0 CA--C 1.492 -1.258 0 O-C-N 128.613 3.695 . . . . 0.0 117.244 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.449 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.366 38.2 t -91.91 126.72 44.47 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-N 108.816 -3.811 . . . . 0.0 111.923 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.4 m -131.64 123.74 28.47 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 127.077 2.736 . . . . 0.0 103.795 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.1 t -96.31 119.73 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 110.854 -2.884 . . . . 0.0 112.657 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.497 ' HG3' ' CB ' ' A' ' 105' ' ' ARG 0.307 0.1 OUTLIER -94.68 104.24 16.16 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 110.895 -2.866 . . . . 0.0 107.886 179.647 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.413 ' HB3' ' CB ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -119.9 106.92 12.52 Favored 'General case' 0 C--O 1.206 -1.227 0 O-C-N 127.27 2.856 . . . . 0.0 110.681 -179.611 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -120.47 -169.12 13.86 Favored Glycine 0 C--O 1.209 -1.415 0 CA-C-O 124.033 1.907 . . . . 0.0 109.57 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -72.69 -13.39 61.34 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 108.376 -3.912 . . . . 0.0 112.459 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -160.63 -43.24 0.05 OUTLIER 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 117.407 2.373 . . . . 0.0 117.407 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.432 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 28.4 mt-10 -56.04 144.78 27.69 Favored 'General case' 0 C--O 1.208 -1.121 0 O-C-N 126.716 2.51 . . . . 0.0 117.668 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -127.11 60.56 1.38 Allowed 'General case' 0 N--CA 1.491 1.593 1 CA-C-N 107.597 -4.365 . . . . 0.0 102.0 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.497 ' CB ' ' HG3' ' A' ' 98' ' ' GLN . 0.7 OUTLIER -69.32 -15.54 63.36 Favored 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.118 5.261 . . . . 0.0 113.792 -179.667 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.427 ' CA ' ' HG2' ' A' ' 98' ' ' GLN . . . -21.11 96.08 0.01 OUTLIER Glycine 0 C--O 1.21 -1.346 2 O-C-N 134.041 7.088 . . . . 0.0 115.351 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.49 ' HE1' ' NE2' ' A' ' 109' ' ' GLN 0.315 0.0 OUTLIER -114.38 129.77 56.66 Favored 'General case' 0 C--O 1.196 -1.727 1 O-C-N 132.259 5.329 . . . . 0.0 110.389 179.762 . . . . . . . . 5 4 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.9 ptpt -158.03 168.02 28.27 Favored 'General case' 0 C--N 1.354 0.774 1 O-C-N 130.681 4.988 . . . . 0.0 117.91 -178.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.49 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 2.3 mp0 -125.26 172.68 9.36 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 115.2 -2.333 . . . . 0.0 110.799 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.487 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER 175.41 71.12 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.977 1 O-C-N 130.222 4.702 . . . . 0.0 117.948 -179.586 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 44.9 t -18.45 116.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.484 -1.583 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -127.18 68.99 1.28 Allowed 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.81 100.61 0.06 OUTLIER Glycine 0 C--O 1.207 -1.537 0 CA-C-O 118.129 -1.373 . . . . 0.0 115.647 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 39.58 41.77 0.81 Allowed 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 10.3 pttm 177.2 170.06 0.56 Allowed 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 128.978 3.924 . . . . 0.0 107.769 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.511 HD22 ' CE2' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -148.85 121.1 8.37 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 115.362 -2.535 . . . . 0.0 113.038 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.487 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 8.9 m-85 -67.15 154.84 40.26 Favored 'General case' 0 C--N 1.362 1.138 0 CA-C-N 111.374 -2.648 . . . . 0.0 112.895 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.467 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -130.21 39.88 3.6 Favored 'General case' 0 N--CA 1.476 0.833 2 O-C-N 131.418 5.449 . . . . 0.0 106.501 179.632 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 120' ' ' LEU . 0.1 OUTLIER -51.9 122.17 7.89 Favored 'General case' 0 CA--C 1.508 -0.651 0 O-C-N 128.853 3.846 . . . . 0.0 110.889 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.482 ' HB2' ' CB ' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -141.15 168.37 19.94 Favored 'General case' 0 CA--C 1.486 -1.51 1 O-C-N 130.33 4.769 . . . . 0.0 109.579 -179.811 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.1 t -135.16 175.73 9.32 Favored 'General case' 0 C--O 1.198 -1.621 0 O-C-N 127.112 2.758 . . . . 0.0 105.224 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.6 p 174.2 84.87 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.52 0 O-C-N 124.925 1.391 . . . . 0.0 111.115 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 71.91 39.64 58.89 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-O 123.749 1.749 . . . . 0.0 111.223 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.14 37.05 6.83 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 109.53 -3.335 . . . . 0.0 112.482 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -96.3 -13.3 23.43 Favored 'General case' 0 C--O 1.199 -1.586 0 O-C-N 127.125 2.765 . . . . 0.0 107.851 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 35.6 m 27.57 60.55 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 C-N-CA 127.505 2.322 . . . . 0.0 115.144 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.0 t -55.02 112.09 0.98 Allowed 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 125.344 1.458 . . . . 0.0 111.793 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 53.4 ttm-85 -105.76 100.88 10.43 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -85.01 173.78 10.26 Favored 'General case' 0 CA--C 1.489 -1.389 0 CA-C-N 112.962 -1.926 . . . . 0.0 113.545 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.449 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 2.2 m -135.88 157.12 38.34 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.467 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 63.6 m-85 -140.96 175.83 9.3 Favored 'General case' 0 CA--C 1.493 -1.215 0 O-C-N 128.196 3.435 . . . . 0.0 115.718 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.293 0.0 OUTLIER -163.96 119.81 1.62 Allowed 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 110.731 -2.941 . . . . 0.0 103.606 179.834 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.509 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 9.2 tttt -53.09 126.17 19.79 Favored 'General case' 0 C--O 1.198 -1.614 0 O-C-N 127.176 2.798 . . . . 0.0 110.72 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.124 0 O-C-N 125.712 1.882 . . . . 0.0 115.972 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.9 -151.16 0.34 Allowed 'General case' 0 C--O 1.206 -1.233 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.5 84.06 0.41 Allowed 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -101.31 81.31 2.19 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -101.11 -83.45 0.45 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 113.725 -3.036 . . . . 0.0 108.127 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.9 113.02 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.733 1 O-C-N 129.191 4.057 . . . . 0.0 114.451 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.56 -130.72 1.84 Allowed Glycine 0 C--O 1.207 -1.569 0 O-C-N 126.52 2.388 . . . . 0.0 112.472 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.424 HG21 HG21 ' A' ' 40' ' ' THR . 1.2 m -174.57 144.01 0.84 Allowed 'General case' 0 C--N 1.314 -0.954 1 O-C-N 130.661 4.389 . . . . 0.0 106.398 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.59 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.2 134.8 22.15 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 111.967 -2.379 . . . . 0.0 114.621 -179.539 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -69.54 -14.81 63.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.471 ' HE1' ' CG ' ' A' ' 39' ' ' GLN . 5.2 ttp 55.2 57.74 5.26 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -17.88 -49.6 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.883 0 O-C-N 128.514 3.634 . . . . 0.0 111.903 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.3 165.39 28.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 110.273 -3.148 . . . . 0.0 111.406 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.24 129.91 11.56 Favored 'General case' 0 CA--C 1.482 -1.651 0 CA-C-N 110.42 -3.082 . . . . 0.0 111.466 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' A' ' 17' ' ' PHE . 7.0 mm-40 -88.46 -174.59 4.65 Favored 'General case' 0 CA--C 1.496 -1.125 1 O-C-N 129.471 4.232 . . . . 0.0 112.119 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 33.24 -81.76 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.55 0 C-N-CA 125.855 1.662 . . . . 0.0 113.763 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.424 ' N ' ' O ' ' A' ' 15' ' ' GLU . 1.4 t80 73.81 -59.39 0.56 Allowed 'General case' 0 C--O 1.203 -1.364 0 O-C-N 126.203 2.189 . . . . 0.0 113.165 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.451 ' CG ' ' HG2' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -76.4 -48.86 18.35 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.536 -1.665 . . . . 0.0 115.241 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.479 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.47 -19.92 28.36 Favored Glycine 0 CA--C 1.494 -1.222 0 CA-C-O 116.934 -2.037 . . . . 0.0 112.893 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -36.89 38.96 Favored 'General case' 0 C--O 1.21 -0.983 0 O-C-N 128.13 2.9 . . . . 0.0 106.387 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -25.57 57.56 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 111.048 -2.796 . . . . 0.0 107.554 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.479 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -79.92 -28.76 39.74 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 129.065 2.946 . . . . 0.0 114.238 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.53 -28.67 66.21 Favored 'General case' 0 N--CA 1.477 0.912 2 O-C-N 130.818 5.074 . . . . 0.0 113.344 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.486 ' CD1' ' HB ' ' A' ' 26' ' ' ILE . 4.1 pp -103.04 -4.39 24.66 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 127.946 3.279 . . . . 0.0 108.999 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 54.25 82.59 0.09 Allowed 'General case' 0 CA--C 1.484 -1.571 0 C-N-CA 131.027 3.731 . . . . 0.0 114.519 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.486 ' HB ' ' CD1' ' A' ' 24' ' ' LEU . 16.2 tt -111.65 42.76 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-N 111.501 -2.591 . . . . 0.0 106.883 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.531 ' O ' ' CG ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -47.21 151.53 0.69 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 114.247 -2.787 . . . . 0.0 108.957 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.531 ' CG ' ' O ' ' A' ' 27' ' ' ASP . 4.8 m-30 147.12 -27.68 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.783 1 O-C-N 131.276 5.36 . . . . 0.0 111.28 179.169 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 90.52 73.32 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.542 0 O-C-N 127.049 2.718 . . . . 0.0 108.125 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -26.43 27.76 Favored 'General case' 0 C--O 1.212 -0.899 1 CA-C-N 105.708 -5.224 . . . . 0.0 111.816 179.761 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.451 ' HG2' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -89.93 -171.24 3.08 Favored 'General case' 0 C--N 1.319 -0.739 1 O-C-N 129.283 4.114 . . . . 0.0 110.874 -179.925 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 96.64 -37.64 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.415 1 O-C-N 130.905 5.128 . . . . 0.0 112.848 -179.663 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.06 34.16 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 128.514 3.634 . . . . 0.0 108.675 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -129.57 20.9 5.59 Favored 'General case' 0 C--O 1.206 -1.185 1 CA-C-O 128.63 4.062 . . . . 0.0 111.373 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.27 -40.75 57.57 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-N 108.542 -3.936 . . . . 0.0 110.038 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.47 99.0 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.858 0 CA-C-N 110.562 -3.017 . . . . 0.0 115.717 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.561 ' HG ' ' CD2' ' A' ' 58' ' ' PHE . 1.4 pp -100.08 -1.26 37.3 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 105.41 -2.071 . . . . 0.0 105.41 178.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.425 ' N ' HD13 ' A' ' 37' ' ' LEU . 2.9 m 142.72 128.38 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.161 1 O-C-N 131.098 5.249 . . . . 0.0 110.393 -178.71 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.471 ' CG ' ' HE1' ' A' ' 11' ' ' MET . 0.6 OUTLIER -130.81 140.95 50.31 Favored 'General case' 0 CA--C 1.494 -1.178 0 O-C-N 126.3 2.25 . . . . 0.0 113.321 -179.359 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.431 HG23 ' CD1' ' A' ' 42' ' ' ILE . 38.9 m -156.03 104.13 2.26 Favored 'General case' 0 C--O 1.21 -1.02 0 O-C-N 128.62 3.7 . . . . 0.0 114.371 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.461 ' HE3' ' CD1' ' A' ' 118' ' ' LEU . 0.0 OUTLIER -96.68 118.96 34.27 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.456 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 3.8 mp -105.92 155.79 6.83 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 1 O-C-N 129.289 4.118 . . . . 0.0 111.1 179.587 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.456 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.307 2.4 tt -132.05 141.18 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.41 0 O-C-N 127.555 3.035 . . . . 0.0 106.486 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.7 t -141.08 85.12 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.752 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.53 131.51 37.6 Favored 'General case' 0 CA--C 1.494 -1.182 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.439 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -140.78 -6.87 1.11 Allowed 'General case' 0 CA--C 1.483 -1.626 0 O-C-N 127.777 3.173 . . . . 0.0 118.06 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 115.21 102.88 2.42 Favored Glycine 0 N--CA 1.474 1.209 0 CA-C-N 120.752 1.615 . . . . 0.0 111.177 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 56.42 26.46 10.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 126.314 1.832 . . . . 0.0 112.102 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -173.5 85.57 0.05 Allowed 'General case' 0 C--O 1.22 -0.475 0 O-C-N 128.235 3.459 . . . . 0.0 112.704 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.477 ' CD1' HD23 ' A' ' 94' ' ' LEU . 35.9 t80 -108.36 119.18 38.75 Favored 'General case' 0 CA--C 1.502 -0.899 0 O-C-N 127.623 3.077 . . . . 0.0 113.99 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -128.15 100.72 5.97 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.476 ' O ' ' N ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -78.21 124.1 27.68 Favored 'General case' 0 C--O 1.217 -0.638 0 O-C-N 129.019 3.95 . . . . 0.0 106.203 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.35 138.22 47.68 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 126.519 2.387 . . . . 0.0 111.232 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.432 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 4.7 t -100.1 143.74 29.95 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 125.936 2.023 . . . . 0.0 110.11 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -118.16 37.54 3.97 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 112.148 -2.296 . . . . 0.0 115.626 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.438 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 63.3 m -96.51 106.79 19.1 Favored 'General case' 0 N--CA 1.476 0.864 1 O-C-N 131.643 5.589 . . . . 0.0 106.318 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.5 m -43.69 -48.42 7.88 Favored 'General case' 0 CA--C 1.501 -0.919 0 O-C-N 127.942 3.277 . . . . 0.0 110.761 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.561 ' CD2' ' HG ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -50.89 -37.2 42.21 Favored 'General case' 0 C--N 1.365 1.245 0 O-C-N 126.421 2.325 . . . . 0.0 111.692 -179.714 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -169.31 124.84 0.87 Allowed 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 129.926 4.516 . . . . 0.0 117.941 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.432 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 3.9 m-80 -115.56 79.07 1.24 Allowed 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 111.231 -2.713 . . . . 0.0 108.86 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -62.01 -47.31 85.34 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 126.934 2.646 . . . . 0.0 106.69 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 52.83 123.2 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 130.098 4.624 . . . . 0.0 117.154 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.49 ' CD2' ' CZ2' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -86.06 95.04 9.4 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 127.173 2.796 . . . . 0.0 109.256 178.841 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -131.39 92.38 3.17 Favored 'General case' 0 C--O 1.208 -1.105 0 C-N-CA 116.409 -2.116 . . . . 0.0 109.597 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.489 ' CE2' ' HB ' ' A' ' 87' ' ' VAL . 0.1 OUTLIER -143.37 -141.78 0.13 Allowed 'General case' 0 CA--C 1.484 -1.582 0 CA-C-N 112.566 -2.106 . . . . 0.0 111.114 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.26 0.8 OUTLIER -158.83 159.79 35.48 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 179.819 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.456 HG12 ' CD1' ' A' ' 89' ' ' TRP . 15.4 t -77.42 144.73 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 O-C-N 125.03 1.457 . . . . 0.0 111.732 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 75.21 1.48 64.12 Favored Glycine 0 CA--C 1.491 -1.434 0 CA-C-N 109.916 -3.311 . . . . 0.0 116.397 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.305 1.4 t -67.54 -45.77 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 CA-C-N 112.374 -1.913 . . . . 0.0 107.527 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 72.9 92.3 0.08 Allowed 'General case' 0 C--N 1.353 0.72 0 CA-C-N 109.613 -3.449 . . . . 0.0 109.898 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.404 ' O ' ' N ' ' A' ' 73' ' ' GLU . 1.5 m-30 -71.55 82.82 0.83 Allowed 'General case' 0 C--N 1.356 0.879 0 O-C-N 128.085 3.366 . . . . 0.0 111.013 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 12.7 p30 -56.22 79.29 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 113.707 -1.588 . . . . 0.0 111.736 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.453 ' HB3' ' CA ' ' A' ' 82' ' ' ASN . 1.4 mt-10 56.38 89.71 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 123.182 1.468 . . . . 0.0 109.936 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.4 ' CD2' ' CE2' ' A' ' 71' ' ' PHE . 1.3 t60 -163.68 98.44 0.88 Allowed 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 111.69 -2.505 . . . . 0.0 115.107 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.42 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -127.81 -60.61 1.15 Allowed 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.33 -1.305 . . . . 0.0 111.139 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.42 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.1 OUTLIER 49.27 -178.86 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 128.428 3.966 . . . . 0.0 116.248 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.55 -84.7 0.27 Allowed Glycine 0 C--O 1.211 -1.326 0 CA-C-N 108.833 -3.803 . . . . 0.0 112.747 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.477 HD13 ' CD1' ' A' ' 26' ' ' ILE . 5.4 tp -57.72 -60.98 2.87 Favored 'General case' 0 N--CA 1.451 -0.376 1 CA-C-N 107.481 -4.359 . . . . 0.0 114.285 179.874 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.474 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 8.1 t0 -115.09 -54.79 2.53 Favored 'General case' 0 CA--C 1.494 -1.187 0 O-C-N 126.928 2.642 . . . . 0.0 110.594 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 68.64 89.25 0.07 OUTLIER Glycine 0 N--CA 1.473 1.129 0 CA-C-N 112.133 -2.303 . . . . 0.0 111.651 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.9 tpp85 -129.4 -131.65 0.21 Allowed 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 111.743 -2.228 . . . . 0.0 112.139 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.453 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 6.9 p-10 -164.09 81.05 0.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 117.997 -1.481 . . . . 0.0 107.729 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.425 HG13 ' N ' ' A' ' 99' ' ' LYS . 0.1 OUTLIER -126.31 133.41 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.505 0 N-CA-C 118.754 2.872 . . . . 0.0 118.754 -179.36 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 90.36 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.705 0 O-C-N 128.595 3.684 . . . . 0.0 107.421 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 83' ' ' VAL . 94.6 m -86.73 58.14 4.89 Favored 'General case' 0 C--O 1.201 -1.49 0 CA-C-N 109.648 -3.433 . . . . 0.0 113.818 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.4 tt -62.82 144.6 56.41 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 109.141 -3.663 . . . . 0.0 112.81 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.489 ' HB ' ' CE2' ' A' ' 65' ' ' PHE . 2.0 p -130.7 132.76 64.08 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 CA-C-N 110.812 -2.904 . . . . 0.0 109.466 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.256 90.1 m -153.82 169.63 22.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 111.477 -2.601 . . . . 0.0 110.716 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.66 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 23.8 m95 -98.38 138.96 34.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 C-N-CA 128.55 2.74 . . . . 0.0 106.22 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.445 ' CB ' HG21 ' A' ' 93' ' ' THR . 1.6 tt0 -95.96 -47.08 6.27 Favored 'General case' 0 CA--C 1.479 -1.773 1 CA-C-O 128.776 4.131 . . . . 0.0 116.292 -179.55 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -176.43 -51.65 0.06 OUTLIER Glycine 0 C--O 1.197 -2.196 0 CA-C-N 109.302 -3.59 . . . . 0.0 106.333 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.01 31.49 1.78 Allowed 'General case' 0 C--O 1.209 -1.036 1 O-C-N 131.945 5.144 . . . . 0.0 111.176 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.445 HG21 ' CB ' ' A' ' 90' ' ' GLU . 0.8 OUTLIER -167.83 165.46 13.97 Favored 'General case' 0 C--O 1.202 -1.425 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.477 HD23 ' CD1' ' A' ' 50' ' ' PHE . 2.1 tp -95.12 86.17 4.52 Favored 'General case' 0 C--O 1.204 -1.314 0 CA-C-N 111.138 -2.756 . . . . 0.0 117.477 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.344 2.5 t -82.25 125.82 39.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.737 0 CA-C-N 109.653 -3.43 . . . . 0.0 111.976 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.434 ' HB2' ' CZ3' ' A' ' 107' ' ' TRP . 14.3 m -132.49 129.13 38.77 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 125.727 2.679 . . . . 0.0 105.24 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -114.19 77.57 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.58 0 CA-C-N 110.754 -2.93 . . . . 0.0 118.902 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -60.62 111.44 1.61 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 119.682 -1.886 . . . . 0.0 108.088 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.425 ' N ' HG13 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.27 143.5 35.96 Favored 'General case' 0 C--O 1.195 -1.813 0 C-N-CA 113.744 -3.182 . . . . 0.0 113.306 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 146.39 137.87 3.1 Favored Glycine 0 C--O 1.213 -1.159 0 C-N-CA 119.259 -1.448 . . . . 0.0 111.032 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 66.88 -59.92 0.36 Allowed 'General case' 0 C--N 1.353 0.753 0 CA-C-N 110.206 -2.997 . . . . 0.0 112.179 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.19 -31.81 0.05 Allowed 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.29 146.69 54.31 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 125.879 2.752 . . . . 0.0 117.311 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.404 ' O ' ' N ' ' A' ' 122' ' ' CYS . 11.6 m-20 -127.25 78.97 1.85 Allowed 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.224 -4.989 . . . . 0.0 101.683 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -98.42 3.11 48.39 Favored 'General case' 0 C--O 1.199 -1.602 1 O-C-N 131.078 5.237 . . . . 0.0 112.664 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -33.56 85.66 0.01 OUTLIER Glycine 0 N--CA 1.428 -1.884 2 O-C-N 133.004 6.44 . . . . 0.0 114.929 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.49 ' CZ2' ' CD2' ' A' ' 63' ' ' LEU 0.273 0.0 OUTLIER -97.42 129.56 44.63 Favored 'General case' 0 C--O 1.197 -1.669 0 O-C-N 129.934 3.961 . . . . 0.0 109.807 179.308 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.405 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.2 OUTLIER -155.03 156.67 36.33 Favored 'General case' 0 C--O 1.211 -0.942 0 O-C-N 129.011 3.944 . . . . 0.0 115.951 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.431 ' NE2' ' CD1' ' A' ' 107' ' ' TRP 0.299 39.2 mm-40 -114.05 165.97 12.09 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 111.201 -2.727 . . . . 0.0 110.927 -177.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.423 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.8 OUTLIER -175.76 95.71 0.06 Allowed 'General case' 0 C--O 1.213 -0.858 1 O-C-N 129.986 4.553 . . . . 0.0 116.009 177.955 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.3 t -38.85 98.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.91 0 CA-C-O 127.036 3.303 . . . . 0.0 112.277 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -104.2 56.19 0.72 Allowed 'General case' 0 CA--C 1.488 -1.408 0 CA-C-N 109.361 -3.563 . . . . 0.0 117.235 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 105.17 -111.61 3.79 Favored Glycine 0 C--O 1.205 -1.712 0 CA-C-N 113.593 -1.639 . . . . 0.0 113.09 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -112.74 19.36 17.49 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 117.413 2.375 . . . . 0.0 117.413 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.464 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 4.5 pttt -158.91 163.43 36.56 Favored 'General case' 0 N--CA 1.476 0.825 2 O-C-N 131.189 5.306 . . . . 0.0 109.807 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.8 mt -105.39 173.13 6.44 Favored 'General case' 0 CA--C 1.494 -1.206 0 O-C-N 127.104 2.753 . . . . 0.0 112.503 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -133.9 93.73 3.15 Favored 'General case' 0 C--O 1.206 -1.206 0 O-C-N 127.95 3.281 . . . . 0.0 113.803 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.533 HD12 ' CZ ' ' A' ' 131' ' ' PHE . 2.3 mp -79.6 70.93 6.17 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 111.467 -2.606 . . . . 0.0 106.479 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.423 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 17.0 mt-10 -85.6 108.14 17.84 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 127.387 2.929 . . . . 0.0 109.075 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.459 ' CD2' ' HB3' ' A' ' 127' ' ' CYS . 0.6 OUTLIER -126.28 177.78 6.22 Favored 'General case' 0 N--CA 1.484 1.275 1 O-C-N 130.091 4.619 . . . . 0.0 113.013 179.83 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.1 m -125.76 170.55 11.46 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 110.593 -3.003 . . . . 0.0 105.364 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER -169.37 38.37 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 123.888 1.804 . . . . 0.0 111.592 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 117.18 -67.3 0.32 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 112.735 -2.03 . . . . 0.0 108.257 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -173.8 43.34 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.005 0 CA-C-N 109.661 -3.269 . . . . 0.0 109.932 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -120.86 4.89 10.49 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 111.669 -2.514 . . . . 0.0 110.006 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 8.0 p 6.67 71.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 O-C-N 128.433 3.583 . . . . 0.0 114.925 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.459 ' HB3' ' CD2' ' A' ' 120' ' ' LEU . 0.5 OUTLIER -66.11 142.82 57.64 Favored 'General case' 0 C--O 1.219 -0.538 0 O-C-N 120.441 -1.412 . . . . 0.0 111.142 -179.532 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.61 147.54 48.68 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 128.432 3.583 . . . . 0.0 110.949 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -122.7 171.06 9.43 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 118.312 -1.355 . . . . 0.0 112.654 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.15 138.3 30.15 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.422 0 N-CA-C 103.543 -2.762 . . . . 0.0 103.543 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.533 ' CZ ' HD12 ' A' ' 118' ' ' LEU . 45.5 m-85 -126.31 179.97 5.03 Favored 'General case' 0 CA--C 1.488 -1.426 0 CA-C-O 128.149 3.833 . . . . 0.0 117.965 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER -161.89 113.35 1.68 Allowed 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 111.196 -2.729 . . . . 0.0 103.773 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.59 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 33.3 ttpt -58.07 89.77 0.01 OUTLIER 'General case' 0 C--O 1.194 -1.867 0 O-C-N 126.654 2.471 . . . . 0.0 115.299 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt . . . . . 0 C--O 1.26 1.616 0 O-C-N 127.866 3.229 . . . . 0.0 117.906 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.507 2.415 0 CA-C-O 123.052 1.406 . . . . 0.0 109.886 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.4 m -146.4 -54.47 0.26 Allowed 'General case' 0 C--O 1.21 -1.013 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.494 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -140.04 -175.5 4.26 Favored 'General case' 0 CA--C 1.491 -1.326 0 C-N-CA 116.268 -2.173 . . . . 0.0 113.096 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -72.02 -151.86 0.02 OUTLIER 'General case' 0 C--O 1.24 0.562 0 N-CA-C 104.531 -2.396 . . . . 0.0 104.531 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -171.14 135.89 1.03 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 103.28 -2.859 . . . . 0.0 103.28 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -51.43 124.76 12.71 Favored 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 131.456 5.472 . . . . 0.0 113.345 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.11 -173.95 43.97 Favored Glycine 0 C--O 1.206 -1.647 0 CA-C-O 116.426 -2.319 . . . . 0.0 113.895 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.2 m -127.18 124.37 38.86 Favored 'General case' 0 C--O 1.209 -1.036 1 O-C-N 132.911 5.712 . . . . 0.0 104.937 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.509 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -118.0 90.35 3.31 Favored 'General case' 0 CA--C 1.493 -1.249 1 O-C-N 129.224 4.077 . . . . 0.0 114.467 179.882 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.57 100.19 0.05 OUTLIER 'General case' 0 C--O 1.218 -0.579 0 O-C-N 126.901 2.626 . . . . 0.0 108.039 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.42 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -33.37 -58.04 0.4 Allowed 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.04 3.337 . . . . 0.0 107.335 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 90.37 -28.21 0.04 OUTLIER 'General case' 0 C--O 1.199 -1.603 1 O-C-N 131.818 5.699 . . . . 0.0 111.006 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.256 3.3 p -175.7 177.25 1.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 124.513 2.102 . . . . 0.0 110.882 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -146.08 168.86 19.9 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 108.828 -3.805 . . . . 0.0 111.458 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -102.18 -107.09 0.25 Allowed 'General case' 0 CA--C 1.477 -1.841 2 O-C-N 133.237 6.586 . . . . 0.0 111.828 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -84.77 87.03 7.28 Favored 'General case' 0 C--O 1.21 -1.013 0 O-C-N 118.783 -2.448 . . . . 0.0 110.464 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.44 -52.23 65.45 Favored 'General case' 0 C--O 1.207 -1.176 0 CA-C-O 127.584 3.564 . . . . 0.0 112.62 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.48 ' CG ' ' HG3' ' A' ' 31' ' ' ARG . 1.1 mp0 -62.06 -51.79 66.54 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 112.297 -2.229 . . . . 0.0 116.379 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.481 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.07 -21.65 11.23 Favored Glycine 0 CA--C 1.484 -1.86 1 O-C-N 129.563 4.289 . . . . 0.0 113.651 -179.931 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.456 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -73.81 -45.7 49.81 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 126.237 2.922 . . . . 0.0 105.654 179.615 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.6 mtm -71.73 -25.38 62.04 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 112.543 -2.117 . . . . 0.0 112.066 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.481 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 1.0 OUTLIER -79.73 -33.92 40.42 Favored 'General case' 0 C--O 1.215 -0.753 0 O-C-N 128.024 3.327 . . . . 0.0 114.989 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.97 78.0 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 109.462 -3.517 . . . . 0.0 113.675 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.423 ' CD1' ' HA ' ' A' ' 79' ' ' ASP . 1.1 pp -84.19 -7.15 59.44 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 128.304 3.502 . . . . 0.0 108.093 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 46.35 93.67 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.59 0 CA-C-O 127.269 3.414 . . . . 0.0 111.105 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.4 HD13 ' HA ' ' A' ' 78' ' ' LEU . 19.7 tt -111.07 28.45 2.07 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 1 CA-C-O 129.093 4.282 . . . . 0.0 108.869 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.443 ' C ' ' CD1' ' A' ' 28' ' ' PHE . 30.5 m-20 77.03 53.35 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 CA-C-N 108.637 -3.892 . . . . 0.0 110.427 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.605 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER 12.15 69.97 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.104 1 O-C-N 130.319 4.762 . . . . 0.0 117.374 179.036 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.87 -175.01 2.91 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 112.591 -2.095 . . . . 0.0 106.677 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.2 m 93.57 -20.51 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 2 O-C-N 132.95 6.406 . . . . 0.0 114.707 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' HG3' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -77.53 -171.4 2.14 Favored 'General case' 0 N--CA 1.44 -0.936 1 O-C-N 130.83 5.081 . . . . 0.0 110.839 179.737 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.501 ' C ' ' CG1' ' A' ' 33' ' ' ILE . 0.3 OUTLIER 75.75 21.26 1.69 Allowed 'General case' 0 CA--C 1.498 -1.034 0 O-C-N 128.749 3.78 . . . . 0.0 113.643 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.501 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -170.12 -40.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 O-C-N 128.917 3.886 . . . . 0.0 113.268 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.526 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -72.77 -12.91 61.19 Favored 'General case' 0 C--O 1.209 -1.048 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.56 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -15.03 -48.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 O-C-N 128.789 3.806 . . . . 0.0 114.659 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.428 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 14.7 tpt180 -177.79 144.56 0.37 Allowed 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 127.321 2.888 . . . . 0.0 115.219 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.551 ' HG ' ' CD2' ' A' ' 58' ' ' PHE . 1.1 pp -175.52 147.96 0.88 Allowed 'General case' 0 CA--C 1.539 0.532 2 O-C-N 130.675 4.984 . . . . 0.0 109.005 178.73 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 m 1.97 58.42 0.0 OUTLIER 'General case' 0 CA--C 1.482 -1.653 1 O-C-N 133.467 6.729 . . . . 0.0 112.982 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.429 ' HG3' ' N ' ' A' ' 40' ' ' THR . 1.4 tp60 -74.19 137.94 43.44 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.429 ' N ' ' HG3' ' A' ' 39' ' ' GLN . 2.9 m -150.6 124.28 9.13 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 109.524 -3.489 . . . . 0.0 114.782 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.432 ' HD2' ' HB2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -109.99 156.85 19.95 Favored 'General case' 0 N--CA 1.49 1.553 1 O-C-N 129.55 4.281 . . . . 0.0 101.938 179.044 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.487 ' N ' ' O ' ' A' ' 53' ' ' LYS . 66.3 mt -149.18 157.71 6.68 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 O-C-N 126.717 2.511 . . . . 0.0 112.198 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.442 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 0.2 OUTLIER -142.02 135.79 29.24 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 109.014 -3.721 . . . . 0.0 105.981 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.1 t -119.35 -32.62 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.194 0 CA-C-N 112.032 -2.349 . . . . 0.0 116.449 -178.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.416 ' HG2' HD12 ' A' ' 43' ' ' ILE . 0.5 OUTLIER 23.45 72.09 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -18.75 64.89 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 108.705 -3.861 . . . . 0.0 110.744 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.96 -95.92 0.16 Allowed Glycine 0 C--O 1.2 -2.016 0 CA-C-N 113.637 -1.619 . . . . 0.0 114.23 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -82.05 -27.44 32.99 Favored 'General case' 0 C--O 1.22 -0.497 0 O-C-N 125.874 1.573 . . . . 0.0 111.124 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.7 99.22 11.09 Favored 'General case' 0 CA--C 1.54 0.591 1 O-C-N 129.601 4.313 . . . . 0.0 108.462 179.32 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.448 ' CD2' ' CD1' ' A' ' 94' ' ' LEU . 90.5 t80 -100.38 104.16 15.58 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 128.447 3.592 . . . . 0.0 114.526 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 36.9 mttm -125.72 83.03 2.12 Favored 'General case' 0 CA--C 1.496 -1.115 1 O-C-N 129.181 4.051 . . . . 0.0 119.097 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.493 ' CB ' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.09 151.85 46.4 Favored 'General case' 0 C--N 1.362 1.146 1 O-C-N 129.281 4.113 . . . . 0.0 106.373 179.664 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -144.84 165.44 28.12 Favored 'General case' 0 CA--C 1.49 -1.342 0 C-N-CA 115.328 -2.549 . . . . 0.0 111.901 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -129.8 137.05 50.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 125.234 2.445 . . . . 0.0 108.171 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -119.7 51.15 1.19 Allowed 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 110.799 -2.91 . . . . 0.0 115.725 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.45 115.05 27.69 Favored 'General case' 0 N--CA 1.483 1.192 1 O-C-N 133.832 6.957 . . . . 0.0 105.178 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.3 p -45.11 -44.36 10.46 Favored 'General case' 0 CA--C 1.511 -0.541 1 O-C-N 129.361 4.163 . . . . 0.0 110.296 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.551 ' CD2' ' HG ' ' A' ' 37' ' ' LEU . 6.3 m-85 -48.75 -71.57 0.06 Allowed 'General case' 0 C--N 1.366 1.311 0 O-C-N 128.433 3.583 . . . . 0.0 110.499 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.2 mmt180 -128.44 133.29 48.51 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-N 108.876 -3.784 . . . . 0.0 113.257 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -136.39 83.53 2.01 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 126.821 2.576 . . . . 0.0 107.32 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -99.37 -37.37 9.26 Favored 'General case' 0 C--N 1.32 -0.677 0 O-C-N 127.952 3.283 . . . . 0.0 108.672 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.63 152.01 0.06 Allowed 'General case' 0 C--O 1.199 -1.556 0 O-C-N 128.527 3.642 . . . . 0.0 116.684 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.531 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 7.3 tp -99.33 73.88 1.9 Allowed 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 112.577 -2.101 . . . . 0.0 110.908 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.86 100.26 9.49 Favored 'General case' 0 CA--C 1.487 -1.449 0 O-C-N 126.998 2.686 . . . . 0.0 113.148 -179.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.531 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 21.0 m-85 -127.01 -175.23 3.36 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 126.093 2.854 . . . . 0.0 106.994 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -134.75 115.24 13.51 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.351 -3.203 . . . . 0.0 102.351 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 p -46.72 123.84 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.483 -1.616 0 O-C-N 126.954 2.659 . . . . 0.0 116.083 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 60.8 53.8 42.24 Favored Glycine 0 CA--C 1.487 -1.683 0 O-C-N 127.324 2.89 . . . . 0.0 117.923 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.277 1.8 p -122.26 10.25 5.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.354 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 52.44 72.9 0.37 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.377 5.423 . . . . 0.0 108.308 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.413 ' O ' ' N ' ' A' ' 73' ' ' GLU . 7.7 t80 -63.71 82.16 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.066 0 CA-C-N 108.582 -3.917 . . . . 0.0 118.325 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -65.13 84.94 0.05 Allowed 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 123.436 1.588 . . . . 0.0 109.417 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 71' ' ' PHE . 32.3 tt0 -71.14 148.91 46.92 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-O 124.819 2.247 . . . . 0.0 108.168 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.9 m80 -140.6 59.39 1.55 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-N 110.257 -3.156 . . . . 0.0 109.852 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.42 ' OG1' ' N ' ' A' ' 81' ' ' ARG . 27.9 p -35.22 146.65 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 110.391 -3.095 . . . . 0.0 114.73 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.81 144.04 0.07 Allowed 'General case' 0 C--O 1.212 -0.911 0 O-C-N 128.994 3.934 . . . . 0.0 111.396 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.91 2.48 64.66 Favored Glycine 0 C--O 1.205 -1.675 0 CA-C-N 111.55 -2.568 . . . . 0.0 107.43 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.4 ' HA ' HD13 ' A' ' 26' ' ' ILE . 8.1 tp -147.99 -57.86 0.24 Allowed 'General case' 0 CA--C 1.506 -0.72 1 O-C-N 131.185 4.697 . . . . 0.0 117.266 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.423 ' HA ' ' CD1' ' A' ' 24' ' ' LEU . 60.3 t0 -111.13 -62.59 1.52 Allowed 'General case' 0 CA--C 1.502 -0.875 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.06 64.79 1.29 Allowed Glycine 0 N--CA 1.476 1.365 0 CA-C-O 126.171 3.095 . . . . 0.0 109.808 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.42 ' N ' ' OG1' ' A' ' 75' ' ' THR . 5.4 tpt180 -145.75 -131.63 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 109.166 -3.517 . . . . 0.0 112.635 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -164.15 -100.78 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 115.114 -2.374 . . . . 0.0 108.294 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.416 HG11 ' N ' ' A' ' 84' ' ' LYS . 21.2 t 91.82 146.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 O-C-N 128.544 3.653 . . . . 0.0 117.027 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.416 ' N ' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -90.86 87.31 6.6 Favored 'General case' 0 C--O 1.219 -0.522 2 O-C-N 129.398 4.186 . . . . 0.0 107.289 179.508 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 61.7 m -96.41 86.15 4.1 Favored 'General case' 0 C--O 1.202 -1.404 0 O-C-N 128.229 3.456 . . . . 0.0 112.091 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 tp -87.24 94.69 9.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 108.595 -3.911 . . . . 0.0 116.259 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.2 t -74.4 141.74 15.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 O-C-N 119.586 -1.946 . . . . 0.0 108.763 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.407 ' CG2' ' HB ' ' A' ' 95' ' ' VAL . 9.3 t -164.04 172.73 13.44 Favored 'General case' 0 CA--C 1.488 -1.43 0 CA-C-O 126.87 3.224 . . . . 0.0 110.833 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.686 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 49.7 m95 -98.71 136.93 38.05 Favored 'General case' 0 N--CA 1.437 -1.101 0 O-C-N 117.916 -2.99 . . . . 0.0 109.377 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.497 ' CG ' ' CG2' ' A' ' 95' ' ' VAL . 0.3 OUTLIER -93.1 -11.15 33.64 Favored 'General case' 0 CA--C 1.475 -1.94 1 CA-C-O 133.642 6.449 . . . . 0.0 113.966 179.569 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.34 -42.18 1.33 Allowed Glycine 0 C--O 1.198 -2.152 1 CA-C-N 107.588 -4.369 . . . . 0.0 104.594 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -152.85 60.8 0.79 Allowed 'General case' 0 C--O 1.204 -1.312 1 O-C-N 131.594 4.938 . . . . 0.0 110.577 -179.768 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.463 ' CG2' ' HB2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.91 130.5 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.124 0 O-C-N 127.084 2.74 . . . . 0.0 118.048 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.448 ' CD1' ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -74.13 92.32 2.18 Favored 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 130.323 4.765 . . . . 0.0 110.758 179.787 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.497 ' CG2' ' CG ' ' A' ' 90' ' ' GLU 0.284 79.5 t -90.36 140.6 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 1 O-C-N 130.655 4.972 . . . . 0.0 115.248 -179.75 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.501 ' HB3' ' CZ3' ' A' ' 107' ' ' TRP . 4.5 t -143.95 122.71 12.63 Favored 'General case' 0 C--O 1.195 -1.778 0 O-C-N 125.573 1.796 . . . . 0.0 106.328 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.4 t -101.34 105.2 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.862 0 CA-C-N 111.172 -2.74 . . . . 0.0 111.902 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.439 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 5.1 mt-30 -86.29 100.79 12.53 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 123.822 1.772 . . . . 0.0 109.88 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.12 96.75 8.67 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 110.037 -3.256 . . . . 0.0 110.507 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -93.29 -97.67 1.48 Allowed Glycine 0 C--O 1.206 -1.646 0 CA-C-N 112.719 -2.037 . . . . 0.0 110.891 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.64 -53.17 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 108.974 -3.613 . . . . 0.0 109.244 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.447 ' CD ' ' HB3' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -94.02 -39.61 10.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 111.047 -2.797 . . . . 0.0 112.833 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.447 ' HB3' ' CD ' ' A' ' 102' ' ' LYS . 2.0 pt-20 -115.96 146.63 41.94 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 111.163 -2.744 . . . . 0.0 114.899 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -106.07 97.54 7.34 Favored 'General case' 0 N--CA 1.478 0.957 2 O-C-N 130.29 4.743 . . . . 0.0 102.9 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.422 ' HD3' ' HA ' ' A' ' 122' ' ' CYS . 0.1 OUTLIER -101.5 5.46 41.89 Favored 'General case' 0 C--O 1.214 -0.781 1 O-C-N 130.483 4.864 . . . . 0.0 110.065 -179.724 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.439 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -45.75 93.68 0.01 OUTLIER Glycine 0 N--CA 1.426 -2.012 2 O-C-N 132.393 6.058 . . . . 0.0 114.277 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.595 ' HE1' ' NE2' ' A' ' 109' ' ' GLN 0.289 0.0 OUTLIER -108.24 136.32 48.09 Favored 'General case' 0 C--O 1.214 -0.802 1 O-C-N 132.262 5.331 . . . . 0.0 110.304 179.808 . . . . . . . . 5 4 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.39 159.33 43.52 Favored 'General case' 0 CA--C 1.506 -0.728 1 O-C-N 131.121 5.263 . . . . 0.0 113.391 -178.637 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.595 ' NE2' ' HE1' ' A' ' 107' ' ' TRP 0.279 1.0 OUTLIER -134.04 123.53 24.68 Favored 'General case' 0 C--N 1.368 1.371 0 C-N-CA 115.999 -2.28 . . . . 0.0 111.172 -178.393 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.531 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -117.46 171.32 8.07 Favored 'General case' 0 CA--C 1.498 -1.031 0 O-C-N 128.987 3.93 . . . . 0.0 112.163 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.1 t -109.57 98.81 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.905 0 CA-C-O 124.499 2.095 . . . . 0.0 112.443 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -108.14 85.68 2.16 Favored 'General case' 0 CA--C 1.479 -1.766 0 CA-C-O 125.816 2.722 . . . . 0.0 113.317 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 90.25 -109.28 3.63 Favored Glycine 0 C--O 1.2 -2.024 0 CA-C-N 113.027 -1.897 . . . . 0.0 115.439 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -105.93 -7.78 17.99 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 114.572 -2.632 . . . . 0.0 113.829 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.437 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -127.1 174.06 9.2 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 133.132 6.52 . . . . 0.0 110.227 179.954 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -136.43 128.26 29.21 Favored 'General case' 0 C--O 1.202 -1.429 0 O-C-N 124.787 1.305 . . . . 0.0 110.517 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.531 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.1 m-85 -78.57 167.17 21.66 Favored 'General case' 0 C--O 1.202 -1.44 0 O-C-N 128.618 3.699 . . . . 0.0 110.11 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.513 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -140.45 59.54 1.55 Allowed 'General case' 0 CA--C 1.509 -0.624 1 CA-C-N 107.291 -4.504 . . . . 0.0 108.079 -179.845 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.2 109.26 1.48 Allowed 'General case' 0 CA--C 1.506 -0.722 0 O-C-N 127.525 3.016 . . . . 0.0 110.525 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.13 148.98 39.75 Favored 'General case' 0 CA--C 1.487 -1.461 1 O-C-N 130.044 4.59 . . . . 0.0 109.902 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 45.5 m -118.47 162.03 19.02 Favored 'General case' 0 C--O 1.208 -1.113 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.422 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -161.25 33.52 0.14 Allowed 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 124.2 1.952 . . . . 0.0 113.941 179.799 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 104.04 -94.49 1.08 Allowed Glycine 0 CA--C 1.505 -0.531 0 CA-C-N 111.428 -2.624 . . . . 0.0 112.272 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.85 -31.58 45.69 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 112.171 -2.014 . . . . 0.0 111.625 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -103.33 176.87 5.01 Favored 'General case' 0 C--O 1.214 -0.785 1 O-C-N 129.104 4.003 . . . . 0.0 109.332 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.1 m -156.19 87.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 CA-C-N 108.842 -3.799 . . . . 0.0 111.672 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 t -66.49 113.71 4.93 Favored 'General case' 0 CA--C 1.489 -1.392 0 C-N-CA 125.58 1.552 . . . . 0.0 112.765 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.73 93.58 9.31 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 117.612 -1.635 . . . . 0.0 110.858 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -75.82 165.54 24.86 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 117.532 2.419 . . . . 0.0 117.532 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.508 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -132.46 150.11 32.97 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.428 0 CA-C-O 124.373 2.035 . . . . 0.0 109.058 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.513 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 88.7 m-85 -148.89 175.13 11.53 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 110.854 -2.884 . . . . 0.0 116.509 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.437 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -155.78 137.05 13.88 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 111.9 -2.409 . . . . 0.0 104.98 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.467 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 5.7 ttpt -77.74 94.91 4.54 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 118.185 2.661 . . . . 0.0 118.185 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt . . . . . 0 C--O 1.259 1.557 0 CA-C-O 114.895 -2.479 . . . . 0.0 116.852 179.857 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mtt . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.421 ' CG2' ' HB3' ' A' ' 92' ' ' ASN . 1.3 p -110.82 177.92 4.52 Favored 'General case' 0 C--O 1.205 -1.271 0 O-C-N 127.642 3.089 . . . . 0.0 110.784 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 mttt 55.87 76.99 0.25 Allowed 'General case' 0 CA--C 1.492 -1.275 0 O-C-N 126.878 2.611 . . . . 0.0 114.974 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -67.92 -53.36 27.0 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.411 ' HB2' ' HB3' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 69.24 169.67 0.3 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.956 2.66 . . . . 0.0 107.468 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 26.31 120.04 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.43 1 O-C-N 129.361 4.163 . . . . 0.0 117.876 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -169.51 -128.32 1.0 Allowed Glycine 0 CA--C 1.532 1.112 0 CA-C-N 112.267 -2.242 . . . . 0.0 114.2 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.538 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 3.7 t 168.63 147.74 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.948 1 O-C-N 133.323 5.954 . . . . 0.0 106.479 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.538 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -145.72 103.02 3.74 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.496 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' N ' ' A' ' 12' ' ' GLU 0.259 1.8 mt-10 -64.56 92.49 0.09 Allowed 'General case' 0 C--O 1.213 -0.861 0 O-C-N 126.72 2.513 . . . . 0.0 108.52 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.523 ' HG3' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -42.26 96.01 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 1 O-C-N 130.227 4.704 . . . . 0.0 103.81 -179.917 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' GLU . 27.8 tt0 -35.81 -37.45 0.1 Allowed 'General case' 0 C--O 1.21 -1.014 1 O-C-N 130.383 4.802 . . . . 0.0 107.403 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.263 4.6 p 173.55 141.08 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 110.723 -2.944 . . . . 0.0 110.327 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -96.69 130.37 43.93 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 111.746 -2.479 . . . . 0.0 110.913 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -116.77 140.64 49.2 Favored 'General case' 0 CA--C 1.499 -1.01 0 O-C-N 128.047 3.342 . . . . 0.0 110.563 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 49.53 69.7 0.57 Allowed 'General case' 0 C--O 1.205 -1.287 0 CA-C-O 126.146 2.879 . . . . 0.0 109.963 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -95.38 -40.44 9.51 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 111.41 -2.632 . . . . 0.0 107.974 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -74.93 -39.13 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 111.183 -2.735 . . . . 0.0 111.089 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.09 -26.72 73.95 Favored Glycine 0 CA--C 1.487 -1.708 0 O-C-N 127.187 2.805 . . . . 0.0 110.771 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -71.61 -31.69 67.18 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 124.961 2.315 . . . . 0.0 109.054 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 12.0 mtt -75.11 -27.04 59.68 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.874 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -79.91 -31.24 40.15 Favored 'General case' 0 C--N 1.317 -0.814 1 O-C-N 133.475 6.734 . . . . 0.0 114.92 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.82 91.38 Favored 'General case' 0 C--O 1.208 -1.086 2 O-C-N 130.835 5.084 . . . . 0.0 113.621 -179.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.5 pp -103.09 -8.26 20.67 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 110.623 -2.99 . . . . 0.0 109.543 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 49.17 99.18 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.155 1 CA-C-O 128.565 4.031 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.3 tt -124.53 42.67 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 109.556 -3.474 . . . . 0.0 109.537 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 76.45 137.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.441 0 CA-C-N 110.339 -3.118 . . . . 0.0 107.479 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -106.0 -172.64 2.13 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 116.42 2.008 . . . . 0.0 116.42 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 58.03 30.85 19.85 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 124.443 2.068 . . . . 0.0 106.343 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -101.84 -16.05 16.7 Favored 'General case' 0 C--O 1.209 -1.057 1 CA-C-N 107.783 -4.281 . . . . 0.0 115.115 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.434 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -86.57 -172.43 4.02 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 128.893 3.87 . . . . 0.0 109.949 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HG2' HG13 ' A' ' 33' ' ' ILE . 0.2 OUTLIER 82.71 7.84 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 O-C-N 129.05 3.968 . . . . 0.0 113.254 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.437 HG13 ' HG2' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -147.21 -41.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 128.561 3.663 . . . . 0.0 111.0 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -90.5 24.93 2.44 Favored 'General case' 0 C--O 1.209 -1.032 0 CA-C-O 123.637 1.684 . . . . 0.0 113.865 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 66.7 t -55.36 -27.41 20.48 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.399 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.203 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? 140.01 134.1 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.862 2 O-C-N 130.621 4.95 . . . . 0.0 108.975 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.516 ' CD2' ' CG ' ' A' ' 58' ' ' PHE . 0.3 OUTLIER -102.54 15.36 29.46 Favored 'General case' 0 N--CA 1.439 -1.019 2 O-C-N 130.377 4.798 . . . . 0.0 111.184 -179.703 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 173.54 -53.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.316 1 O-C-N 132.125 5.891 . . . . 0.0 111.113 179.64 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.416 ' NE2' ' HB3' ' A' ' 11' ' ' MET . 17.1 tt0 67.94 140.29 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 O-C-N 127.488 2.993 . . . . 0.0 115.439 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.0 m 162.42 109.39 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.82 1 O-C-N 131.189 5.305 . . . . 0.0 113.307 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.433 ' CE ' ' CD2' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -98.52 156.12 16.94 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 127.714 3.134 . . . . 0.0 106.764 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.432 ' HB ' ' HE3' ' A' ' 53' ' ' LYS . 4.4 mp -135.99 162.94 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 O-C-N 128.58 3.675 . . . . 0.0 111.497 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.492 ' CD1' ' HB2' ' A' ' 45' ' ' GLN 0.292 0.2 OUTLIER -134.5 133.25 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.566 1 CA-C-N 107.93 -4.214 . . . . 0.0 108.472 179.771 . . . . . . . . 5 4 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.5 t -107.95 -64.71 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.312 0 CA-C-N 112.226 -2.261 . . . . 0.0 108.985 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.492 ' HB2' ' CD1' ' A' ' 43' ' ' ILE . 0.0 OUTLIER 56.01 91.96 0.03 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.01 -40.52 11.05 Favored 'General case' 0 CA--C 1.49 -1.328 2 O-C-N 131.031 5.207 . . . . 0.0 113.255 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.56 -93.23 0.09 OUTLIER Glycine 0 C--O 1.2 -1.977 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.808 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.51 -19.14 24.15 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 127.516 2.539 . . . . 0.0 110.332 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.43 110.93 23.29 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 129.078 3.986 . . . . 0.0 109.917 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.496 ' CE2' HD22 ' A' ' 63' ' ' LEU . 1.7 t80 -115.84 110.25 18.77 Favored 'General case' 0 CA--C 1.497 -1.061 0 O-C-N 127.53 3.019 . . . . 0.0 111.64 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 79.47 1.44 Allowed 'General case' 0 C--O 1.202 -1.401 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.85 160.75 5.49 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 127.216 2.822 . . . . 0.0 107.507 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.432 ' HE3' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -161.91 148.87 14.02 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 115.226 -2.59 . . . . 0.0 110.301 -179.254 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 t -103.83 136.73 42.95 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-O 124.135 1.922 . . . . 0.0 109.618 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -92.55 6.86 45.67 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 115.908 -1.996 . . . . 0.0 113.038 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.4 m -47.61 102.85 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 O-C-N 131.638 5.587 . . . . 0.0 104.872 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 p -33.13 -43.82 0.11 Allowed 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.479 5.487 . . . . 0.0 109.364 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.516 ' CG ' ' CD2' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -51.37 -68.19 0.19 Allowed 'General case' 0 C--N 1.35 0.62 0 O-C-N 128.755 3.784 . . . . 0.0 111.31 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.12 135.16 30.63 Favored 'General case' 0 CA--C 1.508 -0.641 1 O-C-N 129.283 4.114 . . . . 0.0 111.962 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.57 100.4 7.11 Favored 'General case' 0 C--O 1.2 -1.503 0 O-C-N 128.835 3.835 . . . . 0.0 112.275 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -177.39 113.61 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 1 O-C-N 129.337 4.148 . . . . 0.0 108.186 -179.856 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -77.66 0.46 Allowed 'General case' 0 CA--C 1.495 -1.171 0 O-C-N 126.812 2.57 . . . . 0.0 116.56 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.553 ' CD1' ' CZ2' ' A' ' 107' ' ' TRP . 9.8 tp -112.07 39.91 2.3 Favored 'General case' 0 N--CA 1.435 -1.207 0 N-CA-C 119.554 3.168 . . . . 0.0 119.554 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.09 101.99 0.26 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 104.276 -2.491 . . . . 0.0 104.276 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.543 ' CD1' ' CG2' ' A' ' 87' ' ' VAL . 2.2 m-85 -147.18 -175.23 4.75 Favored 'General case' 0 CA--C 1.496 -1.12 1 CA-C-O 128.726 4.108 . . . . 0.0 112.304 -179.633 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.472 HG23 ' CG2' ' A' ' 69' ' ' VAL . 2.0 m -150.74 166.45 30.4 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.481 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.404 ' N ' HG23 ' A' ' 66' ' ' THR . 14.0 t -96.07 130.4 44.8 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.33 0 O-C-N 127.395 2.934 . . . . 0.0 115.544 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.75 34.81 59.16 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.224 -1.941 . . . . 0.0 116.439 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.472 ' CG2' HG23 ' A' ' 66' ' ' THR . 15.0 t -118.21 55.92 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 117.528 -1.225 . . . . 0.0 109.601 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -15.42 86.13 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.801 1 O-C-N 131.934 5.771 . . . . 0.0 115.612 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.402 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.3 m-85 -59.74 94.09 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 109.528 -3.487 . . . . 0.0 114.082 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 80.27 0.3 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 126.984 2.677 . . . . 0.0 108.654 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.468 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 67.57 150.92 0.07 Allowed 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 125.408 2.528 . . . . 0.0 112.929 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.97 62.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 108.88 -3.782 . . . . 0.0 116.166 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.404 ' C ' ' CG ' ' A' ' 76' ' ' LYS . 55.9 p -136.09 115.94 13.12 Favored 'General case' 0 C--O 1.211 -0.954 0 O-C-N 119.434 -2.041 . . . . 0.0 109.743 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.404 ' CG ' ' C ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -155.24 -64.1 0.12 Allowed 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 126.501 3.048 . . . . 0.0 111.561 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -47.96 -37.76 16.28 Favored Glycine 0 N--CA 1.468 0.831 0 CA-C-N 109.289 -3.596 . . . . 0.0 111.516 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . 0.281 1.5 tp -124.28 32.89 5.4 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.3 t0 174.46 -83.43 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 123.499 1.618 . . . . 0.0 112.983 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.93 76.91 0.99 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.674 2.083 . . . . 0.0 110.57 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -148.74 -133.19 0.06 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 111.275 -2.462 . . . . 0.0 114.09 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.468 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 2.0 p30 177.95 105.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 125.199 1.562 . . . . 0.0 109.835 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 99.6 t -136.67 134.04 48.81 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.299 0 N-CA-C 117.665 2.469 . . . . 0.0 117.665 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -60.56 107.88 0.75 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 112.116 -2.311 . . . . 0.0 106.809 178.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.402 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 94.9 m -109.77 65.55 0.62 Allowed 'General case' 0 C--O 1.204 -1.33 0 CA-C-O 126.34 2.971 . . . . 0.0 118.372 -178.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.7 tt -65.78 142.3 58.02 Favored 'General case' 0 CA--C 1.514 -0.426 1 CA-C-N 108.04 -4.164 . . . . 0.0 112.602 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.543 ' CG2' ' CD1' ' A' ' 65' ' ' PHE . 30.8 t -125.35 144.62 34.78 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 CA-C-N 110.995 -2.82 . . . . 0.0 109.682 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 t -159.72 170.54 21.32 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-O 125.743 2.687 . . . . 0.0 110.117 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.683 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 32.4 m95 -94.22 145.26 24.84 Favored 'General case' 0 CA--C 1.507 -0.703 0 C-N-CA 128.015 2.526 . . . . 0.0 106.156 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.487 ' CB ' HG22 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -95.82 -36.28 11.19 Favored 'General case' 0 C--O 1.197 -1.681 1 CA-C-O 129.888 4.661 . . . . 0.0 113.109 179.708 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.46 -47.02 0.44 Allowed Glycine 0 N--CA 1.481 1.659 1 CA-C-N 107.361 -4.472 . . . . 0.0 106.078 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.421 ' HB3' ' CG2' ' A' ' 2' ' ' THR . 7.1 p30 -122.84 2.17 9.4 Favored 'General case' 0 N--CA 1.429 -1.49 1 O-C-N 132.74 5.612 . . . . 0.0 113.207 -179.125 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.493 ' CB ' ' HA ' ' A' ' 110' ' ' TRP . 1.3 t -160.65 175.68 12.39 Favored 'General case' 0 C--O 1.202 -1.43 0 N-CA-C 119.407 3.114 . . . . 0.0 119.407 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.453 ' CD2' HD23 ' A' ' 63' ' ' LEU 0.257 2.9 tp -92.34 106.59 18.56 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 109.872 -3.331 . . . . 0.0 114.805 179.633 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.487 HG22 ' CB ' ' A' ' 90' ' ' GLU 0.327 41.1 t -108.15 126.09 64.78 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.136 0 CA-C-N 111.003 -2.817 . . . . 0.0 111.862 179.506 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.461 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -137.56 150.69 47.68 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 122.255 1.026 . . . . 0.0 108.999 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.0 m -130.79 108.08 14.88 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.545 0 CA-C-O 127.229 3.395 . . . . 0.0 118.046 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.415 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 2.9 mm-40 -85.09 112.19 20.43 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 112.243 -2.253 . . . . 0.0 108.007 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -51.68 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 128.419 3.574 . . . . 0.0 112.585 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.75 155.09 9.75 Favored Glycine 0 C--O 1.219 -0.811 0 CA-C-O 124.276 2.042 . . . . 0.0 109.128 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.29 -16.27 14.62 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 110.704 -2.748 . . . . 0.0 111.276 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -50.06 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 127.131 2.172 . . . . 0.0 113.122 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -97.04 166.56 11.54 Favored 'General case' 0 C--O 1.198 -1.633 0 CA-C-O 123.295 1.522 . . . . 0.0 113.486 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -124.48 97.33 5.26 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 108.752 -3.84 . . . . 0.0 103.398 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.424 ' HD3' ' HB3' ' A' ' 122' ' ' CYS . 0.1 OUTLIER -89.65 2.38 54.82 Favored 'General case' 0 C--O 1.203 -1.36 0 C-N-CA 125.071 1.348 . . . . 0.0 113.421 -179.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.415 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -46.06 115.48 1.75 Allowed Glycine 0 C--O 1.203 -1.84 2 CA-C-N 108.177 -4.101 . . . . 0.0 112.506 179.816 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.553 ' CZ2' ' CD1' ' A' ' 63' ' ' LEU 0.262 0.0 OUTLIER -114.02 144.93 42.29 Favored 'General case' 0 C--O 1.193 -1.888 0 O-C-N 129.974 3.985 . . . . 0.0 110.344 179.218 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.3 169.74 21.53 Favored 'General case' 0 C--O 1.207 -1.141 1 O-C-N 129.851 4.47 . . . . 0.0 116.6 -179.053 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.498 ' NE2' ' NE1' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -138.42 157.4 46.28 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 109.221 -3.627 . . . . 0.0 109.503 -179.99 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.493 ' HA ' ' CB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -146.08 12.29 1.23 Allowed 'General case' 0 CA--C 1.502 -0.878 1 O-C-N 129.835 4.46 . . . . 0.0 116.044 179.228 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 5.8 t 34.22 55.4 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-O 127.226 3.393 . . . . 0.0 116.303 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -60.63 104.53 0.35 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 110.154 -3.203 . . . . 0.0 114.536 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 58.17 -84.1 0.01 OUTLIER Glycine 0 C--O 1.204 -1.771 0 CA-C-N 114.03 -1.441 . . . . 0.0 115.991 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -134.35 49.27 2.26 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 116.428 2.011 . . . . 0.0 116.428 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.433 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.322 -0.604 0 O-C-N 127.406 2.941 . . . . 0.0 109.488 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.433 ' CD2' ' CE ' ' A' ' 41' ' ' LYS . 3.3 tt -116.0 82.23 1.74 Allowed 'General case' 0 CA--C 1.484 -1.558 0 O-C-N 128.434 3.584 . . . . 0.0 116.597 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -54.05 109.26 0.45 Allowed 'General case' 0 CA--C 1.502 -0.866 0 CA-C-N 109.984 -3.28 . . . . 0.0 114.878 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.498 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -92.02 56.77 2.96 Favored 'General case' 0 C--N 1.36 1.059 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.0 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.04 140.33 58.38 Favored 'General case' 0 CA--C 1.489 -1.366 0 C-N-CA 126.838 2.055 . . . . 0.0 107.945 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.65 162.6 41.06 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 118.32 -1.352 . . . . 0.0 109.062 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.7 t -134.43 151.53 51.24 Favored 'General case' 0 C--O 1.199 -1.579 0 O-C-N 127.147 2.78 . . . . 0.0 104.421 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.424 ' HB3' ' HD3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -141.53 30.99 1.69 Allowed 'General case' 0 CA--C 1.496 -1.11 0 CA-C-O 123.768 1.747 . . . . 0.0 114.506 -179.237 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 119.38 -61.15 0.49 Allowed Glycine 0 C--O 1.223 -0.541 0 CA-C-N 109.732 -3.394 . . . . 0.0 113.587 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -162.75 69.87 0.26 Allowed 'General case' 0 C--O 1.205 -1.271 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -140.71 -49.95 0.44 Allowed 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 110.659 -2.973 . . . . 0.0 109.85 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.4 p 49.1 87.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.131 1 O-C-N 131.55 5.531 . . . . 0.0 112.337 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -72.34 126.9 30.97 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 112.528 -2.124 . . . . 0.0 109.728 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 6.2 mmt85 -106.69 80.39 1.45 Allowed 'General case' 0 CA--C 1.484 -1.578 0 O-C-N 125.762 1.913 . . . . 0.0 112.37 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.11 161.71 2.28 Favored 'General case' 0 C--N 1.35 0.617 0 O-C-N 127.396 2.935 . . . . 0.0 114.548 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -152.42 109.32 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.211 0 CA-C-O 126.449 3.023 . . . . 0.0 104.838 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.523 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 4.2 m-85 -109.69 174.28 5.94 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-N 108.859 -3.791 . . . . 0.0 116.743 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.47 125.38 7.17 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 110.821 -2.9 . . . . 0.0 104.508 179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.534 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 18.8 ttpt -70.63 116.05 10.51 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 128.206 3.441 . . . . 0.0 109.72 178.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.486 -1.513 0 N-CA-C 118.038 2.607 . . . . 0.0 118.038 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.52 3.038 0 CA-C-O 117.666 -1.159 . . . . 0.0 108.354 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.64 127.7 0.03 OUTLIER 'General case' 0 C--O 1.212 -0.91 0 CA-C-O 122.296 1.046 . . . . 0.0 109.198 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.1 mttt 53.36 178.38 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 57.97 89.44 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 124.428 2.061 . . . . 0.0 108.142 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -148.96 47.21 1.0 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 112.945 -1.934 . . . . 0.0 107.633 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.24 148.88 0.11 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 127.409 2.943 . . . . 0.0 113.082 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.3 174.96 40.04 Favored Glycine 0 C--O 1.223 -0.567 0 CA-C-N 110.969 -2.832 . . . . 0.0 112.77 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.425 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -116.77 136.87 52.62 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 130.104 4.061 . . . . 0.0 103.877 179.759 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.531 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.274 0.0 OUTLIER -138.88 100.2 3.98 Favored 'General case' 0 CA--C 1.495 -1.143 0 O-C-N 128.564 3.665 . . . . 0.0 112.085 -179.595 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.21 -24.4 0.46 Allowed 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 115.685 -2.102 . . . . 0.0 114.972 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.405 ' HB3' ' HG2' ' A' ' 39' ' ' GLN . 3.5 ttm 83.32 -67.58 0.07 Allowed 'General case' 0 C--O 1.244 0.813 0 O-C-N 128.364 3.54 . . . . 0.0 106.072 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.402 ' CB ' ' O ' ' A' ' 11' ' ' MET . 36.0 tt0 108.08 -44.77 0.0 OUTLIER 'General case' 0 C--O 1.206 -1.222 1 O-C-N 130.364 4.79 . . . . 0.0 111.231 179.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 177.39 153.64 0.26 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 109.004 -3.725 . . . . 0.0 110.73 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -123.69 134.71 53.68 Favored 'General case' 0 CA--C 1.486 -1.502 0 CA-C-N 111.809 -2.451 . . . . 0.0 111.943 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -73.27 -176.56 2.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 128.936 3.898 . . . . 0.0 111.572 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -9.54 80.73 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.082 0 CA-C-O 124.648 2.166 . . . . 0.0 115.479 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.523 ' CD2' ' HA ' ' A' ' 35' ' ' VAL . 8.3 t80 -80.94 -31.92 34.77 Favored 'General case' 0 C--O 1.203 -1.379 0 CA-C-N 110.038 -3.255 . . . . 0.0 110.258 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -78.24 -49.4 13.82 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 110.725 -2.943 . . . . 0.0 112.905 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -60.95 -21.59 59.12 Favored Glycine 0 C--N 1.342 0.915 0 O-C-N 127.92 3.262 . . . . 0.0 111.723 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.24 -39.34 59.98 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 127.399 2.47 . . . . 0.0 105.701 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.504 ' HE2' ' CE2' ' A' ' 17' ' ' PHE 0.251 31.9 mtt -79.74 -23.96 41.91 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 112.533 -2.121 . . . . 0.0 111.631 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -76.99 -23.84 52.27 Favored 'General case' 0 C--N 1.313 -1.007 0 O-C-N 128.798 3.811 . . . . 0.0 113.102 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.05 -54.62 9.29 Favored 'General case' 0 C--O 1.201 -1.451 1 O-C-N 129.906 4.504 . . . . 0.0 109.453 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.458 ' CD1' ' HB ' ' A' ' 26' ' ' ILE . 0.4 OUTLIER -74.33 -18.93 60.63 Favored 'General case' 0 N--CA 1.488 1.457 1 O-C-N 129.809 4.443 . . . . 0.0 106.237 -179.984 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 45.34 84.33 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.363 0 CA-C-O 126.441 3.02 . . . . 0.0 106.705 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.458 ' HB ' ' CD1' ' A' ' 24' ' ' LEU . 9.9 tt -94.8 -30.26 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.531 1 CA-C-N 107.866 -4.243 . . . . 0.0 115.353 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.439 ' N ' HG21 ' A' ' 26' ' ' ILE . 1.7 t70 -168.55 -175.74 2.58 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 118.345 -2.722 . . . . 0.0 109.997 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -127.52 115.5 18.94 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 63.81 41.46 6.82 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.871 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.11 -5.13 50.97 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 128.725 3.766 . . . . 0.0 110.648 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -75.94 -162.8 0.24 Allowed 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 128.647 2.779 . . . . 0.0 109.236 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.432 ' HG2' HG13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER 77.46 4.75 3.1 Favored 'General case' 0 CA--C 1.485 -1.549 0 O-C-N 127.424 2.953 . . . . 0.0 114.133 179.553 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.432 HG13 ' HG2' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -147.71 -73.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-N 113.416 -1.72 . . . . 0.0 113.43 179.418 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -48.98 -19.85 0.45 Allowed 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.523 ' HA ' ' CD2' ' A' ' 17' ' ' PHE . 53.7 t -26.48 -48.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.584 0 O-C-N 126.463 2.352 . . . . 0.0 109.841 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.421 ' HD2' ' HB2' ' A' ' 39' ' ' GLN . 4.6 tpp180 164.54 125.58 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.376 2 O-C-N 131.145 5.278 . . . . 0.0 111.41 178.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.538 ' HG ' ' CD1' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -142.42 85.45 1.91 Allowed 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 110.006 -3.27 . . . . 0.0 104.994 -179.9 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m 87.85 120.81 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.896 1 O-C-N 135.346 7.904 . . . . 0.0 110.689 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.421 ' HB2' ' HD2' ' A' ' 36' ' ' ARG . 46.4 tp60 -135.8 141.72 44.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 120.513 1.506 . . . . 0.0 110.821 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.3 m -168.99 80.74 0.13 Allowed 'General case' 0 C--O 1.212 -0.879 2 O-C-N 132.258 5.974 . . . . 0.0 112.364 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.427 ' CE ' ' HB ' ' A' ' 43' ' ' ILE . 0.5 OUTLIER -68.93 144.85 54.06 Favored 'General case' 0 N--CA 1.485 1.321 1 O-C-N 129.674 4.359 . . . . 0.0 103.415 -179.975 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.488 ' N ' ' O ' ' A' ' 53' ' ' LYS . 4.2 mt -138.54 103.6 2.27 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.438 0 CA-C-O 124.087 1.899 . . . . 0.0 115.387 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.589 ' CD1' ' CE1' ' A' ' 50' ' ' PHE 0.289 0.3 OUTLIER -88.17 141.04 14.86 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 1 CA-C-N 107.753 -4.294 . . . . 0.0 108.81 179.8 . . . . . . . . 5 4 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.454 ' CG1' ' N ' ' A' ' 45' ' ' GLN . 2.1 t -124.8 -66.5 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.367 0 CA-C-N 111.898 -2.41 . . . . 0.0 114.445 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.507 ' HG3' ' CG ' ' A' ' 50' ' ' PHE . 9.6 mt-30 64.39 123.38 0.02 OUTLIER 'General case' 0 CA--C 1.488 -1.424 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -152.01 37.97 0.57 Allowed 'General case' 0 CA--C 1.489 -1.384 0 C-N-CA 114.563 -2.855 . . . . 0.0 116.362 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.0 93.22 0.54 Allowed Glycine 0 C--O 1.201 -1.954 0 CA-C-N 118.985 0.811 . . . . 0.0 111.575 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 53.22 43.92 30.9 Favored 'General case' 0 CA--C 1.507 -0.698 0 O-C-N 128.066 2.862 . . . . 0.0 113.449 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 179.68 96.06 0.02 OUTLIER 'General case' 0 C--O 1.232 0.175 1 O-C-N 129.465 4.228 . . . . 0.0 109.942 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.589 ' CE1' ' CD1' ' A' ' 43' ' ' ILE . 2.0 t80 -118.75 109.95 16.68 Favored 'General case' 0 CA--C 1.483 -1.613 1 O-C-N 130.094 4.621 . . . . 0.0 112.813 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -112.86 80.48 1.35 Allowed 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 118.951 2.945 . . . . 0.0 118.951 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.474 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -63.01 150.36 42.65 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 127.742 3.151 . . . . 0.0 105.668 179.072 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -159.14 133.36 7.71 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 115.845 -2.342 . . . . 0.0 110.502 -179.14 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.29 148.11 22.77 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 126.128 2.142 . . . . 0.0 111.006 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -112.16 48.35 0.99 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 127.305 2.878 . . . . 0.0 115.081 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.533 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 1.5 p -73.04 158.18 35.91 Favored 'General case' 0 N--CA 1.475 0.814 1 O-C-N 133.091 6.494 . . . . 0.0 105.166 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -103.92 24.03 11.95 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 129.026 3.954 . . . . 0.0 107.141 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.538 ' CD1' ' HG ' ' A' ' 37' ' ' LEU . 14.5 p90 -137.36 -50.71 0.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.82 2.156 . . . . 0.0 116.82 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 -79.78 0.56 Allowed 'General case' 0 CA--C 1.503 -0.859 0 C-N-CA 115.238 -2.585 . . . . 0.0 116.781 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 64.82 67.9 0.53 Allowed 'General case' 0 C--O 1.2 -1.539 0 O-C-N 126.264 2.228 . . . . 0.0 108.883 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 -46.04 41.14 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 110.834 -2.894 . . . . 0.0 109.776 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 47.7 t0 74.24 122.13 0.04 OUTLIER 'General case' 0 CA--C 1.503 -0.838 1 O-C-N 130.437 4.836 . . . . 0.0 110.288 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.589 ' CD1' ' CZ2' ' A' ' 107' ' ' TRP . 13.8 tp -77.14 47.45 0.55 Allowed 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.297 2.248 . . . . 0.0 112.028 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -63.08 96.88 0.1 Allowed 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 106.476 -1.676 . . . . 0.0 106.476 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -134.48 169.17 17.66 Favored 'General case' 0 N--CA 1.475 0.783 1 CA-C-O 129.828 4.632 . . . . 0.0 107.908 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -156.54 126.66 6.47 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 109.715 -3.402 . . . . 0.0 105.041 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.467 HG22 ' CD1' ' A' ' 89' ' ' TRP . 7.2 p -48.27 132.91 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 0 O-C-N 126.277 2.236 . . . . 0.0 116.15 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.14 -0.44 73.56 Favored Glycine 0 C--N 1.359 1.848 0 O-C-N 127.34 2.9 . . . . 0.0 116.943 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -65.08 -40.47 89.04 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 C-N-CA 118.398 -1.321 . . . . 0.0 109.565 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 65.12 88.41 0.11 Allowed 'General case' 0 C--N 1.361 1.096 0 O-C-N 128.337 3.523 . . . . 0.0 110.628 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.462 ' O ' ' N ' ' A' ' 73' ' ' GLU . 0.4 OUTLIER -70.44 75.94 0.56 Allowed 'General case' 0 C--O 1.216 -0.707 0 O-C-N 127.643 3.089 . . . . 0.0 110.743 -179.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -48.36 81.02 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.462 ' N ' ' O ' ' A' ' 71' ' ' PHE . 25.4 mt-10 60.47 -176.47 0.11 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 123.249 1.5 . . . . 0.0 107.9 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 47.7 t60 92.15 97.38 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 109.825 -3.352 . . . . 0.0 116.477 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.28 166.51 24.85 Favored 'General case' 0 C--O 1.198 -1.642 0 CA-C-N 112.111 -2.313 . . . . 0.0 108.925 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 172.07 -31.12 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 O-C-N 126.134 2.146 . . . . 0.0 113.187 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.7 -33.03 48.13 Favored Glycine 0 C--O 1.208 -1.511 0 N-CA-C 107.057 -2.417 . . . . 0.0 107.057 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.407 HD13 ' CD1' ' A' ' 26' ' ' ILE . 3.3 tp -140.68 101.49 4.09 Favored 'General case' 0 N--CA 1.448 -0.527 1 CA-C-N 107.427 -4.387 . . . . 0.0 115.399 179.903 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.454 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 23.4 t0 92.06 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.776 0 O-C-N 128.954 3.909 . . . . 0.0 113.489 179.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.88 82.41 1.4 Allowed Glycine 0 N--CA 1.469 0.862 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.35 -170.4 2.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 111.476 -2.362 . . . . 0.0 109.663 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.494 ' N ' ' ND2' ' A' ' 82' ' ' ASN . 0.6 OUTLIER -135.59 87.79 2.35 Favored 'General case' 0 C--O 1.202 -1.431 0 O-C-N 127.552 3.032 . . . . 0.0 106.723 179.693 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.489 HG13 ' CG ' ' A' ' 98' ' ' GLN . 94.8 t -119.19 142.79 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.557 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -178.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.414 ' N ' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -68.45 73.83 0.24 Allowed 'General case' 0 C--O 1.218 -0.604 0 O-C-N 127.22 2.825 . . . . 0.0 108.1 179.9 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.5 m -76.92 70.61 3.36 Favored 'General case' 0 C--O 1.195 -1.793 0 CA-C-N 109.76 -3.382 . . . . 0.0 112.096 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 165.98 7.82 Favored 'General case' 0 C--O 1.214 -0.788 1 CA-C-N 107.459 -4.428 . . . . 0.0 113.659 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.408 ' CG2' ' HA ' ' A' ' 67' ' ' VAL . 0.3 OUTLIER -157.52 116.5 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.364 0 CA-C-N 112.467 -2.151 . . . . 0.0 108.625 179.772 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -150.0 173.98 13.23 Favored 'General case' 0 CA--C 1.474 -1.946 0 CA-C-N 110.574 -3.012 . . . . 0.0 111.023 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.692 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.0 m95 -96.71 151.67 19.41 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-O 114.832 -2.509 . . . . 0.0 107.982 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.482 ' CB ' HG21 ' A' ' 93' ' ' THR . 7.0 tp10 -100.67 -40.55 7.31 Favored 'General case' 0 C--O 1.199 -1.597 1 CA-C-O 131.663 5.506 . . . . 0.0 112.143 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 176.35 -48.6 0.11 Allowed Glycine 0 C--O 1.207 -1.548 0 CA-C-N 108.723 -3.853 . . . . 0.0 105.708 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -151.09 41.73 0.75 Allowed 'General case' 0 N--CA 1.444 -0.748 1 O-C-N 130.586 4.345 . . . . 0.0 110.656 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.482 HG21 ' CB ' ' A' ' 90' ' ' GLU . 0.6 OUTLIER -172.37 153.86 3.07 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 112.091 -2.322 . . . . 0.0 115.367 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.505 HD23 ' CD2' ' A' ' 50' ' ' PHE . 3.1 tp -88.9 93.96 9.77 Favored 'General case' 0 CA--C 1.481 -1.684 0 O-C-N 128.32 3.513 . . . . 0.0 118.561 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.465 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.341 53.0 t -89.61 114.75 28.03 Favored 'Isoleucine or valine' 0 C--N 1.358 0.977 0 CA-C-N 113.014 -1.903 . . . . 0.0 112.72 178.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 75.4 m -119.41 110.35 16.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 103.333 -2.84 . . . . 0.0 103.333 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.56 74.36 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.482 -1.639 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.489 ' CG ' HG13 ' A' ' 83' ' ' VAL . 0.1 OUTLIER -53.49 100.19 0.03 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.88 88.3 4.24 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-N 110.647 -2.979 . . . . 0.0 113.745 -178.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.425 ' HA2' ' CG2' ' A' ' 83' ' ' VAL . . . -62.66 -86.56 0.05 OUTLIER Glycine 0 CA--C 1.534 1.223 0 N-CA-C 106.631 -2.588 . . . . 0.0 106.631 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 177.25 -57.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 128.369 3.04 . . . . 0.0 111.312 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -37.07 18.79 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 110.653 -2.976 . . . . 0.0 115.62 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.479 ' HG3' ' CZ ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -120.35 175.97 5.71 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 110.297 -3.138 . . . . 0.0 111.988 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.486 ' HB2' ' CG2' ' A' ' 121' ' ' THR . 0.0 OUTLIER -124.69 115.83 21.39 Favored 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.637 -4.801 . . . . 0.0 102.212 179.267 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.479 ' CZ ' ' HG3' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -115.39 24.8 11.32 Favored 'General case' 0 C--O 1.209 -1.06 0 O-C-N 128.256 3.473 . . . . 0.0 108.217 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -81.65 129.29 8.95 Favored Glycine 0 N--CA 1.427 -1.953 2 O-C-N 133.492 6.745 . . . . 0.0 115.15 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.589 ' CZ2' ' CD1' ' A' ' 63' ' ' LEU 0.258 0.0 OUTLIER -115.57 136.22 53.29 Favored 'General case' 0 C--O 1.202 -1.409 0 O-C-N 129.554 3.737 . . . . 0.0 108.419 177.746 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.533 ' HD3' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -153.03 174.59 13.98 Favored 'General case' 0 C--O 1.206 -1.23 1 O-C-N 129.432 4.208 . . . . 0.0 114.484 -178.634 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.415 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -134.01 162.54 31.78 Favored 'General case' 0 C--N 1.361 1.102 0 CA-C-N 110.518 -3.037 . . . . 0.0 109.445 -179.502 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.533 ' CZ3' ' HD3' ' A' ' 108' ' ' LYS . 0.4 OUTLIER -170.0 66.47 0.05 Allowed 'General case' 0 C--N 1.31 -1.116 1 O-C-N 131.711 5.632 . . . . 0.0 115.799 -179.931 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 39.7 t -17.84 99.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.269 0 C-N-CA 128.213 2.605 . . . . 0.0 114.896 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.493 ' HB2' ' CE1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -94.08 38.54 1.08 Allowed 'General case' 0 CA--C 1.49 -1.361 0 CA-C-N 111.819 -2.446 . . . . 0.0 116.317 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.7 -100.82 1.02 Allowed Glycine 0 C--O 1.213 -1.191 0 O-C-N 126.448 2.343 . . . . 0.0 118.065 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -107.01 12.6 28.47 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.894 2.553 . . . . 0.0 117.894 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.408 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 6.6 pttt -157.08 150.03 23.68 Favored 'General case' 0 C--N 1.314 -0.936 1 O-C-N 129.437 4.211 . . . . 0.0 109.192 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.34 174.16 10.35 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 126.203 2.189 . . . . 0.0 112.776 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 112' ' ' GLU . 11.4 m-85 -146.9 89.61 1.83 Allowed 'General case' 0 C--O 1.213 -0.833 0 C-N-CA 115.129 -2.628 . . . . 0.0 112.513 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 11.2 mt -83.01 58.86 4.61 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 110.08 -3.236 . . . . 0.0 108.423 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -76.32 91.96 3.29 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 129.713 3.205 . . . . 0.0 111.531 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.73 -179.12 5.45 Favored 'General case' 0 N--CA 1.489 1.504 1 O-C-N 129.367 4.167 . . . . 0.0 110.365 179.628 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.486 ' CG2' ' HB2' ' A' ' 104' ' ' ASN . 18.3 m -129.38 159.08 37.32 Favored 'General case' 0 CA--C 1.492 -1.271 0 O-C-N 127.274 2.859 . . . . 0.0 105.792 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.55 73.27 0.37 Allowed 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 126.738 3.161 . . . . 0.0 113.268 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 63.76 33.29 86.83 Favored Glycine 0 C--O 1.217 -0.909 0 CA-C-N 110.218 -3.174 . . . . 0.0 112.151 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 79.24 51.72 0.03 OUTLIER 'General case' 0 CA--C 1.492 -1.26 0 O-C-N 128.854 3.326 . . . . 0.0 112.43 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -129.8 24.24 5.36 Favored 'General case' 0 C--O 1.217 -0.614 0 O-C-N 127.572 3.045 . . . . 0.0 106.773 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 7.7 p -10.91 79.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 CA-C-N 108.734 -3.848 . . . . 0.0 115.864 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 16.7 t -65.04 151.07 46.95 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.794 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 96.63 3.45 Favored 'General case' 0 CA--C 1.5 -0.967 0 O-C-N 125.101 1.5 . . . . 0.0 112.989 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -73.14 170.2 15.42 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 113.906 -3.118 . . . . 0.0 111.402 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 89.8 t -140.61 140.32 33.95 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.552 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.408 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 14.9 m-85 -123.2 -177.66 3.75 Favored 'General case' 0 CA--C 1.477 -1.857 0 CA-C-N 109.994 -3.275 . . . . 0.0 116.86 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.317 2.9 tptt -167.94 107.77 0.55 Allowed 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 103.218 -2.882 . . . . 0.0 103.218 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.49 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 23.0 ttpt -57.53 93.3 0.01 OUTLIER 'General case' 0 C--O 1.195 -1.796 0 O-C-N 127.094 2.746 . . . . 0.0 112.126 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.265 1.876 0 O-C-N 126.85 2.593 . . . . 0.0 114.028 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 mtp . . . . . 0 N--CA 1.504 2.246 0 CA-C-O 120.567 0.222 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.438 ' HB ' ' HB3' ' A' ' 92' ' ' ASN . 0.1 OUTLIER -129.56 -55.17 1.16 Allowed 'General case' 0 C--O 1.208 -1.081 0 O-C-N 125.916 2.01 . . . . 0.0 111.14 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.453 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 17.3 pttp -136.03 -40.5 0.67 Allowed 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 112.623 -2.08 . . . . 0.0 113.059 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -81.27 87.41 6.12 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 125.778 1.924 . . . . 0.0 107.024 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -117.84 138.71 51.91 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -125.51 77.7 1.67 Allowed 'General case' 0 C--N 1.317 -0.845 0 O-C-N 128.348 3.53 . . . . 0.0 111.6 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -125.64 -144.96 6.34 Favored Glycine 0 C--O 1.204 -1.733 0 CA-C-N 111.199 -2.728 . . . . 0.0 114.32 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.44 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -160.41 152.28 20.04 Favored 'General case' 0 N--CA 1.478 0.968 1 O-C-N 133.395 5.997 . . . . 0.0 104.898 179.974 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.527 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -150.21 122.55 8.42 Favored 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.922 2.639 . . . . 0.0 117.13 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.45 95.52 10.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 126.678 2.486 . . . . 0.0 106.096 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -33.85 -37.78 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 O-C-N 128.516 3.635 . . . . 0.0 106.236 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 78.97 -70.73 0.1 Allowed 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 125.43 2.538 . . . . 0.0 112.206 179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -134.39 169.69 16.86 Favored 'General case' 0 N--CA 1.433 -1.296 1 CA-C-N 108.175 -4.102 . . . . 0.0 107.809 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.568 ' N ' ' ND2' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -146.47 137.79 24.44 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 108.471 -3.968 . . . . 0.0 112.251 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -79.63 -74.35 0.3 Allowed 'General case' 0 CA--C 1.505 -0.775 0 O-C-N 126.181 2.176 . . . . 0.0 109.033 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -96.87 140.76 30.94 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.796 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -144.05 -52.32 0.32 Allowed 'General case' 0 CA--C 1.491 -1.291 0 CA-C-N 112.488 -2.142 . . . . 0.0 111.179 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.403 ' N ' ' CG ' ' A' ' 17' ' ' PHE . 1.8 tm-20 -70.25 -48.95 54.63 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 124.484 1.114 . . . . 0.0 111.991 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.486 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -60.26 -22.19 58.03 Favored Glycine 0 CA--C 1.492 -1.376 1 O-C-N 129.219 4.074 . . . . 0.0 111.822 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.8 -38.53 32.81 Favored 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.492 ' HG3' ' CG2' ' A' ' 26' ' ' ILE 0.318 0.4 OUTLIER -70.37 -24.79 63.02 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 110.373 -3.103 . . . . 0.0 110.227 -179.598 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.486 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.53 -33.2 42.15 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 129.175 4.047 . . . . 0.0 112.697 179.705 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.405 ' HA ' ' NE2' ' A' ' 125' ' ' GLN . . . -61.59 -37.43 83.86 Favored 'General case' 0 C--O 1.207 -1.163 2 O-C-N 132.316 6.01 . . . . 0.0 113.979 -179.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.463 ' CD1' ' HB2' ' A' ' 79' ' ' ASP 0.351 2.3 mm? -74.87 -45.14 45.04 Favored 'General case' 0 C--O 1.211 -0.954 2 CA-C-N 106.38 -4.918 . . . . 0.0 109.041 -178.241 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.27 12.1 t70 91.83 46.35 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.512 3 O-C-N 133.302 6.626 . . . . 0.0 112.809 -179.892 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.492 ' CG2' ' HG3' ' A' ' 21' ' ' MET . 0.6 OUTLIER -105.28 21.33 3.57 Favored 'Isoleucine or valine' 0 C--N 1.361 1.104 1 CA-C-N 107.525 -4.398 . . . . 0.0 111.259 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -87.38 147.27 25.53 Favored 'General case' 0 C--N 1.359 0.988 0 CA-C-N 111.704 -2.498 . . . . 0.0 110.598 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -176.3 43.21 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.672 0 O-C-N 127.189 2.806 . . . . 0.0 113.242 179.867 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 69.22 48.48 0.66 Allowed 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 126.067 2.841 . . . . 0.0 109.392 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.89 -45.78 6.49 Favored 'General case' 0 C--N 1.361 1.089 1 CA-C-N 107.231 -4.532 . . . . 0.0 114.386 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -179.6 0.29 Allowed 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 114.504 -2.665 . . . . 0.0 111.392 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.17 11.09 3.57 Favored 'General case' 0 CA--C 1.488 -1.406 1 O-C-N 130.881 5.113 . . . . 0.0 112.433 179.934 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.6 mt -147.9 -51.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.019 1 O-C-N 132.516 6.135 . . . . 0.0 111.043 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' A' ' 37' ' ' LEU . . . -77.62 1.72 18.81 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.523 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 t -51.74 -29.85 11.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 124.036 1.874 . . . . 0.0 109.971 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.453 ' HD2' ' HB3' ' A' ' 39' ' ' GLN . 0.0 OUTLIER 164.89 133.83 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 109.011 -3.722 . . . . 0.0 111.258 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.473 ' CD1' ' HB3' ' A' ' 58' ' ' PHE . 0.7 OUTLIER -157.94 96.85 1.5 Allowed 'General case' 0 C--O 1.215 -0.724 2 O-C-N 130.045 4.591 . . . . 0.0 108.081 179.152 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.1 m 62.77 52.65 2.7 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 128.677 3.736 . . . . 0.0 109.863 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.453 ' HB3' ' HD2' ' A' ' 36' ' ' ARG . 37.4 tt0 -74.3 154.38 38.95 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 113.047 -1.888 . . . . 0.0 112.104 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.424 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 82.7 m 177.59 125.3 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.209 1 O-C-N 132.754 6.284 . . . . 0.0 111.847 179.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 8.5 tmtt? -112.74 142.46 45.33 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 127.23 2.831 . . . . 0.0 107.668 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.449 ' N ' ' HD3' ' A' ' 41' ' ' LYS . 2.5 mp -131.6 159.85 42.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 127.456 2.973 . . . . 0.0 111.044 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.4 HG12 ' CE1' ' A' ' 50' ' ' PHE 0.262 0.0 OUTLIER -131.41 150.74 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.604 0 CA-C-N 110.912 -2.858 . . . . 0.0 107.968 179.98 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.423 HG13 ' N ' ' A' ' 45' ' ' GLN . 1.2 t -132.4 -54.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.029 0 C-N-CA 116.544 -2.062 . . . . 0.0 116.102 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.423 ' N ' HG13 ' A' ' 44' ' ' VAL . 0.0 OUTLIER 44.48 88.52 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 -179.754 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.71 45.9 0.98 Allowed 'General case' 0 N--CA 1.481 1.095 1 O-C-N 129.322 4.139 . . . . 0.0 114.622 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.58 93.42 0.36 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-O 117.8 -1.556 . . . . 0.0 113.61 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 75.49 -30.9 0.2 Allowed 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 117.527 2.417 . . . . 0.0 117.527 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -109.11 100.98 10.07 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.415 2.686 . . . . 0.0 108.191 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.4 ' CE1' HG12 ' A' ' 43' ' ' ILE . 25.8 t80 -99.67 102.06 13.43 Favored 'General case' 0 C--N 1.311 -1.109 1 O-C-N 130.353 4.783 . . . . 0.0 115.059 -178.769 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -115.21 67.62 0.7 Allowed 'General case' 0 CA--C 1.493 -1.215 1 O-C-N 129.623 4.327 . . . . 0.0 117.797 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.428 HG23 ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -58.52 125.88 25.22 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 127.694 3.121 . . . . 0.0 105.838 179.247 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -129.56 154.17 47.32 Favored 'General case' 0 CA--C 1.485 -1.535 0 O-C-N 128.503 3.627 . . . . 0.0 112.284 -178.081 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.56 167.46 9.84 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 126.039 2.087 . . . . 0.0 109.938 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -137.93 39.56 2.35 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.451 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 14.7 m -75.5 154.32 36.98 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 128.437 3.586 . . . . 0.0 105.245 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.6 p -85.65 -1.51 57.23 Favored 'General case' 0 N--CA 1.481 1.091 1 O-C-N 131.285 5.366 . . . . 0.0 109.125 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.473 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 2.5 p90 -118.21 -40.87 2.91 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.66 128.02 18.86 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 112.695 -2.048 . . . . 0.0 115.052 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -113.09 -161.75 0.77 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 128.677 3.735 . . . . 0.0 107.256 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 60.9 83.62 0.14 Allowed 'General case' 0 CA--C 1.504 -0.808 0 O-C-N 126.408 2.317 . . . . 0.0 110.194 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.19 -65.99 0.93 Allowed 'General case' 0 C--O 1.208 -1.114 0 O-C-N 126.749 2.53 . . . . 0.0 113.894 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.578 ' CD1' ' CZ2' ' A' ' 107' ' ' TRP . 5.2 tp -136.82 41.87 2.49 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 118.455 2.761 . . . . 0.0 118.455 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.56 98.07 0.24 Allowed 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.491 ' CD2' HG23 ' A' ' 87' ' ' VAL . 5.9 m-85 -140.63 -178.36 5.49 Favored 'General case' 0 CA--C 1.488 -1.408 1 CA-C-O 129.427 4.442 . . . . 0.0 110.01 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.401 HG23 ' CG2' ' A' ' 69' ' ' VAL . 1.6 m -150.61 121.91 7.83 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 109.648 -3.433 . . . . 0.0 104.143 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.501 HG12 ' CD1' ' A' ' 89' ' ' TRP . 5.2 t -61.25 144.1 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 O-C-N 128.134 3.396 . . . . 0.0 116.59 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.95 15.97 61.12 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-N 108.94 -3.754 . . . . 0.0 117.201 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.401 ' CG2' HG23 ' A' ' 66' ' ' THR 0.269 11.1 t -81.07 -25.43 10.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 C-N-CA 119.044 -1.062 . . . . 0.0 109.344 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 67.86 77.6 0.25 Allowed 'General case' 0 C--N 1.364 1.208 0 O-C-N 129.06 3.975 . . . . 0.0 108.909 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 73' ' ' GLU . 1.3 m-85 -60.51 99.0 0.07 Allowed 'General case' 0 C--N 1.355 0.811 0 O-C-N 127.497 2.998 . . . . 0.0 115.836 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -68.55 73.11 0.23 Allowed 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 112.358 -2.201 . . . . 0.0 111.352 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.489 ' HB3' ' CA ' ' A' ' 82' ' ' ASN . 6.7 mt-10 53.11 -156.51 0.18 Allowed 'General case' 0 CA--C 1.507 -0.683 0 CA-C-O 121.499 0.666 . . . . 0.0 112.339 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.664 ' ND1' HD22 ' A' ' 82' ' ' ASN . 18.8 m80 71.5 87.97 0.11 Allowed 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 124.763 2.221 . . . . 0.0 112.631 -179.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -125.93 122.56 36.33 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-N 110.214 -3.175 . . . . 0.0 113.04 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.24 168.96 18.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 127.657 3.098 . . . . 0.0 112.254 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.13 34.63 64.52 Favored Glycine 0 C--O 1.207 -1.536 0 CA-C-N 111.782 -2.463 . . . . 0.0 107.845 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.5 tp -167.45 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.51 -0.57 1 O-C-N 130.417 4.245 . . . . 0.0 116.501 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.463 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 7.7 t70 -155.17 -57.4 0.1 Allowed 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 116.197 -2.201 . . . . 0.0 113.055 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.63 76.86 1.31 Allowed Glycine 0 C--O 1.213 -1.169 0 O-C-N 126.104 2.127 . . . . 0.0 111.619 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -137.05 -156.91 0.73 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 111.342 -2.429 . . . . 0.0 111.168 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.664 HD22 ' ND1' ' A' ' 74' ' ' HIS . 0.5 OUTLIER -160.14 105.08 1.51 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 128.167 3.417 . . . . 0.0 108.488 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 12.8 t -144.27 135.33 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.2 0 N-CA-C 117.48 2.4 . . . . 0.0 117.48 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.479 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -49.58 145.07 5.26 Favored 'General case' 0 N--CA 1.467 0.39 1 O-C-N 129.708 4.38 . . . . 0.0 106.266 178.183 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 78.3 m -150.42 66.14 0.95 Allowed 'General case' 0 C--O 1.201 -1.459 0 O-C-N 127.537 3.023 . . . . 0.0 115.251 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -62.04 140.58 58.36 Favored 'General case' 0 N--CA 1.432 -1.373 1 CA-C-N 108.12 -4.127 . . . . 0.0 110.811 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.491 HG23 ' CD2' ' A' ' 65' ' ' PHE . 3.9 t -132.39 135.98 56.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 C-N-CA 126.1 1.76 . . . . 0.0 108.414 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.477 ' HA ' ' CG1' ' A' ' 67' ' ' VAL . 9.7 t -159.81 156.67 27.89 Favored 'General case' 0 CA--C 1.473 -1.982 0 CA-C-O 124.462 2.077 . . . . 0.0 109.28 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.691 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 38.5 m95 -90.34 145.31 25.06 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-O 114.602 -2.618 . . . . 0.0 106.761 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.478 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 7.0 tp10 -97.38 -8.53 29.32 Favored 'General case' 0 CA--C 1.489 -1.367 1 CA-C-O 129.462 4.458 . . . . 0.0 112.055 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.95 -19.17 11.22 Favored Glycine 0 C--O 1.2 -2.023 0 CA-C-N 108.731 -3.85 . . . . 0.0 106.097 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.438 ' HB3' ' HB ' ' A' ' 2' ' ' THR . 0.8 OUTLIER -158.96 44.88 0.27 Allowed 'General case' 0 N--CA 1.431 -1.391 1 O-C-N 131.826 5.074 . . . . 0.0 111.766 179.978 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.459 ' C ' ' CZ3' ' A' ' 89' ' ' TRP . 15.1 t 164.1 144.88 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.916 2.561 . . . . 0.0 117.916 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.465 ' CD2' HD23 ' A' ' 63' ' ' LEU . 1.2 tp -87.55 83.17 7.28 Favored 'General case' 0 CA--C 1.504 -0.798 0 O-C-N 127.397 2.936 . . . . 0.0 114.907 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.478 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.355 73.8 t -81.03 127.63 39.38 Favored 'Isoleucine or valine' 0 C--N 1.351 0.672 1 O-C-N 129.285 4.116 . . . . 0.0 111.394 179.663 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.42 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -139.23 141.39 37.87 Favored 'General case' 0 C--O 1.196 -1.749 0 N-CA-C 103.953 -2.61 . . . . 0.0 103.953 -179.019 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.2 t -121.87 91.13 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.736 0 N-CA-C 119.719 3.229 . . . . 0.0 119.719 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.459 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 17.4 mm-40 -65.97 97.84 0.39 Allowed 'General case' 0 C--N 1.361 1.072 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.479 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 1.1 tmtm? -39.29 -49.24 1.93 Allowed 'General case' 0 N--CA 1.48 1.075 0 O-C-N 128.507 3.629 . . . . 0.0 112.417 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.4 133.97 4.1 Favored Glycine 0 C--O 1.206 -1.652 1 CA-C-O 128.076 4.153 . . . . 0.0 113.879 179.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.46 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -100.78 -46.36 5.17 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 108.955 -3.622 . . . . 0.0 107.607 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.46 ' CG ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -146.24 16.44 1.34 Allowed 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 127.798 2.439 . . . . 0.0 115.965 179.773 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.65 -178.73 7.54 Favored 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 125.859 1.664 . . . . 0.0 114.349 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -125.39 88.22 2.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 127.699 3.124 . . . . 0.0 102.827 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.459 ' HB2' ' CG ' ' A' ' 98' ' ' GLN . 57.9 mmt-85 -92.92 2.79 56.6 Favored 'General case' 0 C--O 1.212 -0.894 0 O-C-N 126.9 2.625 . . . . 0.0 113.427 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -37.98 99.44 0.01 OUTLIER Glycine 0 C--O 1.209 -1.41 2 O-C-N 131.974 5.796 . . . . 0.0 113.093 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.578 ' CZ2' ' CD1' ' A' ' 63' ' ' LEU 0.299 0.0 OUTLIER -108.63 126.8 53.36 Favored 'General case' 0 C--O 1.209 -1.032 0 O-C-N 128.954 3.385 . . . . 0.0 110.025 179.546 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -153.52 155.08 35.54 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 128.299 3.904 . . . . 0.0 113.809 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.469 ' CG ' ' CD2' ' A' ' 118' ' ' LEU . 0.8 OUTLIER -114.93 -179.42 3.62 Favored 'General case' 0 C--N 1.366 1.283 1 CA-C-N 108.006 -4.179 . . . . 0.0 109.562 -179.186 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.455 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.6 OUTLIER 174.55 77.86 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.509 1 O-C-N 132.017 5.823 . . . . 0.0 117.743 179.113 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 63.6 t -27.55 101.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.817 1 CA-C-O 128.61 4.053 . . . . 0.0 117.435 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -111.06 -179.79 3.83 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 112.257 -2.247 . . . . 0.0 111.852 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -25.8 73.94 0.0 OUTLIER Glycine 0 C--O 1.204 -1.742 0 C-N-CA 127.284 2.373 . . . . 0.0 116.633 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 43.25 68.45 0.51 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 127.674 2.39 . . . . 0.0 116.823 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.475 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 9.3 pttt 160.33 164.83 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.161 1 O-C-N 133.128 6.517 . . . . 0.0 108.33 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.14 151.55 23.89 Favored 'General case' 0 CA--C 1.478 -1.789 0 O-C-N 127.088 2.743 . . . . 0.0 113.544 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -113.14 98.34 7.08 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 113.425 -1.716 . . . . 0.0 115.609 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.469 ' CD2' ' CG ' ' A' ' 109' ' ' GLN . 8.3 mt -85.98 77.61 9.63 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 128.178 3.424 . . . . 0.0 107.593 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.455 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.4 mt-10 -88.81 95.24 10.21 Favored 'General case' 0 CA--C 1.494 -1.19 0 O-C-N 126.666 2.479 . . . . 0.0 111.434 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.404 ' CB ' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -110.79 166.11 11.29 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 127.307 2.879 . . . . 0.0 108.466 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 20.2 m -122.18 156.35 33.89 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 110.498 -3.046 . . . . 0.0 105.259 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.426 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.8 OUTLIER -162.35 59.9 0.23 Allowed 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 125.283 2.468 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.44 32.93 14.82 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 113.426 -1.715 . . . . 0.0 113.478 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 73.11 28.03 1.94 Allowed 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 111.576 -2.312 . . . . 0.0 111.485 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.405 ' NE2' ' HA ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -87.15 -28.06 22.68 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 110.896 -2.866 . . . . 0.0 108.165 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.404 ' CG1' ' C ' ' A' ' 125' ' ' GLN . 0.3 OUTLIER 45.81 119.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 1 O-C-N 131.38 5.425 . . . . 0.0 113.477 -179.766 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.1 t -112.19 120.51 42.04 Favored 'General case' 0 CA--C 1.5 -0.954 0 O-C-N 117.991 -2.943 . . . . 0.0 111.452 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 99.0 8.09 Favored 'General case' 0 CA--C 1.51 -0.578 0 O-C-N 127.105 2.753 . . . . 0.0 112.038 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -79.68 172.2 14.1 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 12.2 t -140.42 148.66 22.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 103.788 -2.671 . . . . 0.0 103.788 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.475 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 18.8 m-85 -138.24 -177.18 4.72 Favored 'General case' 0 CA--C 1.485 -1.534 0 CA-C-O 127.454 3.502 . . . . 0.0 116.797 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.277 9.2 tppt? -162.7 105.18 1.07 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 110.975 -2.83 . . . . 0.0 103.418 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.527 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 6.2 ttpt -68.59 78.39 0.28 Allowed 'General case' 0 C--O 1.201 -1.455 0 CA-C-N 111.969 -2.378 . . . . 0.0 113.496 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt . . . . . 0 CA--C 1.481 -1.677 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -179.939 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 50.6 m -160.01 -62.13 0.07 Allowed 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 123.441 1.591 . . . . 0.0 107.847 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.523 ' HG2' ' CZ2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER -68.71 -150.93 0.01 OUTLIER 'General case' 0 C--N 1.357 0.929 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -71.2 -169.74 0.41 Allowed 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.399 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -164.95 148.54 8.65 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 104.451 -2.425 . . . . 0.0 104.451 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -46.16 158.3 0.1 Allowed 'General case' 0 C--N 1.313 -0.982 1 O-C-N 132.83 6.331 . . . . 0.0 116.566 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.77 -167.53 33.68 Favored Glycine 0 C--O 1.203 -1.828 0 O-C-N 127.332 2.895 . . . . 0.0 112.314 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.433 HG21 ' N ' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -144.01 147.01 33.29 Favored 'General case' 0 C--N 1.316 -0.852 1 O-C-N 132.64 5.553 . . . . 0.0 107.801 -179.946 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.534 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -140.56 130.1 24.08 Favored 'General case' 0 C--N 1.323 -0.548 1 O-C-N 133.282 6.614 . . . . 0.0 111.137 -179.644 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -86.47 -6.25 58.96 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 126.753 2.533 . . . . 0.0 115.332 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.527 ' HG3' ' CE1' ' A' ' 131' ' ' PHE . 19.8 ttm 54.88 85.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.678 0 O-C-N 125.073 1.483 . . . . 0.0 107.257 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 132' ' ' LYS . 34.3 tt0 -25.43 -38.01 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 131.034 3.734 . . . . 0.0 110.741 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 173.47 169.17 0.17 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 126.753 3.168 . . . . 0.0 111.513 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -104.88 160.86 14.67 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 108.653 -3.885 . . . . 0.0 114.757 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -122.97 -64.41 1.18 Allowed 'General case' 0 CA--C 1.494 -1.183 1 O-C-N 130.275 4.734 . . . . 0.0 113.978 179.79 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -127.22 85.9 2.43 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.681 -1.145 . . . . 0.0 113.872 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -43.44 7.62 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.687 3.117 . . . . 0.0 112.378 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.262 32.9 tt0 -79.6 -35.34 39.73 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 111.096 -2.775 . . . . 0.0 114.282 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -76.91 -22.73 71.05 Favored Glycine 0 N--CA 1.478 1.481 0 C-N-CA 115.301 -3.333 . . . . 0.0 110.917 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.501 ' CE1' HD12 ' A' ' 120' ' ' LEU . 8.9 t80 -62.4 -33.38 74.65 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 124.608 2.147 . . . . 0.0 108.522 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.51 ' HB3' ' CG2' ' A' ' 26' ' ' ILE 0.282 51.4 mtp -75.64 -26.05 57.4 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-N 112.876 -1.965 . . . . 0.0 108.63 -179.752 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -80.02 -29.05 39.31 Favored 'General case' 0 C--N 1.312 -1.057 0 O-C-N 125.511 1.757 . . . . 0.0 112.841 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.61 -46.23 84.35 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 111.061 -2.79 . . . . 0.0 113.925 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.407 HD13 ' C ' ' A' ' 25' ' ' ASP . 4.0 pp -83.82 -27.12 28.99 Favored 'General case' 0 N--CA 1.48 1.043 1 O-C-N 130.029 4.581 . . . . 0.0 103.005 179.11 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.407 ' C ' HD13 ' A' ' 24' ' ' LEU . 0.3 OUTLIER 80.99 93.4 0.05 OUTLIER 'General case' 0 CA--C 1.483 -1.633 1 CA-C-O 129.486 4.469 . . . . 0.0 114.312 179.252 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.51 ' CG2' ' HB3' ' A' ' 21' ' ' MET . 1.0 OUTLIER -134.23 20.78 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-O 127.415 3.483 . . . . 0.0 107.669 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.54 99.45 0.03 OUTLIER 'General case' 0 C--N 1.366 1.309 0 CA-C-N 112.27 -2.241 . . . . 0.0 113.516 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -132.98 16.01 4.22 Favored 'General case' 0 CA--C 1.488 -1.423 0 O-C-N 128.81 3.819 . . . . 0.0 112.144 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 48.6 38.65 11.69 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-O 126.321 2.962 . . . . 0.0 109.987 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.19 -11.17 33.38 Favored 'General case' 0 C--N 1.349 0.556 1 CA-C-N 108.326 -4.034 . . . . 0.0 112.092 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -102.31 -172.37 2.12 Favored 'General case' 0 C--O 1.222 -0.373 1 O-C-N 130.791 5.057 . . . . 0.0 110.872 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 91.6 -9.27 0.24 Allowed 'General case' 0 C--O 1.202 -1.428 1 O-C-N 131.312 5.383 . . . . 0.0 112.99 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -125.79 4.16 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 O-C-N 128.238 3.461 . . . . 0.0 111.682 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -120.8 31.75 6.28 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 123.182 1.468 . . . . 0.0 108.488 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -41.19 -42.24 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.303 0 CA-C-N 110.739 -2.937 . . . . 0.0 111.242 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.463 ' HG3' ' CB ' ' A' ' 39' ' ' GLN . 7.0 tmm_? 150.26 125.02 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.149 2 CA-C-N 107.472 -4.422 . . . . 0.0 113.07 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.548 HD12 ' CZ ' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -145.14 110.69 5.34 Favored 'General case' 0 N--CA 1.435 -1.178 1 O-C-N 129.428 4.205 . . . . 0.0 107.343 -179.961 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.438 ' HB ' ' HA ' ' A' ' 56' ' ' SER . 1.7 m 75.94 25.43 1.11 Allowed 'General case' 0 CA--C 1.502 -0.9 1 O-C-N 132.991 6.432 . . . . 0.0 112.653 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.463 ' CB ' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -70.12 110.67 5.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.026 2.704 . . . . 0.0 116.23 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.4 m -137.58 101.67 4.55 Favored 'General case' 0 C--O 1.206 -1.189 1 O-C-N 129.178 4.049 . . . . 0.0 113.203 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.417 ' N ' ' O ' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -77.72 139.75 39.44 Favored 'General case' 0 C--O 1.222 -0.372 0 O-C-N 126.671 2.482 . . . . 0.0 108.795 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.43 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 2.3 mp -125.15 161.45 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 126.509 2.38 . . . . 0.0 109.698 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.522 HD12 ' CE2' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -137.12 126.14 35.76 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.528 0 O-C-N 127.504 3.003 . . . . 0.0 110.439 -179.813 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.8 t -129.48 86.67 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 112.443 -2.162 . . . . 0.0 111.128 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.61 140.41 32.07 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 127.107 2.754 . . . . 0.0 112.199 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -151.7 31.95 0.57 Allowed 'General case' 0 CA--C 1.488 -1.408 1 CA-C-N 107.435 -4.438 . . . . 0.0 117.41 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.92 -70.07 1.35 Allowed Glycine 0 C--O 1.205 -1.682 0 O-C-N 119.941 -1.724 . . . . 0.0 111.29 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.61 98.28 3.65 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 129.159 3.505 . . . . 0.0 110.695 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.405 ' ND2' ' HE2' ' A' ' 51' ' ' LYS . 42.1 t30 116.66 79.68 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.604 1 O-C-N 129.577 4.298 . . . . 0.0 108.463 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.522 ' CE2' HD12 ' A' ' 43' ' ' ILE . 7.6 t80 -90.5 125.96 35.76 Favored 'General case' 0 C--N 1.313 -1.004 1 O-C-N 131.974 5.797 . . . . 0.0 110.08 179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.405 ' HE2' ' ND2' ' A' ' 49' ' ' ASN . 2.8 mttt -137.05 80.08 1.79 Allowed 'General case' 0 CA--C 1.492 -1.259 0 O-C-N 128.267 3.479 . . . . 0.0 119.027 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.425 HG21 ' HB2' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -60.3 157.64 13.23 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 128.397 3.561 . . . . 0.0 107.053 179.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -167.64 141.56 3.54 Favored 'General case' 0 CA--C 1.487 -1.454 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.571 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.423 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 0.6 OUTLIER -93.53 161.32 14.41 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.617 1.198 . . . . 0.0 111.258 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -128.59 28.72 5.38 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 116.219 1.933 . . . . 0.0 116.219 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.438 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 91.0 p -64.3 145.83 55.39 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 128.65 3.719 . . . . 0.0 105.102 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.8 m -64.82 -27.35 68.82 Favored 'General case' 0 N--CA 1.469 0.496 1 O-C-N 132.101 5.876 . . . . 0.0 107.46 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.548 ' CZ ' HD12 ' A' ' 37' ' ' LEU . 4.3 m-30 -82.21 -79.02 0.19 Allowed 'General case' 0 C--O 1.239 0.543 0 O-C-N 128.799 3.812 . . . . 0.0 117.615 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -115.8 88.58 2.91 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 127.603 3.064 . . . . 0.0 115.269 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.423 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 14.0 p30 -92.47 63.3 4.1 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.221 4.076 . . . . 0.0 110.636 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -88.57 111.79 22.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 111.772 -2.467 . . . . 0.0 109.394 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.5 p30 -77.64 161.87 27.47 Favored 'General case' 0 C--O 1.204 -1.294 0 O-C-N 127.437 2.961 . . . . 0.0 115.717 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.425 ' HB2' HG21 ' A' ' 52' ' ' THR . 12.4 tp -106.8 45.41 0.98 Allowed 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 112.697 -2.047 . . . . 0.0 111.554 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -71.59 95.0 1.37 Allowed 'General case' 0 C--O 1.203 -1.382 1 O-C-N 129.285 4.116 . . . . 0.0 110.704 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.526 ' CE1' HD23 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -159.57 132.29 6.74 Favored 'General case' 0 CA--C 1.483 -1.606 1 CA-C-O 131.111 5.243 . . . . 0.0 112.912 179.93 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.457 ' CG2' ' N ' ' A' ' 67' ' ' VAL . 0.4 OUTLIER -85.83 172.04 11.07 Favored 'General case' 0 C--O 1.21 -1.012 0 O-C-N 116.835 -3.666 . . . . 0.0 110.32 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.516 ' CG2' ' CD1' ' A' ' 89' ' ' TRP . 10.3 t -82.12 136.02 23.8 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.909 0 O-C-N 127.86 3.225 . . . . 0.0 112.916 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.56 5.85 19.48 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.687 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 8.2 p -60.87 -20.93 22.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.192 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 58.14 72.58 0.51 Allowed 'General case' 0 C--N 1.353 0.718 1 O-C-N 130.344 4.777 . . . . 0.0 109.047 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.428 ' CB ' HG23 ' A' ' 85' ' ' THR . 0.4 OUTLIER -66.88 141.42 57.66 Favored 'General case' 0 CA--C 1.493 -1.24 2 CA-C-N 106.648 -4.796 . . . . 0.0 118.254 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -120.91 63.47 0.87 Allowed 'General case' 0 CA--C 1.485 -1.533 0 CA-C-O 124.21 1.957 . . . . 0.0 113.541 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -55.18 143.13 28.57 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-O 125.081 2.372 . . . . 0.0 108.514 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -111.32 18.69 19.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 112.972 -1.922 . . . . 0.0 115.789 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 16.73 98.77 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.06 0 O-C-N 127.095 2.747 . . . . 0.0 115.956 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.84 146.07 27.79 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 128.116 3.385 . . . . 0.0 115.479 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.16 -32.1 7.98 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-N 110.04 -3.255 . . . . 0.0 110.666 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.2 tp -117.86 -4.23 11.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 129.617 3.775 . . . . 0.0 116.655 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -159.75 -72.43 0.08 Allowed 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 118.296 -1.361 . . . . 0.0 114.361 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.21 84.88 1.79 Allowed Glycine 0 N--CA 1.466 0.688 0 CA-C-O 122.188 0.882 . . . . 0.0 111.273 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.446 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.0 OUTLIER -148.87 -127.32 0.05 Allowed 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.861 -2.17 . . . . 0.0 114.716 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.446 ' ND2' ' O ' ' A' ' 81' ' ' ARG . 3.3 p30 164.43 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 124.533 1.145 . . . . 0.0 110.069 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -146.59 165.92 7.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.798 0 N-CA-C 117.443 2.386 . . . . 0.0 117.443 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.471 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -74.82 167.7 21.33 Favored 'General case' 0 C--O 1.241 0.628 2 O-C-N 132.58 6.175 . . . . 0.0 107.715 179.458 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.428 HG23 ' CB ' ' A' ' 71' ' ' PHE . 1.2 m -173.4 86.69 0.06 Allowed 'General case' 0 C--O 1.194 -1.828 1 O-C-N 130.197 4.685 . . . . 0.0 111.1 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 110.18 21.56 Favored 'General case' 0 N--CA 1.43 -1.444 1 CA-C-N 106.862 -4.699 . . . . 0.0 116.874 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.508 HG23 ' CD2' ' A' ' 65' ' ' PHE . 17.6 t -80.77 150.59 4.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 CA-C-N 111.859 -2.428 . . . . 0.0 108.667 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.287 22.3 m -160.14 145.77 15.28 Favored 'General case' 0 CA--C 1.474 -1.962 0 CA-C-N 112.608 -2.087 . . . . 0.0 109.964 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.689 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 8.9 m95 -85.69 129.09 34.91 Favored 'General case' 0 C--N 1.357 0.899 0 CA-C-O 113.696 -3.05 . . . . 0.0 105.461 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.497 ' CB ' ' CG2' ' A' ' 93' ' ' THR . 0.5 OUTLIER -99.33 -9.53 23.43 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 127.224 3.392 . . . . 0.0 116.243 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 147.34 -78.2 0.24 Allowed Glycine 0 C--O 1.194 -2.363 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -134.75 100.5 4.63 Favored 'General case' 0 C--O 1.195 -1.788 1 O-C-N 131.502 4.884 . . . . 0.0 103.265 179.591 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.497 ' CG2' ' CB ' ' A' ' 90' ' ' GLU . 4.5 t 166.42 -131.87 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 127.478 2.986 . . . . 0.0 113.132 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.526 HD23 ' CE1' ' A' ' 65' ' ' PHE 0.292 1.2 tp 166.19 70.03 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 129.697 3.199 . . . . 0.0 113.925 179.465 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.424 HG22 ' CG ' ' A' ' 90' ' ' GLU 0.36 45.5 t -74.66 132.72 32.9 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 N-CA-C 118.586 2.81 . . . . 0.0 118.586 179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -137.72 129.67 28.78 Favored 'General case' 0 C--O 1.199 -1.56 0 N-CA-C 103.05 -2.944 . . . . 0.0 103.05 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.2 t -104.37 99.62 8.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 C-N-CA 127.254 2.222 . . . . 0.0 116.527 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.84 93.14 5.58 Favored 'General case' 0 C--N 1.36 1.022 0 CA-C-O 125.398 2.523 . . . . 0.0 110.682 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.471 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -75.55 87.35 2.66 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 111.89 -2.413 . . . . 0.0 111.089 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -118.66 165.65 12.94 Favored Glycine 0 C--O 1.209 -1.432 1 CA-C-O 128.566 4.425 . . . . 0.0 113.823 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -129.89 109.48 10.94 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 109.98 -3.11 . . . . 0.0 110.798 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? 125.89 -36.25 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.291 0 O-C-N 127.708 3.13 . . . . 0.0 110.881 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.18 156.24 43.28 Favored 'General case' 0 C--O 1.199 -1.587 1 CA-C-N 107.83 -4.259 . . . . 0.0 113.393 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -115.29 118.53 33.53 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 109.868 -3.333 . . . . 0.0 103.537 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 122' ' ' CYS . 6.5 mmt85 -110.91 11.84 22.27 Favored 'General case' 0 C--O 1.213 -0.835 1 O-C-N 129.746 4.404 . . . . 0.0 109.523 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -51.81 92.85 0.01 OUTLIER Glycine 0 N--CA 1.429 -1.789 2 CA-C-N 106.814 -4.721 . . . . 0.0 111.929 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.44 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.262 0.0 OUTLIER -107.43 143.14 36.19 Favored 'General case' 0 C--O 1.206 -1.214 1 O-C-N 130.786 4.463 . . . . 0.0 109.904 179.662 . . . . . . . . 5 4 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.537 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 2.3 ptpt -158.14 172.22 18.8 Favored 'General case' 0 CA--C 1.507 -0.705 1 O-C-N 132.095 5.872 . . . . 0.0 114.43 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.494 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -122.44 176.69 5.75 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 113.86 -2.971 . . . . 0.0 105.0 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.537 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 20.0 m95 -133.28 -55.64 0.91 Allowed 'General case' 0 C--N 1.311 -1.075 0 O-C-N 125.988 2.055 . . . . 0.0 112.001 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.8 t 87.37 57.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.777 1 CA-C-O 130.222 4.82 . . . . 0.0 110.134 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.95 67.55 1.27 Allowed 'General case' 0 CA--C 1.478 -1.812 1 CA-C-N 107.006 -4.634 . . . . 0.0 117.757 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 87.83 -88.39 1.56 Allowed Glycine 0 C--O 1.202 -1.887 0 N-CA-C 117.527 1.771 . . . . 0.0 117.527 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.437 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 74.5 m-20 -100.94 -23.9 14.45 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 118.962 2.949 . . . . 0.0 118.962 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.437 ' HE2' ' HB2' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -130.72 -168.45 1.99 Allowed 'General case' 0 CA--C 1.499 -0.981 1 O-C-N 130.205 4.691 . . . . 0.0 110.199 179.987 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.439 HD21 ' CZ3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -146.31 94.66 2.49 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 128.123 3.821 . . . . 0.0 111.156 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.14 124.47 20.07 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 109.145 -3.662 . . . . 0.0 110.47 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 2.6 mt -95.2 72.2 3.32 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 127.539 3.024 . . . . 0.0 108.882 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -71.39 91.89 1.04 Allowed 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 128.964 3.915 . . . . 0.0 110.909 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.501 HD12 ' CE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -102.87 160.4 14.64 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 114.26 -1.336 . . . . 0.0 107.55 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.7 m -124.17 168.73 12.53 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.365 1.666 . . . . 0.0 110.799 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.444 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 10.3 t -167.8 50.8 0.06 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 126.347 2.975 . . . . 0.0 110.38 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 103.29 6.91 44.22 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 112.244 -2.253 . . . . 0.0 112.284 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.9 t0 100.57 28.45 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.058 0 O-C-N 128.523 3.131 . . . . 0.0 112.299 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -85.36 -17.27 37.23 Favored 'General case' 0 C--O 1.206 -1.188 0 C-N-CA 114.207 -2.997 . . . . 0.0 105.468 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 33.3 85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 O-C-N 129.051 3.969 . . . . 0.0 113.284 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 77.0 m -59.44 152.48 21.46 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.18 70.95 1.46 Allowed 'General case' 0 CA--C 1.486 -1.501 0 CA-C-O 124.374 2.035 . . . . 0.0 112.604 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -57.49 170.51 0.53 Allowed 'General case' 0 C--N 1.358 0.936 0 C-N-CA 116.611 -2.035 . . . . 0.0 111.695 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 11.5 t -141.62 105.03 1.4 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.295 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.527 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 12.0 m-85 -99.28 162.37 13.09 Favored 'General case' 0 CA--C 1.494 -1.204 1 CA-C-N 108.111 -4.131 . . . . 0.0 117.628 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.418 ' HB2' ' HB2' ' A' ' 12' ' ' GLU 0.384 0.0 OUTLIER -147.82 129.44 15.04 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 110.579 -3.01 . . . . 0.0 104.471 179.989 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.534 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 17.0 tttm -68.53 122.62 18.85 Favored 'General case' 0 C--O 1.198 -1.606 0 O-C-N 127.406 2.941 . . . . 0.0 110.997 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.245 0.861 0 CA-C-O 115.932 -1.985 . . . . 0.0 115.028 -179.906 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 122.705 1.24 . . . . 0.0 108.696 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.3 m -162.67 -52.14 0.04 OUTLIER 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 112.196 -2.274 . . . . 0.0 107.096 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.77 157.6 25.25 Favored 'General case' 0 CA--C 1.491 -1.3 0 O-C-N 127.685 3.116 . . . . 0.0 115.01 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.48 136.63 53.51 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.5 -2.778 . . . . 0.0 103.5 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.588 ' N ' HE21 ' A' ' 5' ' ' GLN . 0.0 OUTLIER -178.83 154.14 0.7 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 114.875 -2.488 . . . . 0.0 105.262 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 24.29 108.67 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.712 1 O-C-N 133.398 6.686 . . . . 0.0 116.934 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.437 ' N ' HG23 ' A' ' 43' ' ' ILE . . . -177.22 147.86 8.52 Favored Glycine 0 C--O 1.211 -1.296 0 CA-C-N 113.411 -1.722 . . . . 0.0 113.333 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 62.7 p -124.7 63.39 1.12 Allowed 'General case' 0 C--O 1.201 -1.451 0 O-C-N 127.228 2.369 . . . . 0.0 105.813 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.601 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -62.77 128.1 34.34 Favored 'General case' 0 N--CA 1.451 -0.421 1 O-C-N 130.838 5.086 . . . . 0.0 111.282 -179.672 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -77.41 -12.06 59.91 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.458 ' HE1' ' CZ ' ' A' ' 131' ' ' PHE . 37.6 ttm 54.53 74.97 0.32 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 105.439 -2.059 . . . . 0.0 105.439 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -47.77 -51.9 20.67 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 127.01 2.694 . . . . 0.0 109.883 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.96 154.54 42.03 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 111.511 -2.586 . . . . 0.0 111.356 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.428 ' ND2' ' O ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -134.58 141.12 46.55 Favored 'General case' 0 CA--C 1.483 -1.63 0 O-C-N 128.49 3.619 . . . . 0.0 111.403 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.428 ' O ' ' ND2' ' A' ' 14' ' ' ASN . 3.0 mt-10 -77.21 -169.81 1.5 Allowed 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 112.661 -2.063 . . . . 0.0 114.085 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -30.1 100.42 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.386 0 C-N-CA 127.108 2.163 . . . . 0.0 114.326 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -96.91 -24.8 15.68 Favored 'General case' 0 C--O 1.204 -1.299 0 O-C-N 125.791 1.932 . . . . 0.0 109.547 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -76.67 -37.6 55.93 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 113.45 -1.704 . . . . 0.0 112.762 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.7 -24.62 60.03 Favored Glycine 0 N--CA 1.487 2.048 0 C-N-CA 115.951 -3.023 . . . . 0.0 106.547 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -68.58 -27.77 66.35 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-O 127.236 3.398 . . . . 0.0 108.488 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.497 ' CG ' ' CG2' ' A' ' 26' ' ' ILE . 3.5 ttt -70.22 -33.57 71.83 Favored 'General case' 0 CA--C 1.488 -1.442 0 CA-C-N 112.704 -2.044 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.9 mtmt -77.0 -21.76 54.16 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 109.177 -3.647 . . . . 0.0 115.987 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.01 -46.49 74.34 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 127.637 3.085 . . . . 0.0 113.456 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.77 -9.91 27.86 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 128.593 3.683 . . . . 0.0 108.176 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t0 38.75 93.78 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.436 1 CA-C-O 129.296 4.379 . . . . 0.0 112.078 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.497 ' CG2' ' CG ' ' A' ' 21' ' ' MET . 14.0 tt -105.3 39.38 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 108.684 -3.871 . . . . 0.0 108.525 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.4 t70 81.83 144.77 0.08 Allowed 'General case' 0 C--N 1.352 0.676 0 CA-C-O 116.485 -1.722 . . . . 0.0 108.658 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -96.71 155.57 16.72 Favored 'General case' 0 C--O 1.204 -1.301 1 O-C-N 129.389 4.181 . . . . 0.0 115.746 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.3 77.84 0.29 Allowed 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 111.951 -2.386 . . . . 0.0 105.268 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.6 m -137.62 -61.07 0.64 Allowed 'General case' 0 C--N 1.354 0.791 2 CA-C-N 105.502 -5.317 . . . . 0.0 116.135 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -69.98 -155.05 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.986 0 O-C-N 128.419 3.574 . . . . 0.0 114.423 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.401 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.1 OUTLIER 89.33 -2.77 0.38 Allowed 'General case' 0 C--O 1.204 -1.34 1 O-C-N 130.502 4.876 . . . . 0.0 111.293 -179.722 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -149.92 35.92 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.671 0 CA-C-N 110.436 -3.075 . . . . 0.0 109.033 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.54 ' HB3' ' CE2' ' A' ' 58' ' ' PHE . . . -141.6 35.32 1.63 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 126.025 2.822 . . . . 0.0 108.573 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -53.71 -34.27 24.31 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.457 0 CA-C-N 110.564 -3.017 . . . . 0.0 110.327 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.423 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 16.1 ttp85 158.0 131.52 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.35 1 CA-C-N 107.488 -4.414 . . . . 0.0 111.584 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.632 ' CD2' ' CE2' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -130.44 83.9 2.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.543 -3.026 . . . . 0.0 105.65 -179.253 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 m 70.14 -21.07 0.18 Allowed 'General case' 0 C--N 1.317 -0.814 1 O-C-N 134.123 7.139 . . . . 0.0 117.436 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -13.74 92.18 0.01 OUTLIER 'General case' 0 CA--C 1.492 -1.251 0 O-C-N 127.773 3.171 . . . . 0.0 118.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -99.58 101.81 13.13 Favored 'General case' 0 C--O 1.203 -1.375 1 O-C-N 133.443 6.714 . . . . 0.0 109.182 179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.57 131.64 35.28 Favored 'General case' 0 N--CA 1.485 1.291 1 O-C-N 129.152 4.033 . . . . 0.0 109.6 -179.353 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.441 ' HB ' ' HE2' ' A' ' 53' ' ' LYS . 8.1 mt -117.82 158.67 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 127.19 2.806 . . . . 0.0 109.814 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.437 HG23 ' N ' ' A' ' 7' ' ' GLY 0.28 0.0 OUTLIER -140.17 146.95 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.444 1 O-C-N 129.123 4.014 . . . . 0.0 109.117 -179.752 . . . . . . . . 5 4 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.454 ' N ' ' O ' ' A' ' 51' ' ' LYS . 79.6 t -153.14 85.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.1 0 CA-C-N 113.204 -1.816 . . . . 0.0 108.299 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.411 ' HB3' ' HA ' ' A' ' 5' ' ' GLN . 0.3 OUTLIER -103.18 117.37 34.38 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 126.605 2.441 . . . . 0.0 113.367 -179.282 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -151.48 106.69 3.31 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 111.249 -2.705 . . . . 0.0 116.848 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 33.97 100.79 0.01 OUTLIER Glycine 0 C--O 1.22 -0.768 0 O-C-N 126.951 2.657 . . . . 0.0 117.913 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.7 t0 78.94 -59.04 0.41 Allowed 'General case' 0 N--CA 1.441 -0.888 0 O-C-N 125.951 1.618 . . . . 0.0 115.087 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.08 116.83 29.27 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 125.067 1.347 . . . . 0.0 112.818 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.49 ' CD1' ' C ' ' A' ' 50' ' ' PHE . 8.4 t80 -121.16 119.9 33.69 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 127.271 2.857 . . . . 0.0 117.096 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.472 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -134.32 152.61 51.91 Favored 'General case' 0 C--O 1.193 -1.914 0 O-C-N 128.412 3.57 . . . . 0.0 112.169 179.561 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.451 ' CG2' ' N ' ' A' ' 53' ' ' LYS . 0.3 OUTLIER -133.33 174.09 10.77 Favored 'General case' 0 CA--C 1.508 -0.635 2 O-C-N 129.914 4.509 . . . . 0.0 106.816 179.645 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.451 ' N ' ' CG2' ' A' ' 52' ' ' THR . 0.1 OUTLIER -177.22 142.61 0.36 Allowed 'General case' 0 CA--C 1.482 -1.636 0 O-C-N 128.442 3.589 . . . . 0.0 109.893 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.5 t -92.03 158.97 15.94 Favored 'General case' 0 CA--C 1.51 -0.565 0 O-C-N 127.917 3.26 . . . . 0.0 111.738 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -131.18 33.53 4.12 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 113.834 -1.53 . . . . 0.0 114.521 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.4 t -72.97 159.41 33.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 126.476 2.36 . . . . 0.0 108.2 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.5 m -70.8 -36.09 72.82 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 110.617 -2.992 . . . . 0.0 105.409 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.632 ' CE2' ' CD2' ' A' ' 37' ' ' LEU . 5.4 m-85 -66.8 -62.42 1.45 Allowed 'General case' 0 C--N 1.361 1.082 0 CA-C-N 112.698 -2.046 . . . . 0.0 111.321 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -139.37 174.99 9.95 Favored 'General case' 0 C--N 1.361 1.099 2 CA-C-N 107.049 -4.614 . . . . 0.0 114.625 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -146.11 39.88 1.12 Allowed 'General case' 0 C--O 1.203 -1.381 2 O-C-N 130.596 4.935 . . . . 0.0 111.03 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -64.02 176.95 0.86 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 126.664 2.477 . . . . 0.0 109.089 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -146.19 146.22 30.73 Favored 'General case' 0 C--O 1.199 -1.597 0 O-C-N 128.207 3.442 . . . . 0.0 116.769 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.516 HD13 ' CE1' ' A' ' 65' ' ' PHE . 14.0 tp -92.24 47.44 1.33 Allowed 'General case' 0 C--N 1.361 1.073 0 CA-C-N 111.644 -2.526 . . . . 0.0 111.283 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 -60.92 93.37 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.516 ' CE1' HD13 ' A' ' 63' ' ' LEU . 1.6 m-30 -121.12 -178.09 3.67 Favored 'General case' 0 CA--C 1.491 -1.291 0 CA-C-O 126.962 3.268 . . . . 0.0 110.647 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -164.32 148.83 9.8 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 109.995 -3.275 . . . . 0.0 104.446 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.0 p -68.81 133.16 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.202 0 O-C-N 127.276 2.86 . . . . 0.0 113.698 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.32 40.13 84.29 Favored Glycine 0 N--CA 1.483 1.8 0 CA-C-N 109.984 -3.28 . . . . 0.0 115.789 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.419 HG11 ' N ' ' A' ' 70' ' ' GLU . 0.7 OUTLIER -85.71 -14.97 10.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 C-N-CA 117.761 -1.575 . . . . 0.0 108.873 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.419 ' N ' HG11 ' A' ' 69' ' ' VAL . 15.1 tt0 53.66 64.96 1.65 Allowed 'General case' 0 C--O 1.217 -0.612 1 O-C-N 131.981 5.8 . . . . 0.0 108.463 -179.486 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -54.81 137.86 43.89 Favored 'General case' 0 CA--C 1.499 -1.018 1 O-C-N 129.879 4.487 . . . . 0.0 114.779 -178.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -102.4 71.0 1.19 Allowed 'General case' 0 C--O 1.202 -1.439 0 O-C-N 125.547 1.78 . . . . 0.0 108.032 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -53.64 130.59 36.83 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 125.161 2.41 . . . . 0.0 111.351 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -142.83 38.19 1.46 Allowed 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 110.675 -2.966 . . . . 0.0 112.028 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.442 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -38.61 160.68 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.733 0 CA-C-N 111.232 -2.713 . . . . 0.0 116.315 -179.96 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.442 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.6 135.83 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 126.796 3.189 . . . . 0.0 112.447 179.469 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.85 -12.61 14.92 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 111.252 -2.704 . . . . 0.0 106.84 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.413 ' HA ' HD13 ' A' ' 26' ' ' ILE . 3.5 tp -117.31 -61.36 1.72 Allowed 'General case' 0 C--N 1.352 0.677 0 CA-C-N 108.993 -3.603 . . . . 0.0 116.583 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -123.19 -53.89 1.81 Allowed 'General case' 0 C--O 1.214 -0.801 0 CA-C-O 123.226 1.489 . . . . 0.0 112.793 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.48 79.08 0.79 Allowed Glycine 0 C--O 1.207 -1.591 0 CA-C-O 125.191 2.551 . . . . 0.0 111.425 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.439 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 2.6 tpt180 -144.36 -101.34 0.11 Allowed 'General case' 0 N--CA 1.486 1.372 1 CA-C-N 107.513 -4.344 . . . . 0.0 113.875 -179.877 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.439 ' N ' ' HG3' ' A' ' 81' ' ' ARG . 0.5 OUTLIER 153.76 120.7 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 O-C-N 127.147 2.78 . . . . 0.0 108.368 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 2.1 t -141.97 178.22 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 0 O-C-N 127.717 3.136 . . . . 0.0 113.266 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt -119.87 95.6 4.83 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 127.038 2.711 . . . . 0.0 110.701 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.1 m -91.54 81.06 5.37 Favored 'General case' 0 C--O 1.195 -1.785 0 O-C-N 126.34 2.275 . . . . 0.0 115.244 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.84 148.36 49.17 Favored 'General case' 0 N--CA 1.433 -1.319 2 CA-C-N 106.525 -4.852 . . . . 0.0 110.849 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.506 HG22 ' CD2' ' A' ' 65' ' ' PHE . 38.7 t -131.48 143.95 38.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 124.766 1.226 . . . . 0.0 110.731 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -164.93 174.06 10.95 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.085 -1.871 . . . . 0.0 111.853 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.695 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 68.9 m95 -98.35 150.0 22.05 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 114.625 -2.607 . . . . 0.0 110.317 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.455 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.6 OUTLIER -96.43 -8.28 32.73 Favored 'General case' 0 C--O 1.206 -1.231 1 CA-C-O 131.808 5.575 . . . . 0.0 112.911 179.665 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.32 -18.15 8.89 Favored Glycine 0 C--O 1.211 -1.283 2 CA-C-N 107.7 -4.318 . . . . 0.0 102.846 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -171.27 75.39 0.06 Allowed 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 128.919 2.888 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 90' ' ' GLU . 6.4 t 132.92 154.88 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.716 3.206 . . . . 0.0 118.365 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.419 ' N ' ' OG1' ' A' ' 93' ' ' THR . 1.1 tp -81.65 105.6 12.92 Favored 'General case' 0 CA--C 1.493 -1.23 0 O-C-N 127.315 2.885 . . . . 0.0 114.868 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.296 88.8 t -107.43 110.62 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 111.589 -2.55 . . . . 0.0 111.771 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.506 ' HB2' ' CH2' ' A' ' 107' ' ' TRP . 33.0 m -130.41 144.34 51.33 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.74 118.18 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.069 0 CA-C-N 112.333 -2.212 . . . . 0.0 116.765 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.481 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 1.4 mt-30 -84.78 93.1 8.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 125.651 2.643 . . . . 0.0 109.009 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -86.33 123.11 31.21 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-N 107.485 -4.416 . . . . 0.0 109.016 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -131.83 -85.6 0.32 Allowed Glycine 0 C--O 1.202 -1.885 0 CA-C-O 126.415 3.23 . . . . 0.0 108.271 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.413 ' HG2' ' N ' ' A' ' 102' ' ' LYS . 43.7 tt0 -149.97 -78.42 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 1 CA-C-N 107.752 -4.224 . . . . 0.0 112.951 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.413 ' N ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -94.71 -9.22 35.44 Favored 'General case' 0 C--O 1.206 -1.224 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -97.51 152.99 18.44 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -140.64 83.35 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 2 O-C-N 132.437 6.085 . . . . 0.0 101.906 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.481 ' HB2' ' CG ' ' A' ' 98' ' ' GLN . 16.7 mmm-85 -88.69 12.33 15.13 Favored 'General case' 0 C--O 1.22 -0.492 0 O-C-N 126.947 2.655 . . . . 0.0 115.284 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.53 109.37 1.74 Allowed Glycine 0 CA--C 1.541 1.702 1 O-C-N 130.533 4.895 . . . . 0.0 116.38 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.506 ' CH2' ' HB2' ' A' ' 96' ' ' CYS . 6.9 p90 -95.65 3.44 53.98 Favored 'General case' 0 N--CA 1.427 -1.623 2 O-C-N 134.858 6.858 . . . . 0.0 114.285 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -20.9 141.21 0.0 OUTLIER 'General case' 0 C--N 1.363 1.154 1 O-C-N 130.483 4.865 . . . . 0.0 115.886 -178.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -107.46 167.96 9.57 Favored 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.566 -2.561 . . . . 0.0 110.531 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.43 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.7 OUTLIER -173.94 61.9 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.02 1 O-C-N 130.736 5.022 . . . . 0.0 116.889 179.04 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 99.9 t -22.53 94.1 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.634 0 O-C-N 126.672 2.483 . . . . 0.0 114.335 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -90.19 16.25 8.88 Favored 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 124.71 2.195 . . . . 0.0 115.341 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.74 122.6 4.02 Favored Glycine 0 C--O 1.197 -2.175 0 CA-C-N 113.908 -1.496 . . . . 0.0 114.378 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 63.23 6.09 2.23 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 119.216 3.043 . . . . 0.0 119.216 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.488 ' HE2' ' CE1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -167.97 -153.95 0.14 Allowed 'General case' 0 CA--C 1.496 -1.106 1 O-C-N 129.539 4.274 . . . . 0.0 110.977 179.931 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.402 ' O ' ' N ' ' A' ' 118' ' ' LEU . 0.0 OUTLIER -162.78 110.48 1.28 Allowed 'General case' 0 CA--C 1.478 -1.805 0 C-N-CA 113.556 -3.258 . . . . 0.0 112.886 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.488 ' CE1' ' HE2' ' A' ' 115' ' ' LYS . 83.0 m-85 -66.48 80.52 0.1 Allowed 'General case' 0 C--N 1.351 0.66 1 CA-C-N 108.023 -4.171 . . . . 0.0 117.227 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 116' ' ' LEU . 1.3 tt -67.04 105.58 1.7 Allowed 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 111.716 -2.493 . . . . 0.0 104.82 178.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.43 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 0.6 OUTLIER -109.92 115.72 30.32 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 116.416 -1.754 . . . . 0.0 109.15 -178.006 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.89 138.77 54.27 Favored 'General case' 0 CA--C 1.504 -0.816 1 O-C-N 130.386 4.804 . . . . 0.0 113.912 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 80.5 m -110.63 162.53 14.64 Favored 'General case' 0 C--O 1.2 -1.55 0 CA-C-N 108.642 -3.89 . . . . 0.0 105.651 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.92 54.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 127.051 3.31 . . . . 0.0 112.394 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 94.88 -43.56 2.27 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 109.813 -3.358 . . . . 0.0 114.156 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -141.28 -52.7 0.45 Allowed 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 113.412 -1.394 . . . . 0.0 110.279 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -67.01 148.19 52.26 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 126.919 2.637 . . . . 0.0 107.136 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.1 m -132.7 77.05 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.875 1 O-C-N 129.321 4.138 . . . . 0.0 111.973 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.76 142.81 58.27 Favored 'General case' 0 CA--C 1.497 -1.074 0 CA-C-N 114.59 -1.187 . . . . 0.0 112.133 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -125.47 115.14 19.78 Favored 'General case' 0 CA--C 1.506 -0.724 0 O-C-N 125.515 1.759 . . . . 0.0 115.107 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -99.46 167.42 10.63 Favored 'General case' 0 N--CA 1.487 1.379 1 O-C-N 129.118 4.012 . . . . 0.0 110.416 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.3 -46.14 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 119.595 1.089 . . . . 0.0 111.776 -178.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.458 ' CZ ' ' HE1' ' A' ' 11' ' ' MET . 7.3 m-85 66.3 174.68 0.24 Allowed 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 128.955 2.902 . . . . 0.0 116.549 -179.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -157.11 118.34 3.68 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.601 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 21.2 ttpt -61.6 125.82 25.18 Favored 'General case' 0 C--O 1.207 -1.16 0 CA-C-O 116.231 -1.843 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt . . . . . 0 C--O 1.265 1.901 0 O-C-N 128.931 3.894 . . . . 0.0 118.864 -179.461 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.374 0 N-CA-C 105.794 -1.928 . . . . 0.0 105.794 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.0 m -64.17 -44.29 92.5 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.529 ' HB3' ' CH2' ' A' ' 89' ' ' TRP . 5.7 mttt -129.44 -29.02 2.24 Favored 'General case' 0 C--N 1.361 1.104 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.55 120.96 32.08 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -134.8 30.49 3.4 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 113.506 -3.14 . . . . 0.0 108.742 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.5 115.81 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 129.024 3.952 . . . . 0.0 112.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -153.38 -123.5 0.95 Allowed Glycine 0 C--O 1.203 -1.807 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.885 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.491 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER 179.53 148.95 0.28 Allowed 'General case' 0 N--CA 1.475 0.806 1 O-C-N 132.616 5.539 . . . . 0.0 107.686 -179.907 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.552 ' CZ3' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -156.93 106.2 2.22 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 128.932 3.895 . . . . 0.0 116.463 -179.726 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -38.74 -39.14 0.47 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 85.53 34.64 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 113.946 -2.93 . . . . 0.0 107.099 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 20.4 -75.94 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.973 1 O-C-N 130.845 5.091 . . . . 0.0 110.552 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -149.74 160.77 43.27 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 111.649 -2.523 . . . . 0.0 110.662 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -116.47 114.02 23.64 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 110.844 -2.889 . . . . 0.0 117.051 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -47.0 83.87 Favored 'General case' 0 CA--C 1.504 -0.806 1 O-C-N 130.085 4.616 . . . . 0.0 113.269 -179.766 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -128.76 95.93 4.24 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 112.362 -2.199 . . . . 0.0 114.739 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.475 ' CD2' ' N ' ' A' ' 18' ' ' GLU . 2.2 t80 -100.31 -57.1 2.19 Favored 'General case' 0 CA--C 1.489 -1.383 0 CA-C-O 127.12 3.343 . . . . 0.0 108.395 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.475 ' N ' ' CD2' ' A' ' 17' ' ' PHE . 0.2 OUTLIER -65.05 -52.9 53.17 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 118.966 -2.333 . . . . 0.0 114.717 179.814 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.459 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -62.33 -25.14 66.36 Favored Glycine 0 N--CA 1.48 1.607 1 O-C-N 130.09 4.619 . . . . 0.0 111.63 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.406 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -66.98 -43.74 82.27 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-O 125.148 2.404 . . . . 0.0 108.221 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 mtp -72.05 -23.85 61.44 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-N 113.673 -1.603 . . . . 0.0 112.877 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.459 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 2.2 ttpt -76.21 -27.61 56.91 Favored 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 109.568 -3.469 . . . . 0.0 111.819 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.35 66.73 Favored 'General case' 0 C--N 1.318 -0.804 1 O-C-N 130.099 4.624 . . . . 0.0 112.089 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.79 -11.07 49.07 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 127.421 2.951 . . . . 0.0 104.372 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.3 t0 45.71 80.63 0.04 OUTLIER 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.137 3.827 . . . . 0.0 109.128 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 14.1 tt -82.7 -15.8 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 1 CA-C-N 108.065 -4.152 . . . . 0.0 109.772 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.442 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 1.3 t0 -173.38 -179.26 1.86 Allowed 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 117.523 -1.671 . . . . 0.0 112.289 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -119.25 86.5 2.56 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 62.5 49.88 3.85 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 126.959 2.662 . . . . 0.0 109.297 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.442 ' HB ' ' HB3' ' A' ' 27' ' ' ASP . 1.7 t -88.67 -26.59 21.76 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 108.571 -3.922 . . . . 0.0 113.186 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.413 ' N ' HG21 ' A' ' 30' ' ' THR . 0.1 OUTLIER -68.84 -138.24 0.01 OUTLIER 'General case' 0 C--O 1.242 0.697 1 O-C-N 130.127 4.642 . . . . 0.0 108.435 179.953 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 84.35 4.38 0.71 Allowed 'General case' 0 CA--C 1.497 -1.077 0 O-C-N 128.82 3.825 . . . . 0.0 113.291 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.43 -21.92 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.928 0 CA-C-N 110.111 -3.222 . . . . 0.0 114.426 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.507 ' HA ' ' CD2' ' A' ' 37' ' ' LEU . . . -90.49 11.34 22.04 Favored 'General case' 0 C--O 1.206 -1.217 0 CA-C-O 123.386 1.565 . . . . 0.0 112.365 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.5 t -44.73 -40.04 1.93 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-O 123.758 1.742 . . . . 0.0 109.931 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 169.34 117.78 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 109.337 -3.574 . . . . 0.0 115.399 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.507 ' CD2' ' HA ' ' A' ' 34' ' ' ALA . 0.4 OUTLIER -147.86 53.76 1.04 Allowed 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 110.704 -2.953 . . . . 0.0 104.972 179.53 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.1 m 68.87 139.94 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.243 1 O-C-N 135.106 7.754 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -125.78 -65.89 0.97 Allowed 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 117.296 2.332 . . . . 0.0 117.296 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.9 m 56.48 108.49 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.622 1 O-C-N 131.971 5.795 . . . . 0.0 111.628 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.7 149.05 23.23 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 127.988 3.305 . . . . 0.0 103.373 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.434 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 5.1 mt -137.43 156.24 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 1 O-C-N 129.189 4.056 . . . . 0.0 110.29 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.434 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.32 6.6 tt -130.36 131.51 65.35 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 O-C-N 126.905 2.628 . . . . 0.0 108.257 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.271 72.4 t -137.58 125.98 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 113.412 -1.722 . . . . 0.0 110.312 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -132.67 88.66 2.55 Favored 'General case' 0 CA--C 1.489 -1.371 0 N-CA-C 118.979 2.955 . . . . 0.0 118.979 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -68.0 -54.78 15.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 C-N-CA 114.266 -2.973 . . . . 0.0 115.018 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.54 105.47 0.2 Allowed Glycine 0 C--O 1.205 -1.719 0 O-C-N 121.169 -0.957 . . . . 0.0 112.489 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 63.41 19.27 11.59 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 119.011 -1.075 . . . . 0.0 110.52 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -130.48 154.3 47.9 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 128.144 3.403 . . . . 0.0 108.399 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.527 ' CD1' HD12 ' A' ' 94' ' ' LEU . 51.1 t80 -155.02 99.92 2.15 Favored 'General case' 0 CA--C 1.484 -1.593 1 O-C-N 129.983 4.552 . . . . 0.0 112.932 -179.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -120.12 75.72 1.12 Allowed 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 126.508 2.38 . . . . 0.0 112.546 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.472 ' O ' ' N ' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -57.68 145.65 33.55 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 128.857 3.848 . . . . 0.0 106.04 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.446 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 4.2 ptmm? -145.26 152.57 40.17 Favored 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 115.396 -2.522 . . . . 0.0 111.397 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.469 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 4.1 t -106.43 155.16 19.85 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 124.934 2.302 . . . . 0.0 112.153 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -130.15 52.21 2.03 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 111.543 -2.571 . . . . 0.0 110.302 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.401 ' HB2' ' CD1' ' A' ' 58' ' ' PHE . 10.5 p -69.12 -99.69 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.078 1 O-C-N 129.332 4.145 . . . . 0.0 112.33 -179.813 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 153.81 -34.05 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 O-C-N 127.281 2.863 . . . . 0.0 104.27 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.487 ' CD2' ' HB3' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -82.39 -60.88 2.05 Favored 'General case' 0 C--N 1.368 1.37 0 O-C-N 128.579 3.674 . . . . 0.0 112.111 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.3 98.41 3.43 Favored 'General case' 0 C--O 1.216 -0.704 2 CA-C-N 107.479 -4.418 . . . . 0.0 113.869 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.469 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 54.3 m-20 -82.99 65.95 8.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 109.556 -3.475 . . . . 0.0 110.507 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -96.72 80.68 3.09 Favored 'General case' 0 CA--C 1.503 -0.862 0 O-C-N 127.058 2.724 . . . . 0.0 109.052 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 5.7 p-10 -79.72 132.63 36.24 Favored 'General case' 0 C--O 1.2 -1.507 1 O-C-N 129.685 4.366 . . . . 0.0 116.423 -179.605 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.538 ' HG ' ' CZ ' ' A' ' 65' ' ' PHE . 3.2 tp -52.86 118.05 3.4 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 128.537 3.648 . . . . 0.0 109.563 177.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -135.46 84.69 2.11 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 116.766 -1.974 . . . . 0.0 111.639 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.538 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 6.5 p90 -171.62 145.07 1.96 Allowed 'General case' 0 N--CA 1.474 0.749 1 CA-C-O 128.939 4.209 . . . . 0.0 111.228 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.406 HG21 ' N ' ' A' ' 67' ' ' VAL . 0.7 OUTLIER -76.86 163.34 26.86 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 110.867 -2.879 . . . . 0.0 106.468 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.522 HG22 ' CD1' ' A' ' 89' ' ' TRP . 9.3 p -77.75 142.28 14.39 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.787 0 O-C-N 128.652 3.72 . . . . 0.0 112.127 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 59.17 14.58 26.11 Favored Glycine 0 N--CA 1.484 1.894 0 C-N-CA 116.217 -2.897 . . . . 0.0 117.323 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -83.63 -18.62 10.04 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.351 0 C-N-CA 118.062 -1.455 . . . . 0.0 107.819 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 74.33 130.72 0.04 OUTLIER 'General case' 0 C--N 1.349 0.584 1 O-C-N 131.488 5.493 . . . . 0.0 109.536 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.423 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.5 t80 -107.74 29.12 7.52 Favored 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.647 3.092 . . . . 0.0 110.62 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -14.23 84.41 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.976 0 O-C-N 127.34 2.9 . . . . 0.0 115.585 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.433 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 3.0 mp0 59.62 173.23 0.08 Allowed 'General case' 0 C--O 1.209 -1.04 1 CA-C-O 129.128 4.299 . . . . 0.0 111.965 -179.345 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.509 ' N ' ' ND1' ' A' ' 74' ' ' HIS . 1.6 m-70 69.98 78.18 0.2 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-N 110.035 -3.257 . . . . 0.0 114.284 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 76.3 p -85.1 -82.32 0.18 Allowed 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 112.868 -1.969 . . . . 0.0 112.015 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.0 mtmt 60.96 168.98 0.09 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 126.215 2.912 . . . . 0.0 115.542 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.18 19.72 77.55 Favored Glycine 0 C--O 1.207 -1.565 0 CA-C-N 111.239 -2.709 . . . . 0.0 109.921 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.1 tp -172.1 -44.39 0.02 OUTLIER 'General case' 0 CA--C 1.505 -0.756 1 O-C-N 130.74 4.435 . . . . 0.0 113.399 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.18 -70.21 0.57 Allowed 'General case' 0 CA--C 1.5 -0.948 0 CA-C-O 124.119 1.914 . . . . 0.0 113.011 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.76 87.88 1.21 Allowed Glycine 0 N--CA 1.476 1.332 0 CA-C-N 113.722 -1.581 . . . . 0.0 111.114 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.4 mmt-85 -144.44 178.96 7.57 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 127.084 2.284 . . . . 0.0 109.5 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 63.6 m-20 -120.47 75.07 1.09 Allowed 'General case' 0 CA--C 1.501 -0.934 0 O-C-N 124.901 1.376 . . . . 0.0 110.714 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.4 HG11 ' N ' ' A' ' 99' ' ' LYS . 17.5 t -113.47 139.15 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 O-C-N 128.815 3.822 . . . . 0.0 111.421 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.442 ' HE3' ' HE3' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -32.35 -69.34 0.08 Allowed 'General case' 0 CA--C 1.504 -0.794 1 O-C-N 131.864 5.727 . . . . 0.0 112.87 -179.856 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 62.4 m 62.65 68.47 0.65 Allowed 'General case' 0 C--O 1.199 -1.573 0 C-N-CA 127.432 2.293 . . . . 0.0 110.585 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.401 HD21 HG21 ' A' ' 97' ' ' VAL . 4.0 tt -91.3 112.82 24.89 Favored 'General case' 0 N--CA 1.429 -1.514 2 O-C-N 131.502 5.501 . . . . 0.0 116.425 -179.429 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.52 HG22 ' CD1' ' A' ' 65' ' ' PHE . 38.4 t -92.88 151.25 3.65 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 CA-C-O 122.764 1.268 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.451 ' HA ' ' CG2' ' A' ' 67' ' ' VAL . 4.0 t -164.3 159.08 19.49 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 112.203 -2.271 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.682 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.252 18.1 m95 -86.49 149.56 24.89 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 114.083 -2.865 . . . . 0.0 105.171 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.492 ' CB ' HG23 ' A' ' 93' ' ' THR . 2.8 tm-20 -96.82 -47.06 6.01 Favored 'General case' 0 C--O 1.195 -1.786 1 CA-C-O 128.949 4.214 . . . . 0.0 111.974 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -179.76 -49.72 0.08 OUTLIER Glycine 0 C--O 1.197 -2.179 1 CA-C-N 107.669 -4.332 . . . . 0.0 103.899 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -141.54 29.03 1.78 Allowed 'General case' 0 N--CA 1.447 -0.613 1 O-C-N 133.118 5.834 . . . . 0.0 111.344 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.492 HG23 ' CB ' ' A' ' 90' ' ' GLU . 1.5 t -162.42 160.91 26.94 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.527 HD12 ' CD1' ' A' ' 50' ' ' PHE . 3.4 tt -93.51 112.48 24.38 Favored 'General case' 0 CA--C 1.487 -1.479 0 O-C-N 127.951 3.282 . . . . 0.0 114.679 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.352 52.9 t -116.83 134.91 58.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 111.726 -2.488 . . . . 0.0 114.552 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 34.4 t -137.18 140.92 42.1 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.401 HG21 HD21 ' A' ' 86' ' ' LEU . 6.1 m -128.93 101.34 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 1 CA-C-O 128.635 4.064 . . . . 0.0 118.949 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . 0.302 4.0 mm100 -71.9 111.01 6.8 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-N 110.185 -3.189 . . . . 0.0 107.464 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.442 ' HE3' ' HE3' ' A' ' 84' ' ' LYS . 3.3 ttmt -37.3 -46.03 0.72 Allowed 'General case' 0 C--O 1.195 -1.81 1 O-C-N 129.579 4.299 . . . . 0.0 111.014 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.89 -86.63 0.42 Allowed Glycine 0 C--O 1.203 -1.833 0 CA-C-O 125.925 2.958 . . . . 0.0 113.37 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.78 16.18 7.88 Favored 'General case' 0 CA--C 1.497 -1.095 1 CA-C-N 106.421 -4.889 . . . . 0.0 109.423 -179.633 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 155.53 -33.83 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 125.852 2.739 . . . . 0.0 113.516 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.404 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 2.7 mt-10 -104.99 178.73 4.48 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 110.037 -3.256 . . . . 0.0 117.301 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.425 ' HB3' HG23 ' A' ' 121' ' ' THR 0.251 7.7 m-20 -144.94 79.9 1.61 Allowed 'General case' 0 N--CA 1.489 1.49 2 CA-C-N 106.535 -4.848 . . . . 0.0 101.732 179.447 . . . . . . . . 4 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 2.5 tpt180 -101.21 -3.3 29.3 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 126.376 2.989 . . . . 0.0 114.172 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -52.15 103.53 0.12 Allowed Glycine 0 N--CA 1.426 -1.968 1 CA-C-N 107.271 -4.513 . . . . 0.0 118.724 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.41 ' CD1' ' C ' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -97.16 146.46 25.04 Favored 'General case' 0 C--O 1.214 -0.778 0 O-C-N 129.299 3.588 . . . . 0.0 110.283 178.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.525 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -163.08 177.19 9.35 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 128.747 3.779 . . . . 0.0 113.097 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -143.12 173.37 11.63 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 116.26 -2.176 . . . . 0.0 108.324 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.525 ' CH2' ' HG3' ' A' ' 108' ' ' LYS 0.29 0.0 OUTLIER -159.23 24.77 0.2 Allowed 'General case' 0 CA--C 1.501 -0.912 1 O-C-N 129.623 4.327 . . . . 0.0 117.542 179.551 . . . . . . . . 5 4 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 32.0 t 23.68 78.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 CA-C-O 127.973 3.749 . . . . 0.0 117.432 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -90.13 57.73 3.86 Favored 'General case' 0 CA--C 1.484 -1.562 0 O-C-N 118.753 -2.467 . . . . 0.0 112.441 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.09 -126.23 7.37 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 111.685 -2.507 . . . . 0.0 111.424 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -106.69 39.49 1.83 Allowed 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 113.875 -1.162 . . . . 0.0 113.139 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.404 ' HB2' ' C ' ' A' ' 131' ' ' PHE . 13.9 pttt -170.48 142.3 2.08 Favored 'General case' 0 C--N 1.316 -0.867 1 O-C-N 130.104 4.627 . . . . 0.0 105.836 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.408 ' O ' ' CD1' ' A' ' 131' ' ' PHE . 3.7 pp -115.49 133.89 55.6 Favored 'General case' 0 C--O 1.194 -1.855 0 O-C-N 128.093 3.371 . . . . 0.0 111.202 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.428 ' O ' ' N ' ' A' ' 119' ' ' GLU . 2.9 m-85 -77.7 92.81 4.18 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 109.441 -3.527 . . . . 0.0 114.364 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.491 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -74.73 76.88 2.07 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 109.096 -3.684 . . . . 0.0 106.197 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 117' ' ' TYR . 40.8 mt-10 -85.29 101.86 12.89 Favored 'General case' 0 CA--C 1.485 -1.539 0 O-C-N 129.094 3.996 . . . . 0.0 110.682 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.44 154.67 33.35 Favored 'General case' 0 CA--C 1.487 -1.472 1 O-C-N 129.311 4.132 . . . . 0.0 111.686 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.425 HG23 ' HB3' ' A' ' 104' ' ' ASN . 4.0 m -111.89 160.01 17.81 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 110.458 -3.065 . . . . 0.0 105.738 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 3.3 m -151.85 33.85 0.54 Allowed 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.541 1.064 . . . . 0.0 111.647 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.71 -41.26 2.25 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 22.6 t70 172.12 91.45 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.295 0 C-N-CA 125.941 1.697 . . . . 0.0 108.609 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -167.78 -53.47 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 111.067 -2.788 . . . . 0.0 105.435 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.1 t 58.26 54.22 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.686 1 O-C-N 130.14 4.65 . . . . 0.0 113.716 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 49.6 t -42.11 124.69 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 124.663 1.227 . . . . 0.0 110.193 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.48 92.89 4.31 Favored 'General case' 0 CA--C 1.486 -1.506 0 CA-C-N 113.732 -1.576 . . . . 0.0 114.043 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -74.17 157.21 36.35 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 114.919 -2.712 . . . . 0.0 113.658 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 52.0 t -142.51 86.97 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 CA-C-O 125.066 2.365 . . . . 0.0 108.068 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.526 ' CE2' ' HB2' ' A' ' 9' ' ' TRP 0.266 6.2 m-85 -72.2 -179.33 2.8 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 109.583 -3.462 . . . . 0.0 116.335 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.67 120.95 0.93 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 109.118 -3.673 . . . . 0.0 103.607 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.552 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 3.2 ttpm? -70.72 90.37 0.77 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 112.111 -2.313 . . . . 0.0 115.048 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt . . . . . 0 CA--C 1.482 -1.664 0 CA-C-O 114.149 -2.834 . . . . 0.0 118.186 179.615 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 mtt . . . . . 0 N--CA 1.51 2.57 0 CA-C-O 123.112 1.434 . . . . 0.0 108.492 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.9 -164.68 1.99 Allowed 'General case' 0 C--O 1.206 -1.215 0 CA-C-N 112.919 -1.946 . . . . 0.0 108.353 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.4 43.81 0.84 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 115.834 -2.346 . . . . 0.0 116.196 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -106.82 97.94 7.66 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -92.76 -124.42 0.09 Allowed 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 115.354 -2.26 . . . . 0.0 107.261 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 71.52 100.02 0.07 Allowed 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 130.329 3.452 . . . . 0.0 112.542 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.27 -130.44 1.18 Allowed Glycine 0 CA--C 1.534 1.242 0 CA-C-O 114.789 -3.228 . . . . 0.0 113.759 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.534 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -169.6 147.35 3.5 Favored 'General case' 0 C--O 1.214 -0.811 1 O-C-N 133.59 6.112 . . . . 0.0 104.519 -179.892 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.534 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -148.24 109.42 4.32 Favored 'General case' 0 CA--C 1.494 -1.176 1 O-C-N 130.941 5.151 . . . . 0.0 114.78 -179.894 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -78.41 119.99 22.51 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 127.4 2.937 . . . . 0.0 111.576 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.477 ' CE ' ' HB3' ' A' ' 14' ' ' ASN . 3.4 ttp -57.54 96.05 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 O-C-N 126.243 2.215 . . . . 0.0 106.53 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.59 -14.23 40.3 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 130.207 3.403 . . . . 0.0 111.688 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.8 158.29 3.22 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.609 -1.632 . . . . 0.0 113.262 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.477 ' HB3' ' CE ' ' A' ' 11' ' ' MET . 14.1 p-10 -133.86 129.47 36.48 Favored 'General case' 0 CA--C 1.493 -1.228 0 O-C-N 127.947 3.28 . . . . 0.0 111.337 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -101.25 -71.31 0.71 Allowed 'General case' 0 CA--C 1.477 -1.833 1 O-C-N 129.779 4.425 . . . . 0.0 115.247 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.98 -71.07 0.51 Allowed 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 118.845 -2.409 . . . . 0.0 115.697 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 71.73 -72.58 0.11 Allowed 'General case' 0 C--O 1.198 -1.609 0 O-C-N 126.546 2.403 . . . . 0.0 112.156 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.466 ' CB ' ' HB3' ' A' ' 31' ' ' ARG . 0.1 OUTLIER -76.49 -30.44 57.25 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.987 -179.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.47 -22.97 77.89 Favored Glycine 0 N--CA 1.484 1.843 1 O-C-N 130.345 4.778 . . . . 0.0 108.404 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.58 -46.65 53.3 Favored 'General case' 0 C--O 1.194 -1.837 0 CA-C-O 126.006 2.813 . . . . 0.0 108.933 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.429 ' HA ' HD22 ' A' ' 24' ' ' LEU . 1.7 mtt -59.93 -29.5 68.43 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 110.451 -3.068 . . . . 0.0 112.928 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -79.72 -23.93 42.01 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 127.757 3.16 . . . . 0.0 112.008 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.37 -29.09 64.55 Favored 'General case' 0 C--O 1.205 -1.243 1 O-C-N 132.211 5.944 . . . . 0.0 114.419 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.445 HD13 HD11 ' A' ' 26' ' ' ILE . 0.9 OUTLIER -111.06 20.06 17.82 Favored 'General case' 0 CA--C 1.539 0.538 1 O-C-N 129.807 4.442 . . . . 0.0 108.529 179.975 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 20.45 86.75 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.571 1 O-C-N 130.053 4.596 . . . . 0.0 110.279 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.445 HD11 HD13 ' A' ' 24' ' ' LEU . 6.4 tp -98.77 -39.78 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 CA-C-O 127.045 3.307 . . . . 0.0 112.017 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.422 ' N ' HG21 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -171.61 -158.61 0.13 Allowed 'General case' 0 C--N 1.359 0.994 0 O-C-N 119.241 -2.162 . . . . 0.0 109.183 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -143.84 49.14 1.39 Allowed 'General case' 0 C--O 1.207 -1.152 0 O-C-N 121.441 -0.787 . . . . 0.0 112.335 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 152.19 78.98 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.792 0 O-C-N 127.942 3.277 . . . . 0.0 107.699 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.5 m -139.17 22.42 2.59 Favored 'General case' 0 CA--C 1.504 -0.798 2 CA-C-N 106.282 -4.963 . . . . 0.0 113.357 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.466 ' HB3' ' CB ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.44 24.05 10.89 Favored 'General case' 0 CA--C 1.509 -0.603 0 O-C-N 128.186 3.429 . . . . 0.0 113.945 179.744 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.45 15.19 17.93 Favored 'General case' 0 CA--C 1.488 -1.441 0 O-C-N 127.284 2.865 . . . . 0.0 112.464 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -170.04 74.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.362 1.132 1 CA-C-N 107.931 -4.213 . . . . 0.0 109.493 -179.791 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.403 ' O ' ' N ' ' A' ' 36' ' ' ARG . . . 172.32 -38.25 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.182 0 O-C-N 120.367 -1.458 . . . . 0.0 109.079 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 51.1 t -17.95 -47.85 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 O-C-N 128.935 3.897 . . . . 0.0 112.717 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' ALA . 0.0 OUTLIER 159.42 114.68 0.0 OUTLIER 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 108.955 -3.748 . . . . 0.0 113.333 179.515 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.47 ' CD1' ' HB3' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -145.53 85.94 1.73 Allowed 'General case' 0 C--O 1.212 -0.905 1 CA-C-N 108.249 -4.069 . . . . 0.0 107.138 179.722 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.5 m 72.91 47.35 0.21 Allowed 'General case' 0 N--CA 1.485 1.318 1 O-C-N 133.973 7.046 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.418 ' HG2' ' CB ' ' A' ' 11' ' ' MET . 4.0 tt0 -79.52 135.36 36.61 Favored 'General case' 0 CA--C 1.492 -1.257 0 C-N-CA 118.393 -1.323 . . . . 0.0 113.277 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.4 m -152.52 120.47 6.17 Favored 'General case' 0 C--O 1.212 -0.905 0 C-N-CA 130.26 3.424 . . . . 0.0 111.5 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.402 ' HD3' ' C ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -103.62 152.97 21.13 Favored 'General case' 0 N--CA 1.48 1.048 1 O-C-N 129.169 4.043 . . . . 0.0 103.486 179.853 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.459 ' N ' ' O ' ' A' ' 53' ' ' LYS . 3.2 mp -140.0 156.64 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 O-C-N 126.886 2.616 . . . . 0.0 109.71 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.443 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.295 1.4 tt -127.38 138.08 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.495 0 O-C-N 128.217 3.448 . . . . 0.0 109.45 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.8 t -137.14 87.69 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.274 0 CA-C-N 112.038 -2.346 . . . . 0.0 109.704 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -99.61 102.99 14.66 Favored 'General case' 0 C--O 1.21 -0.982 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.86 -14.27 23.32 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 128.012 3.32 . . . . 0.0 112.477 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.69 -96.23 0.18 Allowed Glycine 0 C--O 1.203 -1.795 0 CA-C-O 122.955 1.308 . . . . 0.0 111.208 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -86.36 -13.6 45.98 Favored 'General case' 0 C--O 1.21 -1.002 0 CA-C-N 110.872 -2.664 . . . . 0.0 110.661 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.523 HD21 ' N ' ' A' ' 49' ' ' ASN . 2.4 m-80 -109.69 93.34 4.45 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 128.438 3.586 . . . . 0.0 109.57 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.465 ' CD2' HD11 ' A' ' 94' ' ' LEU . 91.3 t80 -108.15 101.04 10.3 Favored 'General case' 0 CA--C 1.501 -0.926 1 O-C-N 129.66 4.35 . . . . 0.0 115.446 -179.968 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.424 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 30.4 mttt -112.35 85.98 2.26 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 119.022 2.971 . . . . 0.0 119.022 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.413 ' O ' ' N ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -65.25 120.47 12.8 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 128.255 3.472 . . . . 0.0 106.222 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -125.43 150.82 46.94 Favored 'General case' 0 CA--C 1.493 -1.232 0 O-C-N 126.513 2.383 . . . . 0.0 112.31 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -98.14 175.3 6.14 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 125.407 1.692 . . . . 0.0 110.457 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -148.65 35.75 0.78 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.827 -1.988 . . . . 0.0 115.483 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.549 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 9.6 p -73.04 167.86 20.25 Favored 'General case' 0 C--N 1.323 -0.549 1 O-C-N 130.66 4.975 . . . . 0.0 111.927 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.3 m -101.56 -1.84 31.98 Favored 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 128.738 3.774 . . . . 0.0 110.746 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.549 ' CE1' ' HB2' ' A' ' 56' ' ' SER . 0.5 OUTLIER -108.93 -58.95 1.95 Allowed 'General case' 0 C--O 1.218 -0.597 0 O-C-N 123.962 0.789 . . . . 0.0 110.864 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.7 mtt85 -137.8 122.59 18.78 Favored 'General case' 0 C--N 1.357 0.899 1 O-C-N 130.183 4.677 . . . . 0.0 116.186 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.4 99.38 5.81 Favored 'General case' 0 N--CA 1.439 -0.988 1 O-C-N 129.168 4.042 . . . . 0.0 111.209 -179.894 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.58 -67.78 0.92 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 110.177 -3.192 . . . . 0.0 107.653 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.422 ' HB2' ' CB ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER 98.02 176.81 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.364 5.415 . . . . 0.0 110.692 179.963 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.468 HD23 ' CZ2' ' A' ' 107' ' ' TRP . 8.6 tp -113.92 49.91 0.96 Allowed 'General case' 0 N--CA 1.436 -1.155 0 O-C-N 127.183 2.802 . . . . 0.0 112.643 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.424 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 14.9 t70 -59.59 89.37 0.01 OUTLIER 'General case' 0 C--O 1.211 -0.958 0 O-C-N 128.742 3.776 . . . . 0.0 105.923 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.441 ' N ' ' O ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -125.81 -174.1 3.0 Favored 'General case' 0 CA--C 1.495 -1.165 1 CA-C-O 128.994 4.235 . . . . 0.0 110.141 -179.763 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -167.12 122.15 1.07 Allowed 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 109.856 -3.338 . . . . 0.0 106.374 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.522 HG23 ' CD1' ' A' ' 89' ' ' TRP . 3.7 t -36.92 119.9 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.202 -1.412 1 O-C-N 129.638 4.336 . . . . 0.0 115.769 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.32 23.8 70.03 Favored Glycine 0 N--CA 1.487 2.05 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.3 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.09 -32.39 53.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.508 0 CA-C-N 112.162 -2.019 . . . . 0.0 109.939 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 57.03 73.99 0.43 Allowed 'General case' 0 C--N 1.356 0.867 1 O-C-N 130.555 4.909 . . . . 0.0 108.697 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.443 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 2.2 t80 -84.29 122.97 29.65 Favored 'General case' 0 CA--C 1.498 -1.042 1 O-C-N 129.352 4.157 . . . . 0.0 119.225 -179.363 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -91.49 54.71 2.58 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.091 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -21.94 109.01 0.02 OUTLIER 'General case' 0 CA--C 1.483 -1.617 0 CA-C-O 126.051 2.834 . . . . 0.0 113.257 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.82 54.73 0.86 Allowed 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 110.3 -3.137 . . . . 0.0 112.044 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.16 169.95 0.1 Allowed 'General case' 0 C--O 1.201 -1.471 0 CA-C-N 110.809 -2.905 . . . . 0.0 112.316 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 158.89 -32.19 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.807 1 O-C-N 130.036 4.585 . . . . 0.0 115.807 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.59 -21.49 57.89 Favored Glycine 0 C--O 1.218 -0.868 0 CA-C-N 108.441 -3.981 . . . . 0.0 112.843 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . 0.311 5.6 tp -171.32 36.47 0.02 OUTLIER 'General case' 0 CA--C 1.503 -0.849 1 O-C-N 132.977 5.751 . . . . 0.0 113.477 -179.844 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -170.65 -58.47 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.66 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 67.36 58.33 8.06 Favored Glycine 0 C--O 1.204 -1.734 0 C-N-CA 125.976 1.75 . . . . 0.0 111.463 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.28 -170.24 1.6 Allowed 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 129.707 3.828 . . . . 0.0 115.255 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -163.43 81.62 0.46 Allowed 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 113.445 -1.707 . . . . 0.0 109.411 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 3.6 t -125.02 155.37 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 0 O-C-N 127.528 3.017 . . . . 0.0 117.511 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.25 86.08 7.24 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 109.686 -3.416 . . . . 0.0 111.22 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.443 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 14.4 m -90.52 85.64 6.19 Favored 'General case' 0 C--O 1.206 -1.201 0 O-C-N 127.202 2.814 . . . . 0.0 111.2 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.7 tt -79.85 146.97 31.93 Favored 'General case' 0 CA--C 1.511 -0.534 2 CA-C-N 106.521 -4.854 . . . . 0.0 112.019 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 1.4 p -134.9 143.4 37.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 125.792 1.637 . . . . 0.0 112.126 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.445 ' CG2' ' HB ' ' A' ' 95' ' ' VAL . 5.8 t -166.98 169.48 12.95 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-O 126.75 3.166 . . . . 0.0 112.209 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.675 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.8 m95 -91.83 145.01 24.9 Favored 'General case' 0 CA--C 1.509 -0.628 0 O-C-N 117.579 -3.201 . . . . 0.0 105.732 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.506 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 1.1 tm-20 -85.9 -59.54 2.27 Favored 'General case' 0 C--O 1.203 -1.374 0 CA-C-O 127.813 3.673 . . . . 0.0 111.077 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.71 59.52 0.01 OUTLIER Glycine 0 C--O 1.195 -2.33 2 N-CA-C 100.818 -4.913 . . . . 0.0 100.818 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.6 t30 99.2 93.06 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 2 O-C-N 131.929 5.135 . . . . 0.0 104.142 -178.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.2 t 127.04 152.47 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.389 0 C-N-CA 130.291 3.436 . . . . 0.0 118.352 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.465 HD11 ' CD2' ' A' ' 50' ' ' PHE 0.268 0.6 OUTLIER -93.64 97.69 10.64 Favored 'General case' 0 CA--C 1.486 -1.495 0 CA-C-N 110.209 -3.178 . . . . 0.0 117.585 -179.407 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.506 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.418 42.3 t -92.65 151.1 3.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 CA-C-N 112.803 -1.999 . . . . 0.0 113.883 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.652 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 0.8 OUTLIER -165.84 157.23 13.9 Favored 'General case' 0 C--O 1.204 -1.328 0 O-C-N 126.977 2.673 . . . . 0.0 105.041 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . 0.286 0.0 OUTLIER -150.93 115.33 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.741 2 O-C-N 129.746 4.404 . . . . 0.0 115.259 -179.869 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.459 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -78.25 98.14 5.79 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 126.329 2.966 . . . . 0.0 109.444 -179.873 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -85.27 84.62 7.61 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 109.595 -3.457 . . . . 0.0 110.898 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -94.4 -155.95 31.96 Favored Glycine 0 C--O 1.2 -2.016 0 CA-C-O 125.53 2.739 . . . . 0.0 108.058 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -93.02 -47.42 7.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 110.528 -2.836 . . . . 0.0 113.066 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.458 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -111.29 -61.32 1.71 Allowed 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -75.31 167.19 22.38 Favored 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 111.391 -2.641 . . . . 0.0 117.385 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -121.6 86.71 2.62 Favored 'General case' 0 CA--C 1.537 0.471 1 CA-C-N 107.353 -4.476 . . . . 0.0 103.592 179.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.459 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 28.4 mmm-85 -87.8 175.03 8.02 Favored 'General case' 0 N--CA 1.48 1.066 1 O-C-N 129.672 4.357 . . . . 0.0 107.374 179.549 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.23 -167.39 33.9 Favored Glycine 0 C--O 1.207 -1.554 1 O-C-N 130.705 5.003 . . . . 0.0 115.693 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.652 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 1.6 p90 -175.52 16.44 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.76 1 O-C-N 131.977 5.163 . . . . 0.0 121.15 178.964 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.539 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -45.24 133.33 7.03 Favored 'General case' 0 C--O 1.208 -1.126 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 -176.83 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.418 ' HG2' HD21 ' A' ' 94' ' ' LEU . 24.5 mm-40 -93.06 168.09 11.36 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 113.975 -2.916 . . . . 0.0 109.525 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.539 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 10.8 m95 -125.07 -38.58 2.31 Favored 'General case' 0 C--O 1.211 -0.956 1 O-C-N 130.226 4.704 . . . . 0.0 114.231 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.5 t 67.3 51.99 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.81 1 CA-C-O 129.721 4.581 . . . . 0.0 109.048 -175.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -98.97 122.72 42.59 Favored 'General case' 0 CA--C 1.475 -1.916 1 CA-C-N 107.043 -4.617 . . . . 0.0 119.009 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 35.35 74.2 0.09 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 118.147 2.019 . . . . 0.0 118.147 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 73.57 -30.85 0.21 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 129.398 3.079 . . . . 0.0 119.257 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.4 ' HG3' ' CE1' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -106.12 174.65 5.79 Favored 'General case' 0 CA--C 1.498 -1.034 1 O-C-N 130.272 4.733 . . . . 0.0 109.756 -179.784 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.4 tt -121.04 94.97 4.51 Favored 'General case' 0 C--O 1.197 -1.708 1 O-C-N 129.951 4.532 . . . . 0.0 112.269 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.4 ' CE1' ' HG3' ' A' ' 115' ' ' LYS . 5.9 m-30 -66.39 131.26 45.68 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 109.938 -3.301 . . . . 0.0 111.123 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.542 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -109.21 102.98 11.88 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 111.171 -2.74 . . . . 0.0 107.947 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -107.44 139.08 42.49 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -137.29 149.91 47.42 Favored 'General case' 0 CA--C 1.485 -1.546 1 O-C-N 129.941 4.525 . . . . 0.0 108.487 -179.568 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.0 m -111.23 156.48 21.4 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.21 -2.144 . . . . 0.0 105.21 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.24 88.66 0.67 Allowed 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 119.13 -1.028 . . . . 0.0 110.959 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 46.24 39.93 10.05 Favored Glycine 0 CA--C 1.508 -0.399 0 CA-C-O 122.725 1.18 . . . . 0.0 114.776 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 t70 71.21 92.31 0.09 Allowed 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 126.275 1.83 . . . . 0.0 110.432 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.22 -53.1 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.374 1 O-C-N 130.275 4.734 . . . . 0.0 105.467 179.813 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.8 t 61.78 78.02 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 CA-C-N 108.834 -3.803 . . . . 0.0 117.953 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.5 t -58.89 125.99 25.82 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 113.436 -1.711 . . . . 0.0 108.671 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -110.72 100.41 9.18 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 125.606 1.816 . . . . 0.0 110.615 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -93.6 163.93 13.36 Favored 'General case' 0 CA--C 1.489 -1.398 0 O-C-N 124.691 1.244 . . . . 0.0 112.258 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -136.46 137.34 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-O 126.288 2.947 . . . . 0.0 106.996 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.542 ' CE1' ' CB ' ' A' ' 118' ' ' LEU 0.273 64.1 m-85 -124.56 177.41 5.95 Favored 'General case' 0 CA--C 1.497 -1.09 1 CA-C-N 108.055 -4.157 . . . . 0.0 116.612 179.855 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.77 139.31 19.61 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 110.622 -2.99 . . . . 0.0 103.774 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.516 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 4.9 ttmm -79.17 119.62 22.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-O 116.654 -1.641 . . . . 0.0 111.939 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt . . . . . 0 CA--C 1.49 -1.348 0 O-C-N 128.885 3.865 . . . . 0.0 118.863 -179.724 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.438 HG21 ' HB3' ' A' ' 92' ' ' ASN . 0.6 OUTLIER -153.96 157.93 39.89 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 119.482 -0.887 . . . . 0.0 108.845 179.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.415 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 1.2 ptmm? 27.86 37.48 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.176 0 O-C-N 128.327 3.517 . . . . 0.0 117.988 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -148.63 71.98 1.17 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -133.2 160.28 37.71 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.402 ' HA ' ' CG2' ' A' ' 43' ' ' ILE . 3.4 m120 -147.25 165.66 29.41 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.632 3.708 . . . . 0.0 112.614 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.3 -149.53 9.89 Favored Glycine 0 C--O 1.203 -1.802 0 CA-C-O 116.619 -2.212 . . . . 0.0 112.693 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.7 t -163.65 41.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 129.236 3.551 . . . . 0.0 105.155 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.594 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.307 0.1 OUTLIER -36.69 103.43 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.816 1 O-C-N 131.45 5.469 . . . . 0.0 112.179 -179.208 . . . . . . . . 5 4 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.41 -51.17 60.49 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.689 2.493 . . . . 0.0 114.884 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.2 ttt 93.41 86.85 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.669 1 O-C-N 129.904 4.503 . . . . 0.0 103.591 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -43.9 -47.54 8.37 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 129.059 3.974 . . . . 0.0 110.802 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -158.33 -179.77 8.41 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 111.214 -2.721 . . . . 0.0 112.111 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -156.22 151.8 27.01 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 17' ' ' PHE . 3.1 mm-40 -93.82 -164.07 1.13 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 108.628 -3.896 . . . . 0.0 110.769 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.412 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 11.3 p30 -30.21 83.69 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 C-N-CA 127.401 2.28 . . . . 0.0 111.85 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.4 ' N ' ' O ' ' A' ' 15' ' ' GLU . 13.3 t80 -69.7 -31.12 68.96 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.342 3.925 . . . . 0.0 107.898 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.514 ' CG ' ' HG3' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -73.69 -49.17 27.11 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 110.649 -2.978 . . . . 0.0 111.48 179.659 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.468 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.57 -22.44 16.98 Favored Glycine 0 CA--C 1.487 -1.7 1 O-C-N 130.425 4.828 . . . . 0.0 113.506 179.784 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -79.72 -38.02 34.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -77.25 -20.59 54.94 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 113.046 -1.888 . . . . 0.0 112.055 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.468 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 2.3 ttmt -73.48 -39.99 64.47 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 110.468 -3.06 . . . . 0.0 111.659 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.53 -40.18 85.05 Favored 'General case' 0 C--O 1.211 -0.933 1 O-C-N 130.429 4.831 . . . . 0.0 111.383 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.442 ' CB ' ' HB ' ' A' ' 26' ' ' ILE 0.322 15.1 mt -70.53 -29.74 66.3 Favored 'General case' 0 C--O 1.208 -1.107 2 O-C-N 130.002 4.564 . . . . 0.0 104.861 -179.885 . . . . . . . . 4 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t0 56.55 43.97 24.83 Favored 'General case' 0 C--O 1.202 -1.425 3 O-C-N 131.696 5.622 . . . . 0.0 103.806 -177.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.48 ' CD1' ' C ' ' A' ' 78' ' ' LEU . 0.5 OUTLIER -70.9 -9.91 13.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 1 CA-C-N 105.665 -5.243 . . . . 0.0 112.592 -178.403 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 50.2 -157.45 0.09 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 109.015 -3.721 . . . . 0.0 114.133 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 1.9 m-30 79.98 -20.38 0.39 Allowed 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 127.956 3.285 . . . . 0.0 115.741 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.449 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . . . 58.25 60.62 2.58 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 103.721 -2.696 . . . . 0.0 103.721 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 34.2 m -127.87 42.76 3.26 Favored 'General case' 0 N--CA 1.475 0.786 2 CA-C-N 105.369 -5.378 . . . . 0.0 115.294 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.514 ' HG3' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.06 -34.69 3.81 Favored 'General case' 0 CA--C 1.499 -1.017 1 O-C-N 129.457 4.223 . . . . 0.0 113.536 -179.629 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.462 ' N ' ' HG2' ' A' ' 31' ' ' ARG 0.258 19.7 tttm -99.11 55.6 1.01 Allowed 'General case' 0 C--N 1.309 -1.158 0 O-C-N 125.762 1.914 . . . . 0.0 107.7 179.809 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.73 -49.77 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.293 2 O-C-N 132.67 6.231 . . . . 0.0 109.732 -179.703 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.551 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -89.57 11.71 18.81 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.511 179.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.2 t -37.15 -46.22 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 O-C-N 125.897 1.998 . . . . 0.0 111.167 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HD2' ' CB ' ' A' ' 39' ' ' GLN . 0.8 OUTLIER 169.13 100.6 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.63 1 O-C-N 130.103 4.627 . . . . 0.0 115.351 -179.991 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.578 ' CD2' ' CD2' ' A' ' 58' ' ' PHE . 1.4 pp -96.71 -8.72 30.69 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 128.329 3.518 . . . . 0.0 107.314 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 m 143.94 112.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.128 1 O-C-N 133.109 6.506 . . . . 0.0 110.282 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.442 ' CB ' ' HD2' ' A' ' 36' ' ' ARG . 61.8 tt0 -127.47 148.2 50.3 Favored 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.619 3.074 . . . . 0.0 115.301 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.417 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 41.7 m -144.46 119.37 9.95 Favored 'General case' 0 C--N 1.318 -0.769 1 O-C-N 131.469 5.481 . . . . 0.0 111.147 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -103.7 107.91 18.97 Favored 'General case' 0 C--N 1.351 0.631 0 O-C-N 127.471 2.982 . . . . 0.0 103.761 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.468 ' CD1' ' HB2' ' A' ' 55' ' ' ASN . 3.9 mp -98.02 158.26 3.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 O-C-N 127.252 2.845 . . . . 0.0 110.699 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.441 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 0.1 OUTLIER -134.77 144.83 33.65 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 110.188 -3.187 . . . . 0.0 109.005 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 56.9 t -149.1 78.85 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.33 0 CA-C-N 111.82 -2.446 . . . . 0.0 111.951 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' A' ' 3' ' ' LYS . 0.8 OUTLIER -77.75 150.48 34.39 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -166.64 91.18 0.42 Allowed 'General case' 0 CA--C 1.498 -1.036 1 O-C-N 129.42 4.2 . . . . 0.0 111.747 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 54.55 -89.48 0.01 OUTLIER Glycine 0 C--N 1.345 1.066 0 CA-C-O 119.833 -0.426 . . . . 0.0 112.523 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -99.55 -39.71 8.19 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 126.796 2.115 . . . . 0.0 116.458 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -85.84 112.98 21.62 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 126.086 2.116 . . . . 0.0 111.975 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.408 ' CE1' HG12 ' A' ' 43' ' ' ILE . 76.8 t80 -112.8 97.98 6.91 Favored 'General case' 0 C--N 1.316 -0.89 1 O-C-N 129.707 4.379 . . . . 0.0 112.315 -179.915 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -117.21 89.36 3.1 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 119.282 3.068 . . . . 0.0 119.282 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.409 HG23 ' HB2' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -76.86 158.42 30.8 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 127.443 2.964 . . . . 0.0 106.691 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.408 ' N ' HG21 ' A' ' 52' ' ' THR . 0.0 OUTLIER -155.31 148.94 25.25 Favored 'General case' 0 CA--C 1.486 -1.482 0 O-C-N 127.654 3.096 . . . . 0.0 109.575 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.2 t -105.4 116.87 32.67 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.652 2.781 . . . . 0.0 107.196 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.468 ' HB2' ' CD1' ' A' ' 42' ' ' ILE . 0.1 OUTLIER -82.31 15.75 2.32 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 117.037 2.236 . . . . 0.0 117.037 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.403 ' O ' ' ND2' ' A' ' 60' ' ' ASN . 0.5 OUTLIER -56.81 155.81 7.35 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 127.356 2.91 . . . . 0.0 109.248 -179.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 p -89.77 -34.2 16.26 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 128.977 3.923 . . . . 0.0 104.01 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.578 ' CD2' ' CD2' ' A' ' 37' ' ' LEU . 1.3 m-85 -57.97 -65.15 0.69 Allowed 'General case' 0 C--O 1.24 0.562 0 O-C-N 126.922 2.639 . . . . 0.0 111.223 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -151.56 110.2 3.82 Favored 'General case' 0 C--N 1.362 1.151 1 CA-C-N 108.24 -4.073 . . . . 0.0 116.726 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.403 ' ND2' ' O ' ' A' ' 56' ' ' SER . 0.0 OUTLIER -111.64 87.75 2.63 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 127.316 2.885 . . . . 0.0 108.934 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.57 -56.46 4.0 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 128.708 3.755 . . . . 0.0 107.377 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 89.6 154.35 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.646 1 O-C-N 132.924 6.39 . . . . 0.0 115.697 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.519 HD12 ' CZ2' ' A' ' 107' ' ' TRP . 11.6 tp -99.34 47.25 0.96 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 111.536 -2.574 . . . . 0.0 112.376 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.83 94.75 1.44 Allowed 'General case' 0 C--O 1.206 -1.205 0 O-C-N 123.903 0.752 . . . . 0.0 109.054 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.499 ' CD2' HG22 ' A' ' 87' ' ' VAL . 0.5 OUTLIER -127.15 178.54 5.96 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-O 127.116 3.341 . . . . 0.0 108.558 -179.681 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -151.53 143.47 23.84 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 112.583 -2.099 . . . . 0.0 105.44 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.488 HG23 ' CD1' ' A' ' 89' ' ' TRP . 1.6 t -70.07 152.12 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 0 O-C-N 127.223 2.827 . . . . 0.0 114.194 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 47.37 37.49 12.07 Favored Glycine 0 N--CA 1.469 0.883 0 CA-C-N 111.238 -2.71 . . . . 0.0 114.373 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.404 HG11 ' N ' ' A' ' 70' ' ' GLU 0.262 9.9 p -98.16 -14.37 7.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.042 179.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.404 ' N ' HG11 ' A' ' 69' ' ' VAL . 1.3 tt0 55.68 74.14 0.39 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 128.665 3.728 . . . . 0.0 110.884 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.437 ' CD1' ' CE1' ' A' ' 65' ' ' PHE . 6.4 t80 -64.35 70.63 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.903 1 O-C-N 129.745 4.403 . . . . 0.0 113.67 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -51.83 87.59 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.32 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.523 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 40.11 -160.72 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 O-C-N 126.934 2.646 . . . . 0.0 112.924 179.54 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 91.62 90.98 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.341 -2.209 . . . . 0.0 116.436 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.413 ' C ' ' HG2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -148.01 153.66 39.27 Favored 'General case' 0 C--O 1.201 -1.492 0 CA-C-N 111.251 -2.704 . . . . 0.0 112.0 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.413 ' HG2' ' C ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 178.99 136.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.795 1 O-C-N 129.111 4.007 . . . . 0.0 111.271 -179.887 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.47 7.41 42.74 Favored Glycine 0 C--O 1.204 -1.725 0 CA-C-N 111.232 -2.713 . . . . 0.0 109.993 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.48 ' C ' ' CD1' ' A' ' 26' ' ' ILE . 4.0 tp -165.6 36.38 0.06 Allowed 'General case' 0 C--N 1.351 0.648 0 O-C-N 128.439 3.082 . . . . 0.0 116.36 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.465 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 7.6 t0 159.3 -66.54 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.044 2.715 . . . . 0.0 113.189 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.67 78.61 0.82 Allowed Glycine 0 C--O 1.204 -1.719 0 O-C-N 126.097 2.123 . . . . 0.0 110.144 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.27 -146.53 0.15 Allowed 'General case' 0 CA--C 1.494 -1.182 0 O-C-N 129.44 3.671 . . . . 0.0 113.193 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.523 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 15.2 m-20 -163.38 112.91 1.31 Allowed 'General case' 0 C--O 1.202 -1.431 0 CA-C-O 117.471 -1.252 . . . . 0.0 108.934 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.45 ' N ' ' HB2' ' A' ' 73' ' ' GLU . 71.1 t -146.95 131.83 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 N-CA-C 117.833 2.531 . . . . 0.0 117.833 -178.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -60.48 115.56 3.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 110.657 -2.974 . . . . 0.0 107.701 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.418 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 40.8 m -122.4 74.31 1.17 Allowed 'General case' 0 C--O 1.198 -1.656 0 O-C-N 127.915 3.26 . . . . 0.0 115.633 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.438 ' HB3' ' CG2' ' A' ' 97' ' ' VAL . 5.3 tp -67.33 143.44 56.38 Favored 'General case' 0 N--CA 1.437 -1.079 2 CA-C-N 106.037 -5.074 . . . . 0.0 108.908 -179.684 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.499 HG22 ' CD2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -123.34 131.09 73.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 O-C-N 126.402 2.314 . . . . 0.0 107.415 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.333 1.7 m -151.3 159.42 44.33 Favored 'General case' 0 CA--C 1.479 -1.782 0 CA-C-N 113.027 -1.897 . . . . 0.0 109.585 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.667 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 58.8 m95 -87.07 143.66 27.22 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 114.509 -2.662 . . . . 0.0 106.503 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.491 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 11.0 tp10 -90.28 -35.45 15.27 Favored 'General case' 0 CA--C 1.479 -1.752 1 CA-C-O 133.074 6.178 . . . . 0.0 112.469 179.798 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.18 -41.75 0.27 Allowed Glycine 0 C--O 1.206 -1.602 1 CA-C-N 107.009 -4.632 . . . . 0.0 103.2 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.508 ' ND2' ' N ' ' A' ' 92' ' ' ASN . 0.0 OUTLIER -155.65 67.64 0.63 Allowed 'General case' 0 C--O 1.197 -1.69 1 O-C-N 131.267 4.745 . . . . 0.0 107.897 -179.787 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.493 ' C ' ' CZ3' ' A' ' 89' ' ' TRP . 14.6 t 159.18 147.19 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 118.051 2.611 . . . . 0.0 118.051 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.447 ' HB3' ' CG ' ' A' ' 109' ' ' GLN . 0.7 OUTLIER -85.97 82.66 8.04 Favored 'General case' 0 CA--C 1.495 -1.165 1 O-C-N 132.679 6.237 . . . . 0.0 116.816 179.491 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.491 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.343 54.5 t -84.12 135.71 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 CA-C-O 115.558 -2.163 . . . . 0.0 112.663 179.492 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.11 137.77 29.38 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.438 ' CG2' ' HB3' ' A' ' 86' ' ' LEU . 16.4 m -113.14 118.49 58.19 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.996 1 O-C-N 130.098 4.624 . . . . 0.0 117.15 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.416 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 3.7 mm-40 -94.95 99.02 11.12 Favored 'General case' 0 C--O 1.221 -0.416 0 O-C-N 119.373 -2.079 . . . . 0.0 108.766 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.74 77.6 4.26 Favored 'General case' 0 C--O 1.201 -1.47 0 CA-C-N 111.059 -2.791 . . . . 0.0 108.324 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -81.65 -117.98 0.46 Allowed Glycine 0 C--O 1.207 -1.573 0 CA-C-N 112.286 -2.234 . . . . 0.0 112.082 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 174.03 94.62 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.984 -2.108 . . . . 0.0 111.731 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? 128.19 -28.62 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 129.159 2.984 . . . . 0.0 111.772 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.35 174.33 10.73 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 110.091 -3.231 . . . . 0.0 116.552 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -125.38 97.36 5.17 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 113.579 -3.105 . . . . 0.0 105.888 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 122' ' ' CYS 0.285 17.9 mmt180 -91.47 6.76 44.28 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 128.844 3.84 . . . . 0.0 113.809 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.416 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -49.0 97.14 0.01 OUTLIER Glycine 0 CA--C 1.533 1.194 2 O-C-N 133.166 6.541 . . . . 0.0 111.48 179.992 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.519 ' CZ2' HD12 ' A' ' 63' ' ' LEU 0.263 0.0 OUTLIER -104.16 137.92 41.4 Favored 'General case' 0 C--N 1.317 -0.815 1 O-C-N 130.97 4.571 . . . . 0.0 108.55 178.541 . . . . . . . . 5 4 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.65 -179.46 7.63 Favored 'General case' 0 C--O 1.204 -1.302 1 O-C-N 131.853 5.721 . . . . 0.0 115.101 -178.047 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.447 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -139.77 177.37 8.0 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 109.147 -3.661 . . . . 0.0 107.747 -179.835 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.489 ' CD1' ' HB3' ' A' ' 117' ' ' TYR 0.27 0.5 OUTLIER 177.93 100.45 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.642 1 O-C-N 132.694 6.246 . . . . 0.0 115.713 178.637 . . . . . . . . 5 4 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.4 t -46.62 96.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.486 -1.491 0 CA-C-O 126.416 3.008 . . . . 0.0 115.63 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.91 96.7 6.41 Favored 'General case' 0 CA--C 1.484 -1.595 0 CA-C-O 125.221 2.439 . . . . 0.0 115.945 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.76 72.78 0.47 Allowed Glycine 0 N--CA 1.439 -1.141 0 CA-C-N 112.049 -2.341 . . . . 0.0 117.101 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 49.48 63.08 2.3 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 126.587 1.992 . . . . 0.0 116.057 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.518 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.6 OUTLIER 160.63 148.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.667 1 O-C-N 130.003 4.564 . . . . 0.0 109.419 -179.93 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.505 HD22 ' CZ2' ' A' ' 9' ' ' TRP . 1.2 mm? -83.19 -174.82 5.51 Favored 'General case' 0 CA--C 1.495 -1.149 0 O-C-N 127.156 2.785 . . . . 0.0 111.679 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.489 ' HB3' ' CD1' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -155.81 69.53 0.67 Allowed 'General case' 0 C--O 1.203 -1.355 0 O-C-N 128.053 3.346 . . . . 0.0 110.751 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.83 87.24 0.06 Allowed 'General case' 0 CA--C 1.505 -0.767 1 CA-C-N 107.512 -4.404 . . . . 0.0 109.022 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -105.78 97.64 7.44 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 125.644 1.84 . . . . 0.0 111.081 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.74 162.66 12.74 Favored 'General case' 0 C--N 1.365 1.24 0 O-C-N 126.645 2.466 . . . . 0.0 108.406 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.53 160.84 38.91 Favored 'General case' 0 C--O 1.2 -1.518 0 O-C-N 128.372 3.545 . . . . 0.0 105.541 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.44 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -159.11 59.66 0.41 Allowed 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 126.795 3.188 . . . . 0.0 110.185 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.97 -69.97 0.5 Allowed Glycine 0 N--CA 1.435 -1.397 0 CA-C-N 110.282 -3.145 . . . . 0.0 111.075 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -162.45 64.13 0.22 Allowed 'General case' 0 C--O 1.206 -1.228 0 CA-C-N 110.646 -2.777 . . . . 0.0 109.197 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -158.09 36.96 0.25 Allowed 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 111.336 -2.665 . . . . 0.0 105.562 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 7.9 p -35.06 111.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 O-C-N 128.847 3.842 . . . . 0.0 113.792 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.6 t -89.71 119.44 30.12 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 119.352 -2.092 . . . . 0.0 107.577 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -106.55 111.46 24.02 Favored 'General case' 0 N--CA 1.477 0.913 1 O-C-N 129.3 4.125 . . . . 0.0 110.678 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -108.76 164.89 11.98 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 126.175 2.172 . . . . 0.0 112.763 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -127.1 157.19 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 N-CA-C 103.24 -2.874 . . . . 0.0 103.24 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -136.22 173.51 11.63 Favored 'General case' 0 CA--C 1.477 -1.863 0 CA-C-N 108.712 -3.858 . . . . 0.0 117.84 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.321 0.5 OUTLIER -162.17 97.02 1.01 Allowed 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 110.575 -3.011 . . . . 0.0 103.827 -179.621 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.594 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 12.2 pttt -33.39 -44.42 0.14 Allowed 'General case' 0 C--O 1.198 -1.607 1 O-C-N 131.168 5.293 . . . . 0.0 117.521 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.447 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 30.0 ttmt . . . . . 0 CA--C 1.481 -1.698 0 CA-C-O 114.745 -2.55 . . . . 0.0 111.817 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.6 mtp . . . . . 0 N--CA 1.501 2.108 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.8 -162.11 0.85 Allowed 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 118.253 -0.88 . . . . 0.0 108.704 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.469 ' HB2' ' CH2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER -49.3 -19.12 0.45 Allowed 'General case' 0 C--N 1.356 0.873 0 O-C-N 125.644 1.84 . . . . 0.0 113.402 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -63.07 104.35 0.56 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 103.443 -2.799 . . . . 0.0 103.443 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -138.4 -177.59 4.92 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 111.684 -2.507 . . . . 0.0 104.96 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -178.54 145.72 0.33 Allowed 'General case' 0 C--O 1.22 -0.482 1 O-C-N 129.499 4.249 . . . . 0.0 111.554 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -176.23 -151.56 8.92 Favored Glycine 0 C--O 1.201 -1.923 0 CA-C-O 115.652 -2.749 . . . . 0.0 115.066 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.438 HG21 ' CB ' ' A' ' 134' ' ' LYS . 5.5 t -167.05 42.73 0.05 OUTLIER 'General case' 0 C--O 1.204 -1.32 1 O-C-N 134.444 6.614 . . . . 0.0 107.791 179.727 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.541 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.2 OUTLIER -34.42 136.74 0.13 Allowed 'General case' 0 C--O 1.242 0.673 1 O-C-N 132.073 5.858 . . . . 0.0 112.024 179.926 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.494 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.4 mt-10 -103.84 53.36 0.75 Allowed 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 117.715 -1.594 . . . . 0.0 110.934 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.421 ' O ' ' N ' ' A' ' 13' ' ' SER . 15.8 ttp -4.92 67.28 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 O-C-N 128.978 3.924 . . . . 0.0 108.957 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.494 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.6 tt0 -12.82 -45.09 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.803 1 O-C-N 133.182 6.551 . . . . 0.0 112.427 -178.518 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 11' ' ' MET . 1.2 t -173.7 161.69 3.95 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 109.524 -3.489 . . . . 0.0 109.886 -179.734 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.414 ' CB ' ' HE2' ' A' ' 11' ' ' MET . 0.4 OUTLIER -116.08 156.61 26.09 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 109.686 -3.416 . . . . 0.0 112.735 -179.827 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -117.77 -56.66 2.18 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 127.067 2.729 . . . . 0.0 110.609 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -116.68 113.41 22.6 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 119.8 -1.812 . . . . 0.0 107.822 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . 0.296 25.0 t80 -115.29 -47.41 2.85 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 127.659 3.6 . . . . 0.0 112.524 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -76.38 -48.75 18.78 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 110.969 -2.832 . . . . 0.0 114.274 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.427 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.4 -21.84 14.09 Favored Glycine 0 CA--C 1.484 -1.869 0 O-C-N 124.982 1.426 . . . . 0.0 113.465 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.465 ' N ' HE21 ' A' ' 125' ' ' GLN . 0.1 OUTLIER -69.14 -48.0 63.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.206 -1.775 . . . . 0.0 106.206 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.7 mtm -70.42 -32.28 69.82 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 111.807 -2.451 . . . . 0.0 112.472 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.427 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -75.68 -23.39 56.21 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 128.569 2.748 . . . . 0.0 114.998 179.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.0 -32.13 50.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 110.226 -3.17 . . . . 0.0 108.804 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . 0.291 3.3 mt -74.03 -23.99 59.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 111.229 -2.714 . . . . 0.0 104.464 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 t70 63.24 58.86 1.35 Allowed 'General case' 0 C--O 1.216 -0.705 1 CA-C-O 128.514 4.006 . . . . 0.0 106.416 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.506 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 1.3 tt -71.72 -47.44 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.983 1 CA-C-N 106.73 -4.759 . . . . 0.0 110.594 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 178.59 123.25 0.05 OUTLIER 'General case' 0 C--N 1.361 1.102 0 CA-C-N 113.981 -1.463 . . . . 0.0 109.231 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -72.65 121.71 20.23 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 117.093 -1.843 . . . . 0.0 114.512 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 78.93 51.65 0.03 OUTLIER 'General case' 0 C--O 1.209 -1.054 0 C-N-CA 126.995 2.118 . . . . 0.0 110.527 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 31' ' ' ARG . 0.4 OUTLIER -87.67 -52.64 5.21 Favored 'General case' 0 C--N 1.355 0.848 2 O-C-N 130.018 4.574 . . . . 0.0 112.001 -179.921 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.25 -138.42 0.01 OUTLIER 'General case' 0 C--O 1.244 0.777 0 CA-C-O 112.437 -3.649 . . . . 0.0 111.92 -179.734 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.453 ' CB ' ' O ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER 98.18 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 O-C-N 128.633 3.708 . . . . 0.0 111.071 -179.864 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -117.44 8.42 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 1 O-C-N 131.057 5.223 . . . . 0.0 110.383 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -116.28 22.04 13.17 Favored 'General case' 0 C--N 1.346 0.429 0 O-C-N 124.735 1.272 . . . . 0.0 107.779 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.4 t -49.77 -36.37 11.15 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.344 0 CA-C-O 123.881 1.801 . . . . 0.0 111.483 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 171.36 128.7 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.828 1 CA-C-N 108.22 -4.082 . . . . 0.0 110.858 179.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.559 ' CD2' ' CE2' ' A' ' 58' ' ' PHE . 1.4 mt -97.74 -50.24 4.53 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 129.038 3.961 . . . . 0.0 104.049 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.3 m -170.23 142.96 2.31 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.727 5.642 . . . . 0.0 112.008 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.469 ' HG2' ' N ' ' A' ' 40' ' ' THR . 0.1 OUTLIER -125.03 150.43 46.76 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 126.074 2.109 . . . . 0.0 114.853 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.469 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 66.2 m 178.23 109.11 0.03 OUTLIER 'General case' 0 N--CA 1.433 -1.287 1 O-C-N 129.478 4.237 . . . . 0.0 111.904 178.815 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.89 152.56 19.63 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 127.928 3.267 . . . . 0.0 105.272 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.425 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 5.1 mp -137.48 157.81 34.3 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.369 0 C-N-CA 117.635 -1.626 . . . . 0.0 110.467 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.47 HG12 ' CE1' ' A' ' 50' ' ' PHE 0.251 3.4 tt -136.43 125.71 38.14 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 2 O-C-N 131.646 5.591 . . . . 0.0 109.07 -179.685 . . . . . . . . 4 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 59.7 t -124.94 102.97 11.61 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 CA-C-N 111.837 -2.438 . . . . 0.0 111.988 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.554 ' CG ' ' CD1' ' A' ' 50' ' ' PHE . 9.6 mt-30 -121.83 89.47 3.13 Favored 'General case' 0 CA--C 1.488 -1.429 0 CA-C-O 125.137 2.399 . . . . 0.0 114.743 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -78.64 -8.41 58.63 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-N 108.788 -3.824 . . . . 0.0 113.006 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.51 -106.8 0.25 Allowed Glycine 0 C--O 1.203 -1.841 0 CA-C-O 123.504 1.613 . . . . 0.0 113.741 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -98.62 -1.19 41.47 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 112.728 -1.736 . . . . 0.0 113.059 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.88 90.25 3.3 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 127.793 3.183 . . . . 0.0 108.907 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.554 ' CD1' ' CG ' ' A' ' 45' ' ' GLN . 6.4 t80 -96.44 103.66 15.58 Favored 'General case' 0 CA--C 1.496 -1.108 0 O-C-N 128.278 3.486 . . . . 0.0 113.305 -179.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.0 73.25 1.01 Allowed 'General case' 0 CA--C 1.496 -1.124 0 O-C-N 128.169 3.418 . . . . 0.0 118.202 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.479 ' CG2' ' N ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -52.28 165.55 0.23 Allowed 'General case' 0 C--N 1.358 0.95 0 CA-C-N 112.221 -2.263 . . . . 0.0 108.87 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.479 ' N ' ' CG2' ' A' ' 52' ' ' THR . 0.0 OUTLIER -170.91 153.31 3.84 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 114.843 -2.743 . . . . 0.0 106.653 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.11 152.34 24.66 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 127.382 2.927 . . . . 0.0 107.847 178.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -104.84 10.44 34.44 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 125.562 1.789 . . . . 0.0 115.258 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.527 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 54.4 m -44.35 152.2 0.21 Allowed 'General case' 0 N--CA 1.477 0.924 1 O-C-N 129.199 4.062 . . . . 0.0 105.513 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.41 HG21 ' HB2' ' A' ' 37' ' ' LEU 0.266 7.3 t -83.51 -35.24 25.0 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-N 111.752 -2.476 . . . . 0.0 110.719 -179.049 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.559 ' CE2' ' CD2' ' A' ' 37' ' ' LEU 0.251 0.0 OUTLIER -60.2 -38.34 83.02 Favored 'General case' 0 C--N 1.366 1.301 0 O-C-N 126.811 2.57 . . . . 0.0 111.524 -179.475 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 168.57 162.43 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.516 1 O-C-N 130.723 5.014 . . . . 0.0 112.05 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -113.38 127.65 56.2 Favored 'General case' 0 C--O 1.209 -1.074 1 O-C-N 130.366 4.791 . . . . 0.0 107.903 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.501 ' CE1' HD21 ' A' ' 78' ' ' LEU . 53.6 t80 -106.38 28.42 7.79 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 126.331 2.269 . . . . 0.0 108.39 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -13.62 112.52 0.02 OUTLIER 'General case' 0 C--O 1.205 -1.257 1 O-C-N 130.287 4.742 . . . . 0.0 117.502 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.533 HD22 ' CE2' ' A' ' 65' ' ' PHE . 9.9 tt -68.16 121.82 16.99 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 127.503 3.002 . . . . 0.0 108.796 177.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -141.02 83.08 1.87 Allowed 'General case' 0 CA--C 1.485 -1.549 0 C-N-CA 113.956 -3.098 . . . . 0.0 112.237 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.533 ' CE2' HD22 ' A' ' 63' ' ' LEU . 5.3 p90 -142.49 167.42 22.14 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 126.076 2.846 . . . . 0.0 110.926 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -119.88 157.3 29.02 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 112.647 -2.069 . . . . 0.0 108.115 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 1.9 t -51.67 141.74 4.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.119 0 O-C-N 127.027 2.705 . . . . 0.0 115.085 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 23.37 47.55 0.01 OUTLIER Glycine 0 CA--C 1.5 -0.875 1 O-C-N 131.501 5.5 . . . . 0.0 117.857 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -97.84 0.12 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 59.03 73.59 0.48 Allowed 'General case' 0 C--N 1.357 0.892 0 O-C-N 128.947 3.904 . . . . 0.0 109.254 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.417 ' HB3' HG23 ' A' ' 85' ' ' THR . 5.3 t80 -67.59 138.14 56.21 Favored 'General case' 0 N--CA 1.451 -0.405 2 O-C-N 129.602 4.314 . . . . 0.0 116.652 -179.801 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -112.79 93.63 4.52 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 113.171 -1.832 . . . . 0.0 110.62 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -72.39 154.21 41.02 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-O 126.517 3.056 . . . . 0.0 109.796 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.509 ' ND1' HD22 ' A' ' 82' ' ' ASN . 0.1 OUTLIER -131.78 74.15 1.57 Allowed 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 108.984 -3.735 . . . . 0.0 109.764 179.911 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 70.3 p -49.85 -79.49 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 114.265 -2.779 . . . . 0.0 116.19 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 13.0 97.32 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.816 1 O-C-N 129.656 4.347 . . . . 0.0 115.782 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 142.01 -29.14 2.22 Favored Glycine 0 C--O 1.213 -1.212 0 CA-C-N 110.345 -3.116 . . . . 0.0 107.666 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.506 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 12.6 tp -141.13 50.01 1.63 Allowed 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 108.481 -3.86 . . . . 0.0 115.395 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.413 ' N ' HD11 ' A' ' 26' ' ' ILE . 5.6 t70 151.73 -67.78 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.893 1.996 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.03 65.28 1.18 Allowed Glycine 0 C--O 1.229 -0.217 0 O-C-N 126.235 2.21 . . . . 0.0 112.818 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.46 ' CG ' ' N ' ' A' ' 82' ' ' ASN 0.267 3.3 tpt180 -139.97 -122.05 0.12 Allowed 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 113.836 -2.983 . . . . 0.0 112.936 -179.721 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.509 HD22 ' ND1' ' A' ' 74' ' ' HIS . 0.3 OUTLIER 156.15 101.81 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 O-C-N 128.299 3.499 . . . . 0.0 108.665 -179.275 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.478 ' CG1' ' HA2' ' A' ' 100' ' ' GLY . 1.9 t -134.33 165.18 32.29 Favored 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 127.043 2.714 . . . . 0.0 117.684 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.24 163.88 27.05 Favored 'General case' 0 C--O 1.218 -0.56 2 O-C-N 133.426 6.704 . . . . 0.0 107.503 179.19 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.417 HG23 ' HB3' ' A' ' 71' ' ' PHE . 1.1 m -168.76 98.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.983 1 O-C-N 130.799 5.062 . . . . 0.0 110.152 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.06 93.55 7.44 Favored 'General case' 0 C--O 1.209 -1.043 2 O-C-N 130.911 5.132 . . . . 0.0 116.626 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.502 ' CG2' ' CD1' ' A' ' 65' ' ' PHE . 26.1 t -68.4 131.66 33.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.197 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -157.95 160.77 37.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 124.188 1.947 . . . . 0.0 111.711 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.674 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 70.3 m95 -88.8 142.5 27.61 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 114.649 -2.596 . . . . 0.0 106.708 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -92.76 -60.37 1.83 Allowed 'General case' 0 CA--C 1.48 -1.718 1 CA-C-O 132.477 5.894 . . . . 0.0 113.456 179.552 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.02 61.72 0.03 OUTLIER Glycine 0 CA--C 1.542 1.778 1 CA-C-N 107.84 -4.255 . . . . 0.0 104.428 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.1 m120 92.39 66.08 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.038 1 O-C-N 132.388 5.405 . . . . 0.0 105.701 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.474 HG21 ' CB ' ' A' ' 90' ' ' GLU . 1.9 t 166.21 141.95 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.512 HD23 ' CE2' ' A' ' 50' ' ' PHE . 4.8 tp -86.05 106.5 17.25 Favored 'General case' 0 CA--C 1.487 -1.458 1 O-C-N 131.239 5.337 . . . . 0.0 114.161 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.48 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.376 40.8 t -109.87 148.68 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.014 0 CA-C-N 109.385 -3.552 . . . . 0.0 114.418 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.478 ' SG ' ' CZ3' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -149.22 133.07 17.0 Favored 'General case' 0 C--O 1.219 -0.532 0 O-C-N 125.739 1.899 . . . . 0.0 106.544 179.656 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.8 t -103.11 73.46 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.598 0 CA-C-N 110.133 -3.212 . . . . 0.0 115.256 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.455 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -53.36 101.4 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 122.383 1.087 . . . . 0.0 109.084 179.664 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -95.98 98.23 10.22 Favored 'General case' 0 C--O 1.205 -1.254 0 CA-C-N 109.315 -3.584 . . . . 0.0 112.358 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.478 ' HA2' ' CG1' ' A' ' 83' ' ' VAL . . . -94.19 -136.72 8.32 Favored Glycine 0 C--O 1.212 -1.239 0 O-C-N 127.94 3.275 . . . . 0.0 111.063 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -154.66 -47.39 0.09 Allowed 'General case' 0 CA--C 1.502 -0.891 1 CA-C-N 107.695 -4.252 . . . . 0.0 109.631 179.675 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.412 ' HD3' ' C ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -101.86 3.6 39.4 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 123.408 1.575 . . . . 0.0 115.033 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.78 174.62 13.64 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 110.222 -3.172 . . . . 0.0 117.307 -179.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.2 96.59 5.15 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 108.838 -3.801 . . . . 0.0 101.637 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 12.2 mmm-85 -87.68 -2.41 58.59 Favored 'General case' 0 C--O 1.208 -1.122 1 O-C-N 129.506 4.254 . . . . 0.0 111.593 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.455 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.66 95.52 0.01 OUTLIER Glycine 0 C--O 1.208 -1.501 2 O-C-N 133.719 6.887 . . . . 0.0 115.551 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.517 ' CD1' ' C ' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -110.46 137.69 47.83 Favored 'General case' 0 C--N 1.319 -0.754 1 O-C-N 130.997 4.586 . . . . 0.0 108.242 178.04 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -163.19 177.84 8.72 Favored 'General case' 0 CA--C 1.506 -0.717 1 O-C-N 130.454 4.846 . . . . 0.0 111.403 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.503 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 1.1 mp0 -139.71 -174.33 3.87 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 113.849 -2.977 . . . . 0.0 108.133 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.431 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.2 OUTLIER 179.4 89.17 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.235 1 O-C-N 130.377 4.798 . . . . 0.0 117.683 178.961 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . 0.25 70.3 t -34.71 104.57 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-O 125.051 2.358 . . . . 0.0 112.187 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.572 ' HG2' ' CD2' ' A' ' 117' ' ' TYR . 0.7 OUTLIER -107.29 28.87 7.66 Favored 'General case' 0 CA--C 1.478 -1.811 0 CA-C-N 111.534 -2.575 . . . . 0.0 117.81 -179.633 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.42 95.36 0.84 Allowed Glycine 0 C--O 1.21 -1.392 0 O-C-N 119.576 -1.952 . . . . 0.0 117.944 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 61.83 35.03 16.77 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 165.19 154.91 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.153 1 O-C-N 130.729 5.018 . . . . 0.0 110.015 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.503 ' CD2' ' HB3' ' A' ' 109' ' ' GLN . 1.1 mt -91.69 -172.75 3.32 Favored 'General case' 0 CA--C 1.484 -1.575 0 O-C-N 127.378 2.924 . . . . 0.0 112.399 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.572 ' CD2' ' HG2' ' A' ' 112' ' ' GLU . 0.0 OUTLIER -150.46 83.86 1.36 Allowed 'General case' 0 C--N 1.362 1.142 0 CA-C-N 111.659 -2.519 . . . . 0.0 113.182 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.515 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -73.33 88.14 1.54 Allowed 'General case' 0 N--CA 1.475 0.778 2 CA-C-N 107.989 -4.187 . . . . 0.0 109.562 -179.894 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -100.47 102.34 13.5 Favored 'General case' 0 CA--C 1.499 -0.985 0 O-C-N 128.863 3.852 . . . . 0.0 109.803 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.417 ' HB2' ' CB ' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -121.52 155.27 35.33 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 128.136 3.397 . . . . 0.0 109.347 -179.847 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.1 t -133.59 154.76 50.63 Favored 'General case' 0 C--N 1.311 -1.103 1 O-C-N 129.56 4.288 . . . . 0.0 104.759 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . 0.273 2.8 m -139.43 39.78 2.06 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.887 1.327 . . . . 0.0 110.962 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 132.93 -57.51 0.71 Allowed Glycine 0 CA--C 1.526 0.781 0 CA-C-N 111.696 -2.502 . . . . 0.0 108.526 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -172.77 49.64 0.02 OUTLIER 'General case' 0 CA--C 1.491 -1.294 0 CA-C-N 109.845 -3.177 . . . . 0.0 106.955 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.465 HE21 ' N ' ' A' ' 20' ' ' TYR . 1.4 tm0? -103.38 -22.93 13.6 Favored 'General case' 0 C--O 1.208 -1.122 0 C-N-CA 116.666 -2.014 . . . . 0.0 110.369 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 11.8 p 27.1 63.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 CA-C-O 125.297 2.475 . . . . 0.0 117.11 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.412 ' N ' ' O ' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -57.71 149.29 22.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 118.923 -2.361 . . . . 0.0 108.191 -179.691 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -135.09 87.71 2.36 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 128.181 3.426 . . . . 0.0 111.002 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -83.02 164.52 20.3 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.42 139.45 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 123.963 1.839 . . . . 0.0 106.078 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.515 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 39.6 m-85 -123.02 179.66 4.59 Favored 'General case' 0 CA--C 1.492 -1.263 0 CA-C-O 126.716 3.15 . . . . 0.0 117.42 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.415 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.297 0.0 OUTLIER -165.76 122.41 1.39 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 109.903 -3.317 . . . . 0.0 104.473 -179.936 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.541 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 19.7 ttpt -71.6 57.35 0.28 Allowed 'General case' 0 C--O 1.202 -1.445 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.438 ' CB ' HG21 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.796 0 N-CA-C 117.976 2.584 . . . . 0.0 117.976 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mtt . . . . . 0 N--CA 1.509 2.525 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 m -80.35 141.14 35.7 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 113.857 -1.519 . . . . 0.0 111.88 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.493 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 17.0 mttt 45.83 34.96 2.05 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.71 104.53 5.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 104.006 -2.59 . . . . 0.0 104.006 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . 0.262 7.7 mt-30 -139.39 145.75 39.33 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 103.616 -2.735 . . . . 0.0 103.616 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 156.7 126.16 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.919 1 O-C-N 131.571 5.545 . . . . 0.0 112.108 179.944 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 150.48 -169.91 30.39 Favored Glycine 0 C--O 1.2 -1.97 0 O-C-N 127.054 2.721 . . . . 0.0 110.224 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.45 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -129.57 145.08 51.51 Favored 'General case' 0 C--N 1.318 -0.8 1 O-C-N 131.963 5.155 . . . . 0.0 107.664 -179.962 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.573 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -138.04 109.2 6.82 Favored 'General case' 0 CA--C 1.498 -1.028 1 O-C-N 131.199 5.312 . . . . 0.0 112.177 -179.773 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -56.02 -15.25 3.28 Favored 'General case' 0 C--N 1.316 -0.863 0 O-C-N 126.828 2.58 . . . . 0.0 115.415 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.9 ttp 59.02 81.49 0.16 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -35.27 -43.95 0.25 Allowed 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 128.879 3.862 . . . . 0.0 110.993 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.268 4.8 p -157.97 162.76 38.23 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 112.046 -2.343 . . . . 0.0 111.535 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -132.3 124.8 29.56 Favored 'General case' 0 CA--C 1.482 -1.664 1 CA-C-N 107.898 -4.228 . . . . 0.0 112.223 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.33 -149.42 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 128.173 3.42 . . . . 0.0 107.65 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -44.61 139.47 2.86 Favored 'General case' 0 C--O 1.2 -1.514 0 CA-C-N 119.551 1.069 . . . . 0.0 112.815 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -126.75 -44.27 1.67 Allowed 'General case' 0 C--O 1.197 -1.669 0 CA-C-O 125.695 2.664 . . . . 0.0 111.648 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.66 -22.17 47.2 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-N 111.348 -2.66 . . . . 0.0 115.542 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.81 -31.03 62.84 Favored Glycine 0 N--CA 1.474 1.21 0 O-C-N 128.129 3.393 . . . . 0.0 108.29 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.404 ' CD1' ' C ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -70.12 -34.32 72.95 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-O 124.7 2.191 . . . . 0.0 108.958 -179.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.442 ' HE2' ' CG2' ' A' ' 30' ' ' THR . 2.1 mtm -73.16 -24.09 60.52 Favored 'General case' 0 CA--C 1.484 -1.568 0 C-N-CA 114.749 -2.78 . . . . 0.0 113.765 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -78.33 -24.33 46.61 Favored 'General case' 0 CA--C 1.538 0.512 1 O-C-N 132.184 5.928 . . . . 0.0 110.585 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.38 -32.18 73.69 Favored 'General case' 0 C--O 1.202 -1.406 1 O-C-N 130.664 4.978 . . . . 0.0 112.857 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.419 ' CD1' ' HB ' ' A' ' 26' ' ' ILE . 0.7 OUTLIER -118.56 19.93 13.13 Favored 'General case' 0 N--CA 1.472 0.634 1 O-C-N 129.411 4.194 . . . . 0.0 107.42 179.648 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.35 -64.03 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 128.37 3.544 . . . . 0.0 112.675 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.419 ' HB ' ' CD1' ' A' ' 24' ' ' LEU . 8.3 tt 36.65 34.42 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.828 1 CA-C-O 129.095 4.283 . . . . 0.0 113.768 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.88 175.08 0.13 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 109.415 -3.539 . . . . 0.0 111.786 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -112.65 168.78 9.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 113.703 -1.589 . . . . 0.0 113.476 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 83.71 103.37 0.05 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.442 ' CG2' ' HE2' ' A' ' 21' ' ' MET . 0.8 OUTLIER 176.81 -45.63 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.394 2.934 . . . . 0.0 112.625 -179.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.25 -9.37 0.16 Allowed 'General case' 0 CA--C 1.497 -1.074 0 C-N-CA 129.698 3.199 . . . . 0.0 114.458 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -31.47 27.36 Favored 'General case' 0 CA--C 1.482 -1.668 0 C-N-CA 117.212 -1.795 . . . . 0.0 114.365 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.441 ' CD1' ' N ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -135.11 15.26 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.913 1 O-C-N 129.45 4.219 . . . . 0.0 114.877 -179.925 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -114.94 12.47 16.82 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 118.919 -1.113 . . . . 0.0 112.469 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.4 t -52.7 -39.18 29.58 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.527 0 CA-C-O 122.888 1.328 . . . . 0.0 111.983 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.43 ' HD3' ' HB3' ' A' ' 39' ' ' GLN . 1.0 OUTLIER 173.93 131.74 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 108.493 -3.958 . . . . 0.0 111.178 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.547 ' CD2' ' N ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -101.68 -60.56 1.51 Allowed 'General case' 0 N--CA 1.435 -1.194 1 O-C-N 129.676 4.36 . . . . 0.0 105.798 -179.523 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 22.1 m -153.23 36.63 0.47 Allowed 'General case' 0 CA--C 1.489 -1.399 1 O-C-N 131.102 5.251 . . . . 0.0 112.032 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.43 ' HB3' ' HD3' ' A' ' 36' ' ' ARG . 6.7 tt0 -63.59 118.22 7.9 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 116.355 1.983 . . . . 0.0 116.355 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 m -121.99 132.61 54.62 Favored 'General case' 0 C--O 1.204 -1.306 1 O-C-N 129.246 4.091 . . . . 0.0 110.183 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -107.87 141.4 39.52 Favored 'General case' 0 N--CA 1.475 0.811 1 O-C-N 129.372 4.17 . . . . 0.0 107.497 -179.84 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.479 HD12 ' CD ' ' A' ' 53' ' ' LYS . 2.9 mp -132.46 155.44 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 O-C-N 126.788 2.555 . . . . 0.0 110.776 179.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.47 HG13 ' CE1' ' A' ' 50' ' ' PHE . 13.4 tt -132.94 129.02 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.543 0 CA-C-O 126.139 2.876 . . . . 0.0 109.46 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.0 t -124.56 48.46 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.372 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -55.97 108.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.563 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -123.64 14.29 9.42 Favored 'General case' 0 CA--C 1.476 -1.877 1 O-C-N 129.532 4.27 . . . . 0.0 117.751 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.32 103.28 2.71 Favored Glycine 0 C--O 1.214 -1.156 0 C-N-CA 119.282 -1.437 . . . . 0.0 112.153 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 73.09 -65.47 0.35 Allowed 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 127.821 2.719 . . . . 0.0 112.072 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -96.81 86.72 4.11 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 129.054 3.971 . . . . 0.0 109.818 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.49 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 1.7 t80 -98.1 109.91 22.59 Favored 'General case' 0 N--CA 1.475 0.8 1 O-C-N 130.39 4.806 . . . . 0.0 110.999 -179.869 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.452 ' CB ' ' HA ' ' A' ' 64' ' ' ASP . 6.0 mttm -120.25 99.46 6.6 Favored 'General case' 0 CA--C 1.487 -1.477 1 O-C-N 129.885 4.49 . . . . 0.0 119.933 -179.227 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.465 ' CG2' ' N ' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -72.71 173.62 8.78 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 126.921 2.638 . . . . 0.0 106.506 178.224 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.479 ' CD ' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -172.53 145.64 1.62 Allowed 'General case' 0 CA--C 1.488 -1.423 0 C-N-CA 115.975 -2.29 . . . . 0.0 111.515 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.403 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 1.3 t -98.13 126.82 43.75 Favored 'General case' 0 CA--C 1.496 -1.104 0 O-C-N 128.209 3.443 . . . . 0.0 109.68 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -96.76 35.11 1.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.88 110.11 14.94 Favored 'General case' 0 N--CA 1.473 0.687 1 O-C-N 130.187 4.68 . . . . 0.0 105.176 179.642 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.47 -36.97 46.58 Favored 'General case' 0 C--O 1.209 -1.027 1 O-C-N 129.759 4.412 . . . . 0.0 108.407 -179.638 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.49 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 1.2 p90 -74.63 -23.83 58.75 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -173.77 100.76 0.11 Allowed 'General case' 0 C--O 1.21 -0.993 1 O-C-N 131.417 5.448 . . . . 0.0 116.389 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.403 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 0.0 OUTLIER -107.52 89.79 3.1 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 108.802 -3.817 . . . . 0.0 105.718 -179.771 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -77.36 -29.08 53.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.37 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 t0 69.16 131.5 0.03 OUTLIER 'General case' 0 CA--C 1.499 -0.993 0 O-C-N 127.435 2.959 . . . . 0.0 112.902 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.463 ' HB3' ' CB ' ' A' ' 52' ' ' THR . 3.9 tp -100.32 58.93 0.98 Allowed 'General case' 0 C--O 1.214 -0.805 0 O-C-N 125.102 1.501 . . . . 0.0 109.868 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.452 ' HA ' ' CB ' ' A' ' 51' ' ' LYS . 15.8 p-10 -99.43 98.66 9.55 Favored 'General case' 0 C--O 1.203 -1.388 0 O-C-N 126.911 2.632 . . . . 0.0 112.89 -178.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.527 ' CE2' ' CZ2' ' A' ' 107' ' ' TRP . 6.8 p90 -132.73 -179.16 5.29 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 124.031 1.872 . . . . 0.0 106.396 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.469 ' CB ' HG22 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -129.87 155.72 45.54 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 104.165 -2.532 . . . . 0.0 104.165 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 p -78.77 135.12 26.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.072 0 O-C-N 126.775 2.547 . . . . 0.0 114.344 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 23.59 75.97 Favored Glycine 0 N--CA 1.488 2.129 0 C-N-CA 116.372 -2.823 . . . . 0.0 116.103 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.469 HG22 ' CB ' ' A' ' 66' ' ' THR . 3.0 t -73.28 -25.16 21.11 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.89 74.59 0.4 Allowed 'General case' 0 C--N 1.364 1.203 1 O-C-N 130.458 4.848 . . . . 0.0 109.509 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.443 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 4.4 m-85 -43.83 147.47 0.46 Allowed 'General case' 0 CA--C 1.503 -0.865 0 O-C-N 128.277 3.485 . . . . 0.0 118.324 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -107.63 56.31 0.64 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 115.995 -1.955 . . . . 0.0 112.491 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' CB ' ' CA ' ' A' ' 83' ' ' VAL . 0.6 OUTLIER 19.16 84.47 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.813 1 CA-C-O 129.267 4.365 . . . . 0.0 114.544 179.765 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.405 ' C ' ' HB2' ' A' ' 82' ' ' ASN . 47.1 t60 -169.7 125.69 0.85 Allowed 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 109.518 -3.492 . . . . 0.0 118.057 178.131 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.484 ' CG2' ' ND2' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -161.64 168.82 22.73 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.143 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.46 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -152.91 161.89 41.98 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 125.652 2.644 . . . . 0.0 114.514 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.83 -7.1 82.33 Favored Glycine 0 C--O 1.217 -0.91 0 CA-C-N 111.155 -2.748 . . . . 0.0 113.475 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 tp -123.67 -63.88 1.19 Allowed 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -118.78 -58.15 1.98 Allowed 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 113.762 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.58 64.26 0.59 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 127.715 2.578 . . . . 0.0 110.949 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ttm105 151.64 146.38 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 O-C-N 128.556 3.151 . . . . 0.0 109.142 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.484 ' ND2' ' CG2' ' A' ' 75' ' ' THR . 1.1 t-20 -132.45 5.89 4.08 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.676 -178.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.604 ' CA ' ' CB ' ' A' ' 73' ' ' GLU 0.32 16.2 t 49.49 178.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 1 O-C-N 130.199 4.687 . . . . 0.0 116.177 -178.936 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.418 ' N ' ' CG1' ' A' ' 83' ' ' VAL . 0.0 OUTLIER -76.85 82.2 3.43 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 124.193 1.949 . . . . 0.0 106.71 177.929 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.443 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 83.6 m -93.09 69.14 4.41 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 109.305 -3.589 . . . . 0.0 117.209 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.6 150.89 43.1 Favored 'General case' 0 N--CA 1.432 -1.366 2 CA-C-N 106.631 -4.804 . . . . 0.0 110.338 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.7 t -130.58 143.02 42.19 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.108 0 C-N-CA 124.374 1.07 . . . . 0.0 109.308 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.1 173.47 14.3 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-O 125.854 2.74 . . . . 0.0 111.848 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.661 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 60.1 m95 -92.78 154.02 18.54 Favored 'General case' 0 CA--C 1.508 -0.672 0 C-N-CA 128.537 2.735 . . . . 0.0 106.473 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.477 ' HG3' ' CG2' ' A' ' 95' ' ' VAL . 0.3 OUTLIER -111.13 -52.23 2.8 Favored 'General case' 0 CA--C 1.485 -1.533 1 CA-C-O 129.735 4.588 . . . . 0.0 115.976 179.588 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 156.91 84.82 0.05 OUTLIER Glycine 0 C--O 1.196 -2.248 2 N-CA-C 101.829 -4.508 . . . . 0.0 101.829 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.4 p30 67.37 46.15 1.48 Allowed 'General case' 0 C--O 1.216 -0.67 1 O-C-N 136.371 7.748 . . . . 0.0 110.211 -179.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.473 HG21 ' CB ' ' A' ' 90' ' ' GLU . 0.5 OUTLIER -179.19 157.36 0.82 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 179.379 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.506 ' HB3' ' CG ' ' A' ' 109' ' ' GLN . 1.6 tp -87.68 136.57 32.9 Favored 'General case' 0 CA--C 1.477 -1.863 1 O-C-N 130.898 5.124 . . . . 0.0 114.044 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.477 ' CG2' ' HG3' ' A' ' 90' ' ' GLU 0.361 54.8 t -144.64 134.49 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.114 0 CA-C-N 112.387 -2.188 . . . . 0.0 116.737 179.738 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -136.67 148.94 47.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.844 2.59 . . . . 0.0 104.394 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.3 t -125.93 83.23 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.937 0 N-CA-C 118.224 2.675 . . . . 0.0 118.224 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.401 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 2.6 mt-30 -58.3 105.17 0.26 Allowed 'General case' 0 C--N 1.359 0.987 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.421 ' N ' HG13 ' A' ' 83' ' ' VAL . 2.4 tptt -139.08 86.83 2.16 Favored 'General case' 0 C--O 1.203 -1.392 0 O-C-N 128.775 3.797 . . . . 0.0 114.669 -177.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.437 ' N ' HG11 ' A' ' 83' ' ' VAL . . . -149.7 -66.63 0.01 OUTLIER Glycine 0 C--N 1.342 0.892 0 CA-C-O 125.827 2.904 . . . . 0.0 109.367 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.81 169.8 9.61 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 108.682 -3.759 . . . . 0.0 112.222 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.43 -63.84 0.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 127.551 3.032 . . . . 0.0 114.868 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -59.7 145.56 44.52 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 111.21 -2.723 . . . . 0.0 117.714 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -111.24 87.74 2.62 Favored 'General case' 0 N--CA 1.49 1.56 1 CA-C-N 107.869 -4.241 . . . . 0.0 101.756 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.42 ' HD3' ' HA ' ' A' ' 122' ' ' CYS . 1.3 mmm180 -104.91 3.72 31.15 Favored 'General case' 0 C--O 1.199 -1.591 1 O-C-N 132.227 5.955 . . . . 0.0 113.198 -179.117 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.401 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -55.13 107.91 0.86 Allowed Glycine 0 N--CA 1.426 -2.002 2 CA-C-N 106.192 -5.004 . . . . 0.0 114.896 -179.829 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.527 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE 0.262 0.0 OUTLIER -96.56 148.55 22.72 Favored 'General case' 0 C--O 1.207 -1.172 0 O-C-N 128.266 2.98 . . . . 0.0 110.38 179.344 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.453 ' N ' ' CD1' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -163.51 176.91 9.28 Favored 'General case' 0 C--O 1.2 -1.509 1 O-C-N 129.106 4.004 . . . . 0.0 113.423 -178.82 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.506 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -147.2 175.6 10.62 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.845 -2.434 . . . . 0.0 108.95 -179.48 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.462 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.1 OUTLIER -172.28 39.5 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.01 1 O-C-N 129.172 4.045 . . . . 0.0 117.816 179.863 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . 0.255 12.8 t 6.92 82.66 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.227 0 C-N-CA 127.55 2.34 . . . . 0.0 115.009 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -84.03 32.14 0.49 Allowed 'General case' 0 CA--C 1.488 -1.419 0 N-CA-C 117.205 2.298 . . . . 0.0 117.205 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 93.56 105.52 1.77 Allowed Glycine 0 C--O 1.21 -1.399 0 N-CA-C 117.409 1.724 . . . . 0.0 117.409 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 1.4 m-20 58.04 15.93 3.48 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 118.66 2.837 . . . . 0.0 118.66 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.447 ' HE2' ' CE1' ' A' ' 117' ' ' TYR . 0.0 OUTLIER -167.58 156.35 9.66 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 129.04 3.963 . . . . 0.0 110.13 -179.634 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.97 106.32 14.98 Favored 'General case' 0 CA--C 1.482 -1.646 0 O-C-N 128.254 3.471 . . . . 0.0 117.574 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.447 ' CE1' ' HE2' ' A' ' 115' ' ' LYS . 1.2 m-85 -66.34 99.54 0.56 Allowed 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 116.238 -2.185 . . . . 0.0 115.985 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.08 70.8 8.44 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 114.881 -2.727 . . . . 0.0 106.498 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -83.93 111.86 19.63 Favored 'General case' 0 CA--C 1.502 -0.901 0 O-C-N 127.488 2.993 . . . . 0.0 111.268 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.75 156.21 43.9 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 128.651 3.72 . . . . 0.0 110.952 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 59.4 m -112.24 160.26 17.79 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 126.951 2.657 . . . . 0.0 105.438 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 1.9 m -146.18 25.52 1.25 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 120.411 1.46 . . . . 0.0 112.799 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 106.68 29.37 4.72 Favored Glycine 0 N--CA 1.437 -1.235 0 O-C-N 125.834 1.959 . . . . 0.0 114.49 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 126.39 -31.18 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 130.169 3.387 . . . . 0.0 110.996 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -79.15 81.97 5.36 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 128.132 3.395 . . . . 0.0 111.653 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 39.1 t -68.34 94.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-N 110.068 -3.242 . . . . 0.0 111.489 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.1 m -72.75 106.12 4.6 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 116.289 -1.815 . . . . 0.0 109.884 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.9 75.98 4.19 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 128.309 3.505 . . . . 0.0 112.917 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -56.54 146.7 24.14 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 115.573 -2.156 . . . . 0.0 110.442 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.2 t -122.63 100.63 8.49 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.403 ' CD2' ' HB2' ' A' ' 9' ' ' TRP . 6.0 m-85 -75.93 176.18 8.11 Favored 'General case' 0 CA--C 1.48 -1.748 0 CA-C-N 109.753 -3.385 . . . . 0.0 116.878 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.419 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.411 0.0 OUTLIER -171.05 110.14 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 110.393 -3.094 . . . . 0.0 103.747 179.795 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.552 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 32.3 ttpt -49.58 127.78 16.28 Favored 'General case' 0 C--O 1.218 -0.576 1 O-C-N 130.149 4.655 . . . . 0.0 110.588 179.476 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 37.7 pttt . . . . . 0 CA--C 1.491 -1.322 0 O-C-N 126.903 2.627 . . . . 0.0 117.545 -179.561 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.4 mtp . . . . . 0 N--CA 1.506 2.36 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.6 -44.63 0.19 Allowed 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.029 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.501 ' HD3' ' CH2' ' A' ' 89' ' ' TRP . 1.1 ptpt -116.03 82.87 1.85 Allowed 'General case' 0 C--N 1.363 1.175 0 N-CA-C 117.84 2.533 . . . . 0.0 117.84 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.27 116.43 31.93 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 102.848 -3.019 . . . . 0.0 102.848 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -133.13 -102.41 0.26 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 115.229 -2.32 . . . . 0.0 109.331 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 m120 35.38 41.4 0.09 Allowed 'General case' 0 C--N 1.307 -1.272 0 O-C-N 127.957 3.286 . . . . 0.0 114.427 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -101.43 -120.09 4.61 Favored Glycine 0 C--O 1.204 -1.766 0 CA-C-O 115.524 -2.82 . . . . 0.0 112.174 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.42 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 2.2 m 170.13 147.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.664 1 O-C-N 131.14 4.67 . . . . 0.0 104.132 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.593 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -142.68 91.68 2.33 Favored 'General case' 0 C--N 1.323 -0.577 1 O-C-N 133.422 6.701 . . . . 0.0 116.937 179.935 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.405 ' HB2' ' HE2' ' A' ' 132' ' ' LYS . 10.6 mt-10 -61.66 111.87 2.01 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 116.321 -2.151 . . . . 0.0 107.945 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 37.0 ttp -61.4 74.24 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.715 0 O-C-N 127.096 2.748 . . . . 0.0 106.733 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.402 ' N ' ' O ' ' A' ' 10' ' ' GLU . 1.7 tt0 -23.67 -47.28 0.01 OUTLIER 'General case' 0 C--O 1.2 -1.502 0 O-C-N 128.285 3.491 . . . . 0.0 111.749 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.262 0.3 OUTLIER -145.08 152.2 39.72 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 109.013 -3.721 . . . . 0.0 111.573 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -116.31 104.46 11.51 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-N 109.716 -3.402 . . . . 0.0 112.976 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -50.85 31.82 Favored 'General case' 0 CA--C 1.503 -0.846 1 O-C-N 130.107 4.629 . . . . 0.0 112.364 179.892 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.465 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -161.05 150.34 16.78 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-O 125.239 2.447 . . . . 0.0 110.421 -179.797 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.51 ' CD1' ' N ' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -121.77 -58.15 1.76 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 124.926 2.298 . . . . 0.0 110.02 179.706 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 19' ' ' GLY . 9.2 pt-20 -71.32 -28.55 64.17 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 113.756 -1.566 . . . . 0.0 114.537 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.465 ' N ' ' OD1' ' A' ' 16' ' ' ASN . . . -70.71 -23.27 77.95 Favored Glycine 0 N--CA 1.488 2.148 0 O-C-N 128.549 3.656 . . . . 0.0 109.374 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -75.38 -28.28 59.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 119.049 1.425 . . . . 0.0 108.751 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.425 ' HG2' HG23 ' A' ' 26' ' ' ILE . 21.9 mtt -76.95 -33.3 57.69 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-N 113.245 -1.798 . . . . 0.0 107.838 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.475 ' HA ' ' CE ' ' A' ' 22' ' ' LYS . 4.7 mmpt? -68.59 -30.04 68.7 Favored 'General case' 0 C--O 1.203 -1.363 0 O-C-N 128.558 3.661 . . . . 0.0 114.159 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.48 -39.17 65.1 Favored 'General case' 0 C--O 1.208 -1.114 2 O-C-N 130.994 5.184 . . . . 0.0 114.773 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.7 0.24 30.33 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 127.627 3.079 . . . . 0.0 108.314 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 40.06 98.53 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.251 1 CA-C-O 129.32 4.39 . . . . 0.0 109.804 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.425 HG23 ' HG2' ' A' ' 21' ' ' MET . 6.4 tp -127.09 -45.01 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.108 0 CA-C-N 109.637 -3.438 . . . . 0.0 113.137 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.432 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 0.5 OUTLIER -151.07 142.91 23.83 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 119.119 -2.238 . . . . 0.0 108.849 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -80.95 65.33 6.05 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 72.19 73.47 0.16 Allowed 'General case' 0 C--O 1.203 -1.35 0 O-C-N 127.331 2.894 . . . . 0.0 107.848 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.432 ' HB ' ' HB3' ' A' ' 27' ' ' ASP . 0.4 OUTLIER -73.15 -40.96 64.44 Favored 'General case' 0 N--CA 1.479 1.023 1 CA-C-N 106.658 -4.792 . . . . 0.0 114.141 179.874 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -120.55 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.019 1 O-C-N 130.317 4.76 . . . . 0.0 112.636 -179.827 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.23 9.5 2.14 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 129.021 3.951 . . . . 0.0 108.335 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.7 mp -142.17 -49.51 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 111.415 -2.63 . . . . 0.0 108.175 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.53 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -93.2 35.29 1.08 Allowed 'General case' 0 C--O 1.205 -1.264 0 CA-C-O 122.228 1.013 . . . . 0.0 111.877 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.457 HG11 ' CZ ' ' A' ' 17' ' ' PHE . 55.0 t -50.47 -34.95 12.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.705 0 C-N-CA 127.48 2.312 . . . . 0.0 115.897 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 153.74 122.82 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 1 O-C-N 129.394 4.184 . . . . 0.0 111.487 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.548 ' HG ' ' CD2' ' A' ' 58' ' ' PHE . 1.3 pp -106.27 -11.52 16.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 113.937 -2.935 . . . . 0.0 110.87 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.3 m 145.96 98.85 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.082 1 O-C-N 134.132 7.145 . . . . 0.0 111.039 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.96 114.78 26.99 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 127.089 2.743 . . . . 0.0 117.562 -179.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 m -106.43 112.14 25.02 Favored 'General case' 0 C--O 1.209 -1.061 1 O-C-N 130.522 4.889 . . . . 0.0 110.824 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.432 ' HG3' HD11 ' A' ' 118' ' ' LEU . 2.4 tmtt? -105.55 119.94 40.38 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 127.908 3.255 . . . . 0.0 107.593 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.459 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 2.7 mp -109.86 159.93 9.18 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 128.645 3.715 . . . . 0.0 111.625 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.459 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.307 1.0 OUTLIER -132.37 146.83 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-N 109.443 -3.526 . . . . 0.0 106.898 179.668 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 55.8 t -156.88 113.66 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.34 0 O-C-N 126.389 2.305 . . . . 0.0 110.428 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.513 ' HG2' ' CD2' ' A' ' 50' ' ' PHE . 1.1 mt-30 -114.73 134.37 55.15 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-O 125.159 2.409 . . . . 0.0 112.88 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -130.04 40.84 3.5 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 108.445 -3.979 . . . . 0.0 110.741 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.0 114.76 0.02 OUTLIER Glycine 0 C--N 1.349 1.304 0 CA-C-N 112.525 -2.125 . . . . 0.0 110.646 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 73.5 -68.9 0.2 Allowed 'General case' 0 C--O 1.217 -0.612 0 O-C-N 126.796 2.115 . . . . 0.0 111.735 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -78.85 92.96 4.92 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.754 1.622 . . . . 0.0 109.934 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.528 ' CE1' HD21 ' A' ' 94' ' ' LEU . 44.8 t80 -98.18 117.59 32.89 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.006 5.191 . . . . 0.0 111.259 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -130.35 86.76 2.42 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 128.236 3.46 . . . . 0.0 117.713 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.77 153.19 44.22 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 128.181 3.426 . . . . 0.0 106.725 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.447 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -156.33 147.1 21.89 Favored 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 128.007 3.317 . . . . 0.0 108.294 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.407 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 1.0 OUTLIER -108.83 151.9 25.61 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 127.001 2.688 . . . . 0.0 107.756 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -134.79 52.51 2.04 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.62 -92.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 1 O-C-N 131.859 5.724 . . . . 0.0 110.315 179.845 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 m 148.15 -53.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.448 1 O-C-N 130.795 5.06 . . . . 0.0 102.288 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.548 ' CD2' ' HG ' ' A' ' 37' ' ' LEU . 3.0 m-85 -51.42 -58.77 5.34 Favored 'General case' 0 N--CA 1.474 0.771 1 O-C-N 130.725 5.016 . . . . 0.0 108.231 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -154.47 111.12 3.3 Favored 'General case' 0 C--N 1.364 1.232 1 CA-C-N 106.952 -4.658 . . . . 0.0 113.823 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.407 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 0.0 OUTLIER -105.39 97.84 7.62 Favored 'General case' 0 C--O 1.218 -0.566 1 O-C-N 130.565 4.916 . . . . 0.0 110.329 179.89 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.0 89.91 3.21 Favored 'General case' 0 C--N 1.318 -0.763 1 O-C-N 129.36 4.163 . . . . 0.0 105.899 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.447 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 21.8 p30 -84.11 165.19 18.7 Favored 'General case' 0 C--O 1.199 -1.579 1 O-C-N 130.688 4.993 . . . . 0.0 115.987 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.529 ' HG ' ' CZ ' ' A' ' 65' ' ' PHE . 10.8 tp -100.58 54.06 0.87 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 111.43 -2.623 . . . . 0.0 112.268 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.41 100.12 12.79 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 124.266 1.984 . . . . 0.0 112.771 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.529 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -151.0 -137.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 112.774 -2.012 . . . . 0.0 110.47 179.478 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.401 HG21 ' N ' ' A' ' 67' ' ' VAL . 1.6 m -156.14 153.44 29.31 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.401 ' N ' HG21 ' A' ' 66' ' ' THR . 3.4 t -76.32 151.91 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.313 0 O-C-N 125.194 1.559 . . . . 0.0 113.81 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 43.64 30.21 1.44 Allowed Glycine 0 C--O 1.215 -1.08 1 O-C-N 130.663 4.977 . . . . 0.0 115.241 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.266 0.8 OUTLIER -102.54 -5.52 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 112.679 -1.761 . . . . 0.0 109.829 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 66.37 99.45 0.05 OUTLIER 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 127.138 2.774 . . . . 0.0 111.78 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -83.38 95.48 8.23 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 127.417 2.948 . . . . 0.0 118.591 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 36.3 p-10 -74.21 76.33 1.8 Allowed 'General case' 0 C--O 1.202 -1.437 0 CA-C-O 123.991 1.853 . . . . 0.0 109.238 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -48.4 128.71 15.02 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 125.044 2.354 . . . . 0.0 113.747 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.32 49.66 2.28 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 127.067 3.318 . . . . 0.0 110.522 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.403 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 8.5 t -70.97 -172.99 0.74 Allowed 'General case' 0 C--O 1.203 -1.372 0 CA-C-N 111.161 -2.745 . . . . 0.0 110.893 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.403 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -165.77 -51.05 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 126.459 3.028 . . . . 0.0 114.262 179.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -90.72 61.56 3.09 Favored Glycine 0 N--CA 1.473 1.141 0 CA-C-N 109.352 -3.567 . . . . 0.0 112.792 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . 0.268 8.4 tp 176.27 -32.43 0.0 OUTLIER 'General case' 0 C--O 1.241 0.612 0 CA-C-N 109.822 -3.189 . . . . 0.0 115.487 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -141.16 -53.68 0.47 Allowed 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.23 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 62.83 65.88 2.88 Favored Glycine 0 C--O 1.206 -1.623 0 CA-C-O 125.481 2.712 . . . . 0.0 111.519 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -127.65 -86.82 0.58 Allowed 'General case' 0 C--N 1.364 1.211 1 CA-C-N 107.043 -4.578 . . . . 0.0 114.372 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 132.36 73.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.117 1 O-C-N 129.271 4.107 . . . . 0.0 108.646 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.67 178.17 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 128.281 3.488 . . . . 0.0 115.929 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -108.85 158.06 18.02 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 133.401 6.688 . . . . 0.0 107.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.7 m -156.1 75.47 0.89 Allowed 'General case' 0 C--O 1.199 -1.602 0 O-C-N 128.267 3.479 . . . . 0.0 111.547 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.06 146.05 44.31 Favored 'General case' 0 N--CA 1.429 -1.507 1 CA-C-N 107.243 -4.526 . . . . 0.0 109.644 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.432 HG23 ' CZ ' ' A' ' 65' ' ' PHE . 3.3 t -131.28 148.98 32.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 C-N-CA 127.08 2.152 . . . . 0.0 107.648 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.44 ' CG2' ' N ' ' A' ' 89' ' ' TRP 0.345 0.9 OUTLIER -166.88 165.89 15.84 Favored 'General case' 0 CA--C 1.473 -2.007 0 CA-C-O 125.893 2.759 . . . . 0.0 112.414 -179.712 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.683 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 38.4 m95 -96.3 113.73 25.34 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-O 113.472 -3.156 . . . . 0.0 109.284 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.49 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 4.9 tp10 -73.74 -45.87 49.37 Favored 'General case' 0 CA--C 1.477 -1.858 1 CA-C-O 131.861 5.601 . . . . 0.0 112.784 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.78 -46.36 0.15 Allowed Glycine 0 CA--C 1.542 1.775 0 CA-C-N 108.692 -3.867 . . . . 0.0 104.94 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -144.16 57.44 1.33 Allowed 'General case' 0 N--CA 1.427 -1.622 0 O-C-N 128.121 2.895 . . . . 0.0 111.268 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.411 HG22 ' CB ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER 170.83 151.93 0.05 OUTLIER 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 108.537 -3.938 . . . . 0.0 117.688 179.475 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.546 ' HB3' ' CG ' ' A' ' 109' ' ' GLN . 0.4 OUTLIER -85.21 3.9 37.14 Favored 'General case' 0 CA--C 1.476 -1.873 1 O-C-N 131.548 5.53 . . . . 0.0 119.637 -178.941 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.49 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.435 27.4 t -3.45 117.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.413 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -131.14 149.11 52.74 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-O 123.538 1.637 . . . . 0.0 109.019 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.6 122.35 54.96 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.597 0 CA-C-N 111.854 -2.43 . . . . 0.0 117.369 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.497 ' CG ' ' HB3' ' A' ' 105' ' ' ARG . 1.2 tt0 -90.22 117.54 29.04 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 120.821 -1.174 . . . . 0.0 108.295 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.0 tppt? -47.94 -36.19 12.01 Favored 'General case' 0 N--CA 1.486 1.341 1 O-C-N 129.476 4.235 . . . . 0.0 108.659 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 65.91 -83.22 0.09 OUTLIER Glycine 0 C--O 1.199 -2.063 0 CA-C-N 112.543 -2.117 . . . . 0.0 113.269 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 91.31 35.32 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.052 1 CA-C-N 107.177 -4.511 . . . . 0.0 110.477 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.471 ' CD ' ' HG2' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 169.69 -42.79 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 110.952 -2.84 . . . . 0.0 113.556 -179.881 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.483 ' HB2' ' CA ' ' A' ' 123' ' ' GLY . 0.2 OUTLIER -129.38 151.56 49.88 Favored 'General case' 0 N--CA 1.433 -1.321 0 O-C-N 127.096 2.747 . . . . 0.0 115.236 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.441 ' HB2' HG23 ' A' ' 121' ' ' THR . 76.5 m-20 -82.82 103.06 12.02 Favored 'General case' 0 N--CA 1.491 1.59 1 O-C-N 132.271 5.982 . . . . 0.0 101.888 179.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.497 ' HB3' ' CG ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -118.96 28.02 8.53 Favored 'General case' 0 C--N 1.31 -1.126 1 O-C-N 130.57 4.919 . . . . 0.0 110.562 -178.88 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -93.7 131.05 10.58 Favored Glycine 0 N--CA 1.427 -1.936 1 CA-C-N 106.583 -4.826 . . . . 0.0 112.703 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.618 ' NE1' ' NE2' ' A' ' 109' ' ' GLN . 0.1 OUTLIER -111.78 147.01 36.58 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 129.133 3.49 . . . . 0.0 107.047 177.383 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.452 ' HD3' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -138.97 -176.16 4.4 Favored 'General case' 0 C--O 1.215 -0.721 1 O-C-N 129.724 4.39 . . . . 0.0 111.111 -179.102 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.641 ' N ' ' CD ' ' A' ' 109' ' ' GLN . 0.1 OUTLIER -156.18 115.61 3.54 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 115.308 -2.557 . . . . 0.0 111.119 -176.168 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.516 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -132.7 124.26 27.85 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 117.422 2.379 . . . . 0.0 117.422 179.506 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 42.3 t -59.5 103.98 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.819 0 CA-C-O 123.718 1.723 . . . . 0.0 112.497 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -101.21 40.34 1.3 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 112.239 -2.255 . . . . 0.0 114.406 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.85 -112.7 3.7 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-N 111.789 -2.46 . . . . 0.0 115.036 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -68.15 -49.51 60.51 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -98.27 -179.08 4.25 Favored 'General case' 0 C--O 1.22 -0.48 0 O-C-N 128.963 3.915 . . . . 0.0 107.568 -179.712 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.406 ' HG ' ' N ' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -143.73 136.72 27.54 Favored 'General case' 0 C--O 1.202 -1.41 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.503 179.722 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.516 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 10.1 m-85 -81.76 163.77 22.17 Favored 'General case' 0 C--O 1.208 -1.115 0 C-N-CA 115.538 -2.465 . . . . 0.0 114.133 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 2.2 tt -130.34 21.0 5.23 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 128.264 3.477 . . . . 0.0 106.804 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.401 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 19.6 mt-10 -28.58 125.55 0.1 Allowed 'General case' 0 N--CA 1.48 1.053 1 O-C-N 131.372 5.42 . . . . 0.0 109.922 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.481 ' HB2' ' CB ' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -143.78 155.8 44.28 Favored 'General case' 0 CA--C 1.488 -1.406 0 C-N-CA 116.012 -2.275 . . . . 0.0 110.518 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.441 HG23 ' HB2' ' A' ' 104' ' ' ASN . 23.5 m -114.82 158.8 21.42 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.358 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.404 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -157.66 49.6 0.42 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 126.379 2.99 . . . . 0.0 113.612 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.483 ' CA ' ' HB2' ' A' ' 103' ' ' GLU . . . 93.09 -100.95 2.72 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 112.968 -1.923 . . . . 0.0 108.699 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.92 -59.93 2.49 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 111.665 -2.267 . . . . 0.0 112.236 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -73.59 174.87 7.68 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 128.031 3.332 . . . . 0.0 108.963 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.1 t -150.35 71.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.821 2 O-C-N 131.307 5.38 . . . . 0.0 113.219 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 114.63 1.45 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 116.337 -1.792 . . . . 0.0 110.696 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.12 79.89 1.66 Allowed 'General case' 0 CA--C 1.497 -1.063 0 O-C-N 128.608 3.693 . . . . 0.0 114.171 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -56.13 129.59 40.7 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.277 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.25 0.4 OUTLIER -110.12 136.92 44.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 123.905 1.812 . . . . 0.0 108.753 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.464 ' N ' ' CD1' ' A' ' 131' ' ' PHE . 67.4 m-85 -128.09 168.23 15.65 Favored 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 111.111 -2.768 . . . . 0.0 116.92 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.405 ' HE2' ' HB2' ' A' ' 10' ' ' GLU 0.354 0.0 OUTLIER -143.61 30.13 1.37 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 116.234 -1.841 . . . . 0.0 108.813 179.881 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.593 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 62.2 176.65 0.13 Allowed 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 117.449 -1.7 . . . . 0.0 111.42 -179.43 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.448 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.259 1.594 0 CA-C-O 116.224 -1.846 . . . . 0.0 114.963 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.201 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.459 ' HB ' ' CB ' ' A' ' 92' ' ' ASN . 0.7 OUTLIER -127.62 -60.29 1.18 Allowed 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 127.265 2.853 . . . . 0.0 106.108 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.34 166.9 11.16 Favored 'General case' 0 CA--C 1.497 -1.083 0 CA-C-N 113.29 -1.777 . . . . 0.0 113.237 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 63.5 t0 67.53 84.54 0.15 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 102.709 -3.071 . . . . 0.0 102.709 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -116.31 46.36 1.6 Allowed 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 44' ' ' VAL . 5.1 t-20 -34.13 137.5 0.11 Allowed 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 126.172 2.17 . . . . 0.0 113.976 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 160.26 -163.53 33.94 Favored Glycine 0 C--O 1.218 -0.887 0 CA-C-O 115.271 -2.961 . . . . 0.0 112.463 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.477 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -136.91 144.47 43.5 Favored 'General case' 0 C--O 1.202 -1.434 1 O-C-N 132.725 5.603 . . . . 0.0 103.688 -179.828 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.517 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.283 0.0 OUTLIER -141.56 137.16 31.77 Favored 'General case' 0 CA--C 1.496 -1.119 1 O-C-N 131.832 5.708 . . . . 0.0 112.891 -179.191 . . . . . . . . 5 4 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.5 mm-40 -81.5 5.12 18.82 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 125.52 1.763 . . . . 0.0 115.551 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.0 ttp 58.61 -91.01 0.03 OUTLIER 'General case' 0 C--O 1.246 0.919 0 CA-C-O 111.955 -3.879 . . . . 0.0 104.134 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.8 tt0 119.54 -45.56 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.985 1 O-C-N 129.495 4.247 . . . . 0.0 110.106 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.96 155.84 5.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.479 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.84 169.89 12.77 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 110.563 -3.017 . . . . 0.0 111.882 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -121.93 124.96 45.3 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 128.812 3.82 . . . . 0.0 113.118 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 t30 46.35 84.5 0.03 OUTLIER 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 124.051 1.881 . . . . 0.0 112.645 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -92.12 -30.56 15.91 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-N 112.769 -2.014 . . . . 0.0 112.871 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.46 ' HA ' ' CG ' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -71.24 -56.78 5.35 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.064 -2.398 . . . . 0.0 112.608 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.4 ' HA2' ' HB2' ' A' ' 22' ' ' LYS . . . -53.87 -23.59 23.25 Favored Glycine 0 CA--C 1.489 -1.57 1 O-C-N 132.276 5.985 . . . . 0.0 113.252 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.87 -49.58 19.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 126.843 3.211 . . . . 0.0 108.128 179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.404 ' HB2' ' HB2' ' A' ' 31' ' ' ARG . 19.7 mmm -68.77 -20.54 64.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 119.73 -1.856 . . . . 0.0 112.345 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.4 ' HB2' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.8 -22.77 42.69 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.55 3.031 . . . . 0.0 110.341 179.754 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -37.33 63.71 Favored 'General case' 0 C--O 1.207 -1.177 1 O-C-N 131.745 5.653 . . . . 0.0 112.806 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.84 9.36 40.78 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 128.446 3.591 . . . . 0.0 108.802 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 32.53 66.94 0.17 Allowed 'General case' 0 CA--C 1.482 -1.647 0 CA-C-O 127.008 3.29 . . . . 0.0 113.348 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.4 HG23 ' HE2' ' A' ' 21' ' ' MET . 10.7 tt -87.5 -31.48 5.91 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-O 126.685 3.136 . . . . 0.0 112.355 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.05 -176.55 0.25 Allowed 'General case' 0 C--N 1.36 1.044 0 CA-C-N 112.72 -2.036 . . . . 0.0 112.832 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.445 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 26.4 m-85 -125.0 35.73 4.73 Favored 'General case' 0 CA--C 1.501 -0.915 0 O-C-N 126.517 2.386 . . . . 0.0 111.127 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.52 177.36 6.71 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.258 3.474 . . . . 0.0 106.736 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 76.97 -62.46 0.4 Allowed 'General case' 0 C--O 1.214 -0.807 0 O-C-N 128.747 3.78 . . . . 0.0 111.423 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' CG ' ' HA ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -38.4 -19.74 0.01 OUTLIER 'General case' 0 C--O 1.243 0.755 1 O-C-N 130.735 5.022 . . . . 0.0 113.079 -179.86 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -86.81 -32.4 20.34 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 127.668 3.105 . . . . 0.0 111.906 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -111.42 36.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 128.665 3.728 . . . . 0.0 115.071 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.26 23.25 11.95 Favored 'General case' 0 C--O 1.201 -1.491 0 CA-C-O 126.081 2.848 . . . . 0.0 108.568 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.431 ' O ' ' CE1' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -62.96 178.74 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 108.785 -3.825 . . . . 0.0 106.65 176.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HD3' ' N ' ' A' ' 36' ' ' ARG . 4.2 mpt_? -49.04 -30.39 6.19 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 127.584 3.052 . . . . 0.0 112.254 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.512 HD22 ' CG ' ' A' ' 58' ' ' PHE . 3.8 pp 29.84 108.48 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 2 O-C-N 134.822 7.576 . . . . 0.0 113.479 177.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.6 m 57.17 42.95 24.77 Favored 'General case' 0 CA--C 1.479 -1.767 0 CA-C-N 110.793 -2.912 . . . . 0.0 118.333 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.512 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.3 OUTLIER -159.34 -97.59 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.517 ' CG2' ' N ' ' A' ' 41' ' ' LYS . 1.3 m 172.56 159.15 0.11 Allowed 'General case' 0 C--O 1.199 -1.566 0 O-C-N 128.842 3.839 . . . . 0.0 112.387 -175.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.517 ' N ' ' CG2' ' A' ' 40' ' ' THR . 0.0 OUTLIER -111.98 158.21 19.79 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 101.708 -3.441 . . . . 0.0 101.708 178.43 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.476 ' N ' ' O ' ' A' ' 53' ' ' LYS . 2.1 mp -134.32 156.85 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 119.912 1.233 . . . . 0.0 111.587 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.415 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 5.3 tt -132.31 135.74 57.49 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 0 CA-C-N 111.248 -2.705 . . . . 0.0 107.828 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.463 ' CG1' ' N ' ' A' ' 45' ' ' GLN . 2.3 t -110.49 -64.97 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 N-CA-C 116.323 1.971 . . . . 0.0 116.323 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.463 ' N ' ' CG1' ' A' ' 44' ' ' VAL . 1.7 tm0? 65.32 140.24 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 125.851 2.739 . . . . 0.0 112.071 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -165.6 71.93 0.16 Allowed 'General case' 0 C--N 1.363 1.189 0 CA-C-N 110.244 -3.162 . . . . 0.0 114.007 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.06 -89.07 1.5 Allowed Glycine 0 C--O 1.216 -1.025 0 CA-C-O 122.893 1.274 . . . . 0.0 110.793 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -108.76 -44.47 4.02 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 109.586 -3.307 . . . . 0.0 110.788 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.16 95.49 0.13 Allowed 'General case' 0 C--N 1.357 0.904 0 O-C-N 127.269 2.856 . . . . 0.0 109.172 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.494 ' CE2' HD21 ' A' ' 94' ' ' LEU . 42.5 t80 -95.91 95.75 8.46 Favored 'General case' 0 CA--C 1.496 -1.134 1 O-C-N 129.539 4.274 . . . . 0.0 113.021 -179.933 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.44 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 43.7 mttt -105.65 165.63 11.03 Favored 'General case' 0 CA--C 1.491 -1.297 0 O-C-N 128.789 3.806 . . . . 0.0 113.84 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -148.61 111.35 4.79 Favored 'General case' 0 CA--C 1.499 -0.997 1 O-C-N 131.047 5.217 . . . . 0.0 107.797 179.713 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.57 153.17 42.55 Favored 'General case' 0 C--O 1.208 -1.128 0 C-N-CA 117.666 -1.614 . . . . 0.0 111.289 -179.468 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.6 157.67 17.02 Favored 'General case' 0 C--N 1.313 -0.979 0 O-C-N 125.878 1.986 . . . . 0.0 111.073 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -107.82 -18.58 13.78 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-O 113.824 -2.989 . . . . 0.0 115.233 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.434 ' HB2' ' CD1' ' A' ' 58' ' ' PHE . 16.5 p -16.85 152.22 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.181 1 O-C-N 135.703 8.127 . . . . 0.0 113.566 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.84 -33.19 57.94 Favored 'General case' 0 CA--C 1.504 -0.819 1 CA-C-N 107.588 -4.369 . . . . 0.0 109.038 179.519 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.512 ' CG ' HD22 ' A' ' 37' ' ' LEU . 5.8 p90 -68.14 -53.31 26.1 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 126.938 2.648 . . . . 0.0 114.438 -179.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -172.47 130.81 0.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 O-C-N 127.985 3.303 . . . . 0.0 110.183 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 90.64 5.81 Favored 'General case' 0 C--O 1.204 -1.318 0 O-C-N 127.604 3.065 . . . . 0.0 113.409 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.58 141.68 37.46 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 109.083 -3.689 . . . . 0.0 109.047 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.91 161.52 14.38 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 126.877 2.611 . . . . 0.0 116.095 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.1 tp -109.99 62.22 0.6 Allowed 'General case' 0 C--O 1.214 -0.781 0 O-C-N 129.096 3.997 . . . . 0.0 110.753 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.44 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 7.2 p-10 -71.11 93.99 1.09 Allowed 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 112.568 -2.106 . . . . 0.0 111.141 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.675 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -127.85 169.36 13.99 Favored 'General case' 0 CA--C 1.494 -1.181 0 CA-C-O 126.686 3.136 . . . . 0.0 109.31 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.41 ' CG2' ' N ' ' A' ' 67' ' ' VAL . 0.6 OUTLIER -147.97 172.82 13.61 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 110.302 -3.135 . . . . 0.0 106.972 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.41 ' N ' ' CG2' ' A' ' 66' ' ' THR . 21.3 t -87.59 142.82 12.44 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.463 0 O-C-N 126.459 2.35 . . . . 0.0 115.664 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 37.78 33.55 0.14 Allowed Glycine 0 C--N 1.342 0.894 1 O-C-N 129.806 4.441 . . . . 0.0 116.721 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 13.4 p -81.24 -14.22 12.6 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.941 0 C-N-CA 117.797 -1.561 . . . . 0.0 108.459 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 72' ' ' ASP . 24.6 tt0 58.31 75.77 0.37 Allowed 'General case' 0 C--N 1.355 0.815 0 O-C-N 128.692 3.745 . . . . 0.0 109.361 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.11 81.13 0.02 OUTLIER 'General case' 0 C--N 1.345 0.409 1 O-C-N 131.983 5.802 . . . . 0.0 111.039 179.769 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 70' ' ' GLU . 24.3 t70 -60.27 76.74 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.465 ' HG2' ' CA ' ' A' ' 83' ' ' VAL 0.272 32.6 mt-10 57.45 111.48 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.207 0 O-C-N 125.823 1.952 . . . . 0.0 113.698 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.524 ' CE1' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER 176.2 69.17 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 108.667 -3.879 . . . . 0.0 111.923 179.558 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 82.4 p -99.26 -27.97 13.54 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 110.318 -3.128 . . . . 0.0 115.675 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.524 ' HE2' ' CE1' ' A' ' 74' ' ' HIS . 0.1 OUTLIER -35.92 153.94 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 1 O-C-N 130.049 4.593 . . . . 0.0 114.772 -179.819 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.6 24.12 Favored Glycine 0 C--O 1.218 -0.89 0 CA-C-N 111.218 -2.719 . . . . 0.0 110.664 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 10.8 tp -163.73 -47.75 0.03 OUTLIER 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 126.963 3.268 . . . . 0.0 112.505 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.79 -67.04 1.03 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 110.562 -3.017 . . . . 0.0 113.24 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.98 69.93 1.16 Allowed Glycine 0 C--O 1.209 -1.44 0 CA-C-O 125.727 2.848 . . . . 0.0 110.842 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.412 ' NE ' ' HA ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -114.47 -156.04 0.59 Allowed 'General case' 0 N--CA 1.49 1.567 1 CA-C-N 107.399 -4.4 . . . . 0.0 107.944 -179.585 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.464 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.3 OUTLIER -174.52 82.21 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 127.544 3.027 . . . . 0.0 108.118 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.465 ' CA ' ' HG2' ' A' ' 73' ' ' GLU . 2.3 t -138.09 153.54 27.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 N-CA-C 118.17 2.655 . . . . 0.0 118.17 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.97 147.05 20.59 Favored 'General case' 0 C--O 1.239 0.524 1 O-C-N 129.592 4.307 . . . . 0.0 106.334 179.448 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.1 m -152.83 70.79 0.9 Allowed 'General case' 0 C--O 1.199 -1.553 1 O-C-N 130.589 4.931 . . . . 0.0 112.066 -179.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.0 tp -70.65 140.88 51.67 Favored 'General case' 0 C--O 1.209 -1.039 1 CA-C-N 107.114 -4.585 . . . . 0.0 115.298 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.403 ' CG1' HD12 ' A' ' 94' ' ' LEU . 2.2 t -116.79 142.31 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 111.728 -2.487 . . . . 0.0 107.012 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.253 16.4 m -159.1 161.82 36.45 Favored 'General case' 0 CA--C 1.48 -1.75 0 O-C-N 126.175 2.172 . . . . 0.0 111.499 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.677 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 33.5 m95 -98.87 143.97 28.6 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 128.309 2.644 . . . . 0.0 107.957 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 93' ' ' THR . 9.7 tp10 -99.46 -30.78 11.98 Favored 'General case' 0 C--O 1.195 -1.794 1 CA-C-O 128.521 4.01 . . . . 0.0 112.09 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.44 -40.25 0.51 Allowed Glycine 0 C--O 1.21 -1.371 1 N-CA-C 102.751 -4.14 . . . . 0.0 102.751 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.459 ' CB ' ' HB ' ' A' ' 2' ' ' THR . 10.7 p-10 -149.54 31.04 0.74 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.767 5.04 . . . . 0.0 111.579 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.456 ' O ' ' N ' ' A' ' 90' ' ' GLU . 5.5 t -167.74 149.67 5.59 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 117.672 2.471 . . . . 0.0 117.672 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.494 HD21 ' CE2' ' A' ' 50' ' ' PHE . 1.6 tp -85.81 87.24 7.38 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 118.036 2.606 . . . . 0.0 118.036 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.335 53.4 t -81.79 120.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.361 1.101 0 O-C-N 128.006 3.317 . . . . 0.0 112.451 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.532 ' HB2' ' CZ3' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -143.07 143.69 31.96 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 126.79 3.185 . . . . 0.0 108.916 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.9 m -133.55 144.08 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 108.459 -3.973 . . . . 0.0 117.813 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.406 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -96.57 101.03 12.58 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 110.692 -2.958 . . . . 0.0 106.959 178.784 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -92.31 96.11 10.09 Favored 'General case' 0 CA--C 1.496 -1.101 0 C-N-CA 114.449 -2.9 . . . . 0.0 114.229 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 138.86 160.49 8.4 Favored Glycine 0 C--N 1.348 1.218 1 CA-C-O 128.055 4.142 . . . . 0.0 114.267 179.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.16 178.19 0.06 Allowed 'General case' 0 CA--C 1.499 -1.016 1 CA-C-N 106.631 -4.785 . . . . 0.0 108.553 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.86 -68.35 0.2 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 117.218 2.303 . . . . 0.0 117.218 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -56.31 158.87 3.9 Favored 'General case' 0 C--O 1.2 -1.511 0 CA-C-N 111.253 -2.703 . . . . 0.0 116.671 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.82 105.98 11.23 Favored 'General case' 0 N--CA 1.492 1.637 2 O-C-N 130.094 4.621 . . . . 0.0 102.493 179.719 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.421 ' HD2' ' HA ' ' A' ' 105' ' ' ARG . 19.5 mmm-85 -108.05 31.78 5.26 Favored 'General case' 0 C--N 1.32 -0.68 1 O-C-N 130.308 4.755 . . . . 0.0 112.272 -179.68 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -62.77 83.78 0.04 OUTLIER Glycine 0 N--CA 1.428 -1.848 2 O-C-N 131.209 5.318 . . . . 0.0 113.564 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.675 ' CH2' ' CE2' ' A' ' 65' ' ' PHE 0.283 0.0 OUTLIER -99.44 128.38 45.55 Favored 'General case' 0 C--N 1.319 -0.728 1 O-C-N 131.817 5.069 . . . . 0.0 109.962 179.721 . . . . . . . . 5 4 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.556 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.8 OUTLIER -160.92 150.13 16.83 Favored 'General case' 0 CA--C 1.508 -0.647 1 O-C-N 130.074 4.609 . . . . 0.0 117.052 -177.007 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -106.42 179.01 4.39 Favored 'General case' 0 C--N 1.359 0.984 0 CA-C-O 113.497 -3.144 . . . . 0.0 109.648 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.556 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 0.7 OUTLIER 173.37 82.69 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.279 1 O-C-N 131.726 5.641 . . . . 0.0 117.71 178.526 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 80.6 t -45.57 102.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.761 0 CA-C-O 127.973 3.749 . . . . 0.0 116.239 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.442 ' HG3' ' CD1' ' A' ' 117' ' ' TYR . 4.8 mt-10 -85.31 20.28 2.04 Favored 'General case' 0 N--CA 1.484 1.238 1 CA-C-N 108.345 -4.025 . . . . 0.0 116.042 -179.642 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.49 -101.28 0.33 Allowed Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.148 1.219 . . . . 0.0 116.148 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.53 12.69 25.88 Favored 'General case' 0 C--O 1.207 -1.137 0 N-CA-C 118.302 2.705 . . . . 0.0 118.302 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.427 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.7 OUTLIER -143.7 172.89 12.2 Favored 'General case' 0 C--N 1.32 -0.705 2 O-C-N 132.192 5.933 . . . . 0.0 109.388 179.837 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.409 ' O ' ' CG ' ' A' ' 131' ' ' PHE . 0.6 OUTLIER -138.78 121.05 15.88 Favored 'General case' 0 CA--C 1.48 -1.74 1 O-C-N 129.88 4.487 . . . . 0.0 111.713 179.942 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.45 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 4.7 m-85 -76.83 158.51 30.77 Favored 'General case' 0 C--O 1.213 -0.857 0 C-N-CA 115.888 -2.325 . . . . 0.0 116.097 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.51 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -137.95 46.49 2.07 Favored 'General case' 0 C--N 1.349 0.572 2 O-C-N 130.039 4.587 . . . . 0.0 108.261 179.789 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -62.03 157.32 19.07 Favored 'General case' 0 CA--C 1.506 -0.739 0 C-N-CA 127.067 2.147 . . . . 0.0 109.338 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.81 177.08 5.93 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 116.735 -1.986 . . . . 0.0 111.305 179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 47.7 m -135.8 155.71 49.93 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.412 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.2 OUTLIER -159.05 72.28 0.55 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 126.01 2.814 . . . . 0.0 114.155 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.27 58.15 9.24 Favored Glycine 0 CA--C 1.532 1.131 0 CA-C-N 112.039 -2.346 . . . . 0.0 111.273 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 62.98 52.6 2.55 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 126.523 1.929 . . . . 0.0 109.594 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -137.46 26.23 2.86 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-N 111.684 -2.507 . . . . 0.0 109.191 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 89.6 t -18.63 86.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.963 1 O-C-N 129.688 4.367 . . . . 0.0 111.653 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.42 150.78 31.2 Favored 'General case' 0 CA--C 1.49 -1.357 0 CA-C-N 111.936 -2.393 . . . . 0.0 112.843 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -124.71 151.13 45.41 Favored 'General case' 0 C--N 1.353 0.749 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.333 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -136.95 166.31 23.95 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 127.015 2.697 . . . . 0.0 114.862 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.3 t -150.94 143.26 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-O 128.117 3.818 . . . . 0.0 105.99 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.51 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 29.6 m-85 -137.34 -175.83 4.19 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-N 108.988 -3.733 . . . . 0.0 114.48 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.427 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -168.77 122.74 0.85 Allowed 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 178.767 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.474 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 35.7 ttpt -50.54 95.55 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 112.467 -2.152 . . . . 0.0 116.013 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt . . . . . 0 C--O 1.259 1.556 0 O-C-N 126.789 2.556 . . . . 0.0 116.499 179.604 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 mtm . . . . . 0 N--CA 1.499 1.98 0 CA-C-O 121.32 0.581 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.62 141.82 2.98 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.457 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm 45.16 76.04 0.1 Allowed 'General case' 0 CA--C 1.493 -1.22 0 O-C-N 127.899 3.249 . . . . 0.0 118.654 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.477 ' HA ' ' CG2' ' A' ' 111' ' ' VAL . 22.9 m-20 53.1 -104.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -170.22 -146.96 0.05 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 114.96 -2.447 . . . . 0.0 105.888 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -170.77 104.94 0.25 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 130.513 3.525 . . . . 0.0 113.242 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -179.81 -117.43 0.55 Allowed Glycine 0 C--O 1.201 -1.953 0 CA-C-O 116.844 -2.087 . . . . 0.0 113.725 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 40' ' ' THR . 30.8 m -167.69 145.61 4.55 Favored 'General case' 0 C--O 1.216 -0.664 1 O-C-N 130.26 4.153 . . . . 0.0 108.439 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.554 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.287 0.0 OUTLIER -132.65 125.27 29.97 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 128.441 3.588 . . . . 0.0 112.489 -179.785 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -75.37 -4.06 37.2 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 127.16 2.787 . . . . 0.0 115.004 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.544 ' HG3' ' CE1' ' A' ' 131' ' ' PHE 0.27 16.0 ttm 57.86 62.0 2.22 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 116.209 -1.853 . . . . 0.0 107.266 179.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -34.91 -34.7 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 127.766 3.166 . . . . 0.0 111.842 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.29 0.2 OUTLIER -151.39 154.67 37.11 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-O 124.889 2.281 . . . . 0.0 112.254 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -129.92 125.2 34.95 Favored 'General case' 0 CA--C 1.503 -0.864 1 CA-C-N 107.629 -4.351 . . . . 0.0 116.695 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.443 ' CB ' ' HB3' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -112.34 122.88 48.98 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 132.042 5.839 . . . . 0.0 113.892 179.934 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.5 t30 49.99 84.64 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 124.024 1.868 . . . . 0.0 114.323 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.62 -37.58 9.08 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-O 125.725 2.679 . . . . 0.0 111.88 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.255 28.9 tt0 -79.24 -36.25 40.25 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 110.708 -2.951 . . . . 0.0 113.032 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.05 -22.92 76.15 Favored Glycine 0 CA--C 1.486 -1.775 0 O-C-N 128.914 3.884 . . . . 0.0 112.286 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -29.75 65.94 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 123.274 1.511 . . . . 0.0 108.899 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.43 -29.99 57.23 Favored 'General case' 0 CA--C 1.49 -1.338 0 C-N-CA 116.616 -2.034 . . . . 0.0 110.648 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -75.6 -29.76 59.37 Favored 'General case' 0 C--N 1.313 -0.981 0 O-C-N 128.089 3.368 . . . . 0.0 111.25 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.19 -48.71 79.47 Favored 'General case' 0 C--N 1.315 -0.91 1 O-C-N 129.979 4.549 . . . . 0.0 114.485 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -90.15 -12.33 38.54 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 110.262 -3.154 . . . . 0.0 108.789 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 53.27 104.83 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 O-C-N 128.279 3.487 . . . . 0.0 107.387 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 9.6 tt -112.17 -43.05 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 CA-C-N 110.656 -2.975 . . . . 0.0 109.18 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -170.09 33.69 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 118.489 -2.632 . . . . 0.0 112.844 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.463 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.2 OUTLIER 36.16 76.44 0.05 OUTLIER 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 76.83 63.06 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 124.96 2.314 . . . . 0.0 106.29 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -63.69 -43.28 97.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 108.531 -3.941 . . . . 0.0 109.763 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . 0.272 0.0 OUTLIER -74.69 -105.19 0.01 OUTLIER 'General case' 0 C--O 1.246 0.874 2 O-C-N 130.655 4.972 . . . . 0.0 110.527 179.88 . . . . . . . . 4 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.9 tttm 86.77 -3.19 0.67 Allowed 'General case' 0 C--O 1.203 -1.376 0 O-C-N 128.223 3.452 . . . . 0.0 110.07 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.459 ' CD1' ' N ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -155.42 31.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 O-C-N 127.059 2.725 . . . . 0.0 108.588 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -138.86 24.09 2.6 Favored 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 112.864 -1.971 . . . . 0.0 110.151 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 t -44.85 -37.37 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.168 0 CA-C-O 125.276 2.465 . . . . 0.0 109.497 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.507 ' C ' ' CD1' ' A' ' 37' ' ' LEU . 0.0 OUTLIER 177.89 168.85 0.72 Allowed 'General case' 0 C--O 1.216 -0.702 1 CA-C-N 106.568 -4.833 . . . . 0.0 111.081 178.814 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.578 ' CD2' ' N ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -150.64 -103.98 0.06 Allowed 'General case' 0 C--N 1.316 -0.89 2 O-C-N 132.1 5.875 . . . . 0.0 107.662 -176.922 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.458 ' N ' HD21 ' A' ' 37' ' ' LEU . 35.0 m -130.15 38.65 3.76 Favored 'General case' 0 CA--C 1.488 -1.429 0 O-C-N 127.633 3.083 . . . . 0.0 111.991 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -47.2 150.28 0.86 Allowed 'General case' 0 N--CA 1.481 1.076 0 O-C-N 120.236 -1.54 . . . . 0.0 115.066 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 8' ' ' THR . 22.1 m -168.88 108.09 0.46 Allowed 'General case' 0 C--O 1.216 -0.702 1 O-C-N 130.904 5.128 . . . . 0.0 114.33 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.424 ' C ' ' CD ' ' A' ' 41' ' ' LYS . 3.7 tmtt? -94.13 144.34 25.58 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 127.482 2.989 . . . . 0.0 107.166 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.445 ' CG2' ' N ' ' A' ' 43' ' ' ILE . 4.2 mt -124.9 161.67 28.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.327 0 O-C-N 126.449 2.343 . . . . 0.0 110.622 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.445 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 12.7 tt -139.26 130.61 34.37 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.508 0 CA-C-N 110.419 -3.082 . . . . 0.0 107.517 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.0 t -106.94 -61.14 2.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 CA-C-O 115.538 -2.172 . . . . 0.0 112.117 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 50.5 130.08 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.265 0 CA-C-O 126.64 3.114 . . . . 0.0 115.946 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -163.95 32.46 0.08 Allowed 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 109.434 -3.53 . . . . 0.0 112.913 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 114.92 -118.67 4.4 Favored Glycine 0 C--N 1.345 1.04 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -79.57 -31.01 41.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 118.073 -1.451 . . . . 0.0 112.69 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -105.45 91.51 3.8 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.729 2.811 . . . . 0.0 108.755 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.495 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 14.7 t80 -103.55 137.6 41.4 Favored 'General case' 0 CA--C 1.48 -1.73 1 O-C-N 129.642 4.339 . . . . 0.0 114.766 -179.444 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.411 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -147.99 99.8 3.11 Favored 'General case' 0 C--O 1.203 -1.363 0 N-CA-C 118.317 2.71 . . . . 0.0 118.317 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.403 HG23 ' HB2' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -73.87 153.88 39.68 Favored 'General case' 0 C--O 1.245 0.822 0 O-C-N 128.629 3.706 . . . . 0.0 105.739 177.807 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.444 ' HG2' HD11 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -159.69 134.76 8.08 Favored 'General case' 0 CA--C 1.483 -1.62 0 C-N-CA 115.197 -2.601 . . . . 0.0 111.876 -178.554 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -97.64 152.52 18.99 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.736 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -144.49 36.21 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 114.267 -1.333 . . . . 0.0 114.021 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -37.73 -46.48 0.9 Allowed 'General case' 0 C--N 1.317 -0.824 0 O-C-N 128.535 3.647 . . . . 0.0 106.171 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 88.95 10.35 0.09 Allowed 'General case' 0 N--CA 1.481 1.101 1 O-C-N 130.959 5.162 . . . . 0.0 106.219 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.408 ' CG ' ' HG ' ' A' ' 37' ' ' LEU . 0.4 OUTLIER -110.4 -51.99 2.82 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 110.765 -2.925 . . . . 0.0 110.998 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.517 ' NH2' ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -164.73 90.56 0.54 Allowed 'General case' 0 C--N 1.359 1.019 0 CA-C-N 109.076 -3.693 . . . . 0.0 109.985 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.415 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 0.0 OUTLIER -91.85 126.27 36.87 Favored 'General case' 0 N--CA 1.431 -1.418 1 CA-C-N 108.061 -4.154 . . . . 0.0 111.854 -179.708 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.517 ' CE1' ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -128.55 47.57 2.43 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 128.722 3.764 . . . . 0.0 107.184 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -28.86 133.54 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 O-C-N 128.937 3.898 . . . . 0.0 113.769 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.54 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 11.7 tp -82.48 56.31 3.25 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -92.4 99.89 12.56 Favored 'General case' 0 C--O 1.205 -1.252 0 O-C-N 126.182 2.176 . . . . 0.0 112.823 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.54 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -147.89 -157.19 0.79 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 126.526 1.931 . . . . 0.0 107.386 179.134 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.44 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.5 OUTLIER -128.27 179.27 5.71 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 178.209 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.561 HG12 ' CD1' ' A' ' 89' ' ' TRP . 4.1 t -118.97 115.58 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.8 1 O-C-N 129.714 4.384 . . . . 0.0 109.96 -179.206 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.72 -24.34 22.06 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 116.448 -2.787 . . . . 0.0 111.561 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.8 t -92.48 89.69 2.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 112.587 -1.806 . . . . 0.0 109.378 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -37.28 102.71 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.761 1 O-C-N 129.879 4.487 . . . . 0.0 113.137 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.44 86.95 0.63 Allowed 'General case' 0 C--N 1.355 0.828 0 O-C-N 126.045 2.091 . . . . 0.0 111.432 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -48.04 85.3 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.51 0 CA-C-N 112.153 -2.294 . . . . 0.0 116.193 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 57.84 -165.76 0.16 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 120.827 1.649 . . . . 0.0 108.824 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 92.08 112.83 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.963 0 CA-C-N 110.251 -3.159 . . . . 0.0 110.48 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.418 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 71.4 p -134.11 -105.81 0.23 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 110.921 -2.854 . . . . 0.0 113.462 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 58.56 162.89 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 126.235 2.922 . . . . 0.0 114.613 -179.694 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 64.23 19.95 64.6 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-N 108.582 -3.917 . . . . 0.0 107.713 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.9 tp -159.15 -52.75 0.06 Allowed 'General case' 0 N--CA 1.475 0.796 0 O-C-N 127.485 2.52 . . . . 0.0 114.826 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -125.13 -66.23 0.97 Allowed 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 125.679 2.657 . . . . 0.0 110.421 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.35 74.07 1.21 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.665 2.079 . . . . 0.0 116.608 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -150.65 -130.97 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 112.045 -2.078 . . . . 0.0 113.672 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -169.4 115.67 0.58 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.659 1.118 . . . . 0.0 108.843 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.435 HG11 ' N ' ' A' ' 100' ' ' GLY . 75.6 t -138.09 149.61 24.74 Favored 'Isoleucine or valine' 0 C--N 1.365 1.254 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -179.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.39 103.86 0.56 Allowed 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 112.281 -2.236 . . . . 0.0 106.877 178.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.4 m -115.95 78.47 1.19 Allowed 'General case' 0 C--O 1.208 -1.131 0 O-C-N 126.994 2.684 . . . . 0.0 111.557 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.5 tp -86.6 148.95 25.26 Favored 'General case' 0 C--O 1.209 -1.072 1 CA-C-N 106.572 -4.831 . . . . 0.0 109.647 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 49.7 t -135.82 147.33 28.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 125.826 1.651 . . . . 0.0 107.602 179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.7 t -167.71 126.96 1.31 Allowed 'General case' 0 CA--C 1.474 -1.979 0 CA-C-O 127.561 3.553 . . . . 0.0 111.934 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.671 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 21.2 m95 -64.09 144.38 57.15 Favored 'General case' 0 C--N 1.346 0.454 0 O-C-N 116.877 -3.639 . . . . 0.0 102.792 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.7 OUTLIER -104.33 -3.48 24.12 Favored 'General case' 0 CA--C 1.471 -2.087 1 CA-C-O 131.673 5.511 . . . . 0.0 118.689 -177.83 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 116.08 -13.51 16.7 Favored Glycine 0 C--O 1.198 -2.126 1 N-CA-C 102.883 -4.087 . . . . 0.0 102.883 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 179.33 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.609 1 O-C-N 131.325 4.78 . . . . 0.0 111.891 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.599 ' O ' ' N ' ' A' ' 90' ' ' GLU 0.315 12.6 t 161.49 130.26 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 128.093 2.557 . . . . 0.0 116.386 179.448 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.576 ' N ' ' CZ3' ' A' ' 89' ' ' TRP . 6.4 tp -52.48 -38.16 58.83 Favored 'General case' 0 CA--C 1.482 -1.66 0 N-CA-C 118.63 2.826 . . . . 0.0 118.63 -177.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.469 ' CG2' HG21 ' A' ' 93' ' ' THR . 18.1 t 28.7 120.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.285 0 N-CA-C 120.63 3.567 . . . . 0.0 120.63 -178.082 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.462 ' SG ' ' CZ3' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -139.52 137.79 35.77 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 103.416 -2.809 . . . . 0.0 103.416 179.314 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.41 ' O ' ' N ' ' A' ' 99' ' ' LYS . 3.5 t -119.93 96.57 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 119.439 3.125 . . . . 0.0 119.439 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.404 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 5.1 mm-40 -66.0 94.12 0.22 Allowed 'General case' 0 C--N 1.364 1.215 0 CA-C-O 123.992 1.853 . . . . 0.0 106.504 178.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' A' ' 97' ' ' VAL . 3.4 tttp -91.59 -56.19 3.21 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 110.036 -3.257 . . . . 0.0 114.404 -178.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.435 ' N ' HG11 ' A' ' 83' ' ' VAL . . . -49.58 146.13 7.56 Favored Glycine 0 C--O 1.206 -1.612 0 CA-C-O 124.426 2.125 . . . . 0.0 112.599 -179.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 69.98 165.79 0.28 Allowed 'General case' 0 CA--C 1.498 -1.046 1 CA-C-N 107.808 -4.196 . . . . 0.0 108.865 179.8 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.423 ' HD2' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -43.57 -48.68 7.56 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.468 2.307 . . . . 0.0 113.09 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.423 ' N ' ' HD2' ' A' ' 102' ' ' LYS . 3.3 mm-40 -42.27 147.72 0.24 Allowed 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 109.964 -3.289 . . . . 0.0 116.147 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -125.15 71.4 1.19 Allowed 'General case' 0 N--CA 1.492 1.632 1 CA-C-N 106.451 -4.886 . . . . 0.0 101.971 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.427 ' HD2' ' HA ' ' A' ' 122' ' ' CYS . 28.8 mmm-85 -88.65 1.85 54.3 Favored 'General case' 0 C--O 1.204 -1.326 1 O-C-N 131.749 5.656 . . . . 0.0 114.045 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.404 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.65 98.43 0.01 OUTLIER Glycine 0 N--CA 1.43 -1.764 2 O-C-N 134.256 7.222 . . . . 0.0 116.596 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.609 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.283 0.0 OUTLIER -108.89 126.92 53.58 Favored 'General case' 0 C--O 1.214 -0.764 1 O-C-N 131.074 4.632 . . . . 0.0 109.068 178.725 . . . . . . . . 5 4 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.55 ' HG3' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -162.48 178.57 8.49 Favored 'General case' 0 C--O 1.209 -1.055 1 O-C-N 130.877 5.111 . . . . 0.0 112.81 -179.074 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.471 ' CG ' ' HB3' ' A' ' 94' ' ' LEU 0.286 0.0 OUTLIER -133.28 -177.22 4.42 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 112.985 -3.388 . . . . 0.0 107.644 -179.825 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.55 ' CZ3' ' HG3' ' A' ' 108' ' ' LYS . 0.6 OUTLIER 174.93 92.66 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.416 1 O-C-N 131.445 5.466 . . . . 0.0 118.183 178.221 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.477 ' CG2' ' HA ' ' A' ' 4' ' ' ASP 0.277 77.5 t -31.64 100.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.783 0 O-C-N 119.134 -2.229 . . . . 0.0 115.774 179.714 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.487 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -101.41 4.05 41.03 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 112.348 -2.205 . . . . 0.0 116.617 -179.595 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 151.0 -94.08 0.15 Allowed Glycine 0 N--CA 1.435 -1.368 0 O-C-N 120.767 -1.208 . . . . 0.0 113.789 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -118.62 24.66 10.76 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 117.692 2.479 . . . . 0.0 117.692 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.423 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -172.79 153.38 2.68 Favored 'General case' 0 CA--C 1.508 -0.654 1 O-C-N 129.931 4.519 . . . . 0.0 110.477 -179.792 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.522 HD11 ' CZ2' ' A' ' 9' ' ' TRP . 2.3 mt -96.26 112.53 24.24 Favored 'General case' 0 C--O 1.199 -1.565 1 O-C-N 129.386 4.179 . . . . 0.0 114.667 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.487 ' CD1' ' HB2' ' A' ' 112' ' ' GLU . 17.6 m-85 -74.0 98.11 2.99 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 114.596 -2.842 . . . . 0.0 115.661 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.418 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -80.27 79.14 6.89 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 128.73 3.769 . . . . 0.0 108.047 179.786 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.458 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 4.3 mt-10 -93.88 122.34 36.28 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 125.373 1.671 . . . . 0.0 109.783 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.03 150.47 51.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 126.363 2.29 . . . . 0.0 109.025 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.5 m -106.24 168.04 9.41 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.427 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -162.72 41.91 0.12 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 125.991 2.805 . . . . 0.0 115.618 -179.704 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 76.06 70.62 1.25 Allowed Glycine 0 C--O 1.218 -0.876 0 CA-C-N 109.547 -3.478 . . . . 0.0 111.731 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 102.72 -50.01 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.977 0 C-N-CA 129.088 2.955 . . . . 0.0 110.672 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -73.64 143.38 46.32 Favored 'General case' 0 C--O 1.217 -0.657 1 O-C-N 129.197 4.061 . . . . 0.0 108.562 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.9 t -124.81 87.02 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 O-C-N 128.114 3.384 . . . . 0.0 112.523 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.9 t -56.83 143.46 37.05 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.443 ' HB3' ' CB ' ' A' ' 15' ' ' GLU . 4.8 ttp180 -127.51 135.68 50.7 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 128.495 3.622 . . . . 0.0 110.467 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -124.42 135.56 53.36 Favored 'General case' 0 N--CA 1.481 1.122 1 O-C-N 129.157 4.036 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 54.1 t -127.99 74.74 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.202 -1.445 0 N-CA-C 102.996 -2.965 . . . . 0.0 102.996 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.544 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 2.5 m-85 -54.86 -176.34 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.807 2 CA-C-N 104.677 -5.692 . . . . 0.0 111.52 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -164.16 107.71 0.95 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 114.846 -2.502 . . . . 0.0 105.271 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.546 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -51.99 129.55 27.44 Favored 'General case' 0 N--CA 1.475 0.795 1 O-C-N 130.536 4.897 . . . . 0.0 108.682 178.521 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 pttt . . . . . 0 CA--C 1.504 -0.819 0 N-CA-C 118.075 2.62 . . . . 0.0 118.075 -179.086 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.425 ' HB2' ' HB2' ' A' ' 4' ' ' ASP . 0.5 OUTLIER . . . . . 0 N--CA 1.503 2.221 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -71.65 -42.79 67.11 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 117.291 -1.337 . . . . 0.0 111.559 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.467 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 0.0 OUTLIER -92.9 -13.72 28.57 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 127.184 2.802 . . . . 0.0 117.455 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.425 ' HB2' ' HB2' ' A' ' 1' ' ' MET . 1.4 m-20 -77.09 132.19 38.75 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -154.3 66.4 0.7 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 116.938 -1.905 . . . . 0.0 107.62 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -44.31 146.3 0.69 Allowed 'General case' 0 N--CA 1.44 -0.959 1 O-C-N 129.96 4.538 . . . . 0.0 111.579 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.38 -169.81 33.87 Favored Glycine 0 C--O 1.207 -1.536 0 C-N-CA 117.546 -2.264 . . . . 0.0 111.993 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.474 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -127.64 147.98 50.37 Favored 'General case' 0 C--O 1.203 -1.381 1 O-C-N 131.954 5.149 . . . . 0.0 104.515 179.704 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.528 ' CZ3' ' HG3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.05 105.92 3.99 Favored 'General case' 0 C--N 1.32 -0.717 0 O-C-N 128.499 3.624 . . . . 0.0 116.705 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' N ' ' A' ' 12' ' ' GLU . 3.1 mt-10 -78.75 107.96 11.83 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 127.258 2.849 . . . . 0.0 108.997 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.421 ' CE ' ' ND2' ' A' ' 14' ' ' ASN 0.273 5.8 ttp -64.08 85.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 103.507 -2.775 . . . . 0.0 103.507 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 10' ' ' GLU . 36.8 tt0 -45.24 -30.28 1.19 Allowed 'General case' 0 C--N 1.312 -1.042 1 O-C-N 130.988 5.18 . . . . 0.0 112.006 -179.955 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.1 m -144.7 149.53 35.78 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 113.377 -1.738 . . . . 0.0 111.447 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.421 ' ND2' ' CE ' ' A' ' 11' ' ' MET . 5.9 t-20 -128.59 110.18 12.02 Favored 'General case' 0 C--O 1.206 -1.236 1 O-C-N 129.503 4.252 . . . . 0.0 112.665 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -110.97 125.31 53.57 Favored 'General case' 0 CA--C 1.496 -1.103 1 O-C-N 131.348 5.405 . . . . 0.0 113.717 179.446 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 57.66 85.97 0.08 Allowed 'General case' 0 C--O 1.209 -1.07 0 CA-C-O 122.277 1.037 . . . . 0.0 109.393 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.527 ' N ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -105.4 -29.36 10.29 Favored 'General case' 0 CA--C 1.487 -1.449 0 CA-C-O 124.944 2.307 . . . . 0.0 109.148 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.7 -48.68 14.5 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 114.982 -2.437 . . . . 0.0 110.601 179.154 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.417 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -59.58 -20.88 53.29 Favored Glycine 0 N--CA 1.475 1.241 0 O-C-N 128.43 3.581 . . . . 0.0 111.214 178.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.44 -38.69 48.95 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-O 127.434 3.492 . . . . 0.0 105.611 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.441 ' HG3' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -69.12 -36.3 77.35 Favored 'General case' 0 C--O 1.214 -0.789 0 CA-C-N 111.194 -2.73 . . . . 0.0 109.617 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.417 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -72.82 -22.57 60.78 Favored 'General case' 0 C--O 1.207 -1.164 1 O-C-N 134.03 7.081 . . . . 0.0 114.617 -179.328 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.14 -27.65 61.79 Favored 'General case' 0 N--CA 1.477 0.924 2 O-C-N 132.082 5.864 . . . . 0.0 109.11 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.418 HD23 ' NH1' ' A' ' 105' ' ' ARG . 0.6 OUTLIER -122.95 25.53 8.54 Favored 'General case' 0 CA--C 1.542 0.651 1 O-C-N 130.362 4.789 . . . . 0.0 105.484 179.775 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.402 ' C ' ' N ' ' A' ' 27' ' ' ASP . 1.6 m-20 57.72 -73.72 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.646 0 C-N-CA 130.826 3.65 . . . . 0.0 111.786 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.492 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 4.5 tt 28.54 49.8 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.046 3 CA-C-O 130.333 4.873 . . . . 0.0 106.84 179.557 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -67.87 62.41 0.08 Allowed 'General case' 0 N--CA 1.49 1.552 1 CA-C-N 107.992 -4.186 . . . . 0.0 113.844 -177.454 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.8 m-30 -106.72 -43.14 4.77 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 118.153 2.649 . . . . 0.0 118.153 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 158.36 155.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 104.328 -2.471 . . . . 0.0 104.328 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.404 ' O ' ' N ' ' A' ' 33' ' ' ILE . 2.4 m 154.04 -50.26 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.099 1 O-C-N 131.148 5.28 . . . . 0.0 110.392 -178.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.436 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -50.36 -32.66 17.97 Favored 'General case' 0 N--CA 1.472 0.632 1 O-C-N 132.597 6.186 . . . . 0.0 106.288 179.234 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.436 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.6 OUTLIER -82.89 -45.69 13.9 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 127.807 3.192 . . . . 0.0 106.493 178.366 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.504 ' CG2' ' O ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -172.76 97.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.383 0 CA-C-O 128.245 3.878 . . . . 0.0 115.948 177.305 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 169.25 46.25 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.543 0 CA-C-O 127.697 3.618 . . . . 0.0 107.732 175.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.518 HG12 ' CZ ' ' A' ' 17' ' ' PHE . 58.6 t -62.03 -25.93 38.68 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.622 1 CA-C-N 106.932 -4.667 . . . . 0.0 108.282 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.448 ' HG3' ' HB2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER 174.84 -80.83 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.868 1 CA-C-N 107.917 -4.22 . . . . 0.0 108.421 177.133 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.576 ' C ' ' CD1' ' A' ' 37' ' ' LEU . 0.0 OUTLIER 123.1 2.09 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.035 1 O-C-N 132.613 6.196 . . . . 0.0 110.977 178.3 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 m 157.85 -70.34 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.309 1 O-C-N 129.871 4.482 . . . . 0.0 112.675 179.359 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.448 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 0.5 OUTLIER 57.56 101.14 0.02 OUTLIER 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -121.44 75.22 1.16 Allowed 'General case' 0 C--O 1.2 -1.539 1 O-C-N 131.44 5.462 . . . . 0.0 109.712 179.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.82 138.0 54.02 Favored 'General case' 0 N--CA 1.49 1.564 1 O-C-N 132.373 6.046 . . . . 0.0 106.823 -179.646 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.458 ' N ' ' O ' ' A' ' 53' ' ' LYS . 5.3 mt -136.46 109.1 8.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 O-C-N 127.509 3.005 . . . . 0.0 111.901 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.5 HD12 ' CZ ' ' A' ' 50' ' ' PHE 0.262 0.3 OUTLIER -83.97 118.62 31.65 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.672 1 CA-C-N 106.922 -4.672 . . . . 0.0 110.157 -179.432 . . . . . . . . 5 4 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -95.84 -40.77 11.19 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.485 0 CA-C-N 112.047 -2.342 . . . . 0.0 112.939 -179.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.498 ' HB2' ' CD1' ' A' ' 50' ' ' PHE . 47.3 tt0 18.4 102.7 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.523 0 O-C-N 127.936 3.272 . . . . 0.0 117.617 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -118.86 23.95 11.13 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-N 111.124 -2.762 . . . . 0.0 117.017 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.31 106.01 2.24 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-O 116.601 -2.222 . . . . 0.0 109.904 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 68.37 -68.13 0.18 Allowed 'General case' 0 C--O 1.211 -0.962 0 O-C-N 128.509 3.123 . . . . 0.0 109.454 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.63 99.29 2.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 112.833 -3.461 . . . . 0.0 107.58 178.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.5 ' CZ ' HD12 ' A' ' 43' ' ' ILE . 2.3 t80 -122.55 102.88 8.33 Favored 'General case' 0 CA--C 1.484 -1.576 1 O-C-N 130.444 4.84 . . . . 0.0 113.509 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 93.03 3.95 Favored 'General case' 0 C--O 1.194 -1.835 0 O-C-N 128.375 3.547 . . . . 0.0 115.198 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 62' ' ' ASP . 0.3 OUTLIER -69.21 155.19 40.81 Favored 'General case' 0 CA--C 1.499 -0.984 0 O-C-N 127.248 2.842 . . . . 0.0 107.322 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.458 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -168.58 143.46 3.36 Favored 'General case' 0 CA--C 1.485 -1.52 0 C-N-CA 115.843 -2.343 . . . . 0.0 112.551 -179.712 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.7 t -90.1 175.06 7.3 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 112.905 -1.952 . . . . 0.0 108.218 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -138.85 23.58 2.62 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.503 ' CB ' HD13 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -36.48 -64.88 0.31 Allowed 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.572 5.545 . . . . 0.0 110.187 179.969 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.4 t 118.62 -36.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 O-C-N 130.076 4.61 . . . . 0.0 103.02 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.529 ' CD1' ' CD2' ' A' ' 37' ' ' LEU . 2.2 m-85 -58.55 -64.83 0.79 Allowed 'General case' 0 C--O 1.241 0.632 0 O-C-N 126.849 2.593 . . . . 0.0 110.987 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -145.79 106.76 4.14 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 127.788 3.18 . . . . 0.0 110.291 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -99.4 64.92 1.36 Allowed 'General case' 0 C--O 1.21 -0.992 1 O-C-N 129.286 4.116 . . . . 0.0 107.508 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.76 77.89 1.74 Allowed 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 128.957 3.911 . . . . 0.0 108.692 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.412 ' HB3' HG23 ' A' ' 52' ' ' THR . 0.2 OUTLIER -101.83 -65.73 0.96 Allowed 'General case' 0 C--O 1.204 -1.331 0 O-C-N 126.632 2.457 . . . . 0.0 114.232 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.518 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 0.5 OUTLIER -149.41 103.86 3.33 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.916 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.442 ' C ' ' CD1' ' A' ' 65' ' ' PHE . 8.2 p-10 -126.23 70.76 1.24 Allowed 'General case' 0 CA--C 1.499 -1.018 0 C-N-CA 118.158 -1.417 . . . . 0.0 110.597 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.518 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -134.84 160.83 36.97 Favored 'General case' 0 C--N 1.353 0.743 1 CA-C-O 129.205 4.336 . . . . 0.0 111.02 179.842 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.43 HG23 ' CG2' ' A' ' 69' ' ' VAL . 1.2 m -107.77 102.44 11.66 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 109.454 -3.521 . . . . 0.0 102.862 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.478 HG13 ' CD1' ' A' ' 89' ' ' TRP . 14.1 t -33.52 129.39 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.489 -1.379 1 O-C-N 129.568 4.293 . . . . 0.0 115.97 -179.258 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.61 -18.39 56.58 Favored Glycine 0 N--CA 1.481 1.638 0 CA-C-N 111.517 -2.583 . . . . 0.0 112.968 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.43 ' CG2' HG23 ' A' ' 66' ' ' THR . 97.2 t -88.38 79.03 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 119.136 -1.025 . . . . 0.0 109.486 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -38.04 105.45 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.501 2 O-C-N 132.871 6.357 . . . . 0.0 110.611 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -64.86 92.5 0.1 Allowed 'General case' 0 CA--C 1.51 -0.569 0 O-C-N 129.043 3.964 . . . . 0.0 114.314 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -58.22 70.77 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 0 O-C-N 126.656 2.473 . . . . 0.0 113.125 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.45 ' HB3' ' CA ' ' A' ' 82' ' ' ASN . 13.9 mt-10 54.51 -165.79 0.09 Allowed 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 123.274 1.511 . . . . 0.0 110.688 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 72.84 86.31 0.11 Allowed 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 110.307 -3.133 . . . . 0.0 114.513 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.455 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 14.4 p -94.98 -70.88 0.69 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.4 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.455 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 43.54 140.62 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.954 2 O-C-N 130.218 4.699 . . . . 0.0 116.781 179.666 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.02 -15.77 61.1 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.644 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.492 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 8.2 tp -153.1 53.24 0.75 Allowed 'General case' 0 C--N 1.347 0.459 0 O-C-N 128.994 3.408 . . . . 0.0 116.028 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.5 t0 141.63 -67.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 O-C-N 128.568 3.667 . . . . 0.0 110.22 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.05 82.6 0.32 Allowed Glycine 0 C--O 1.213 -1.185 0 CA-C-N 110.073 -3.239 . . . . 0.0 110.557 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.97 -125.36 0.14 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 108.512 -3.844 . . . . 0.0 113.803 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.45 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER 178.68 93.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 120.455 1.48 . . . . 0.0 107.476 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.45 HG11 ' N ' ' A' ' 99' ' ' LYS . 68.0 t -128.88 151.6 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 O-C-N 127.8 3.187 . . . . 0.0 118.445 -178.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.24 95.65 5.04 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.064 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 76.7 m -99.84 81.74 2.49 Favored 'General case' 0 C--O 1.202 -1.439 0 CA-C-N 109.41 -3.541 . . . . 0.0 116.566 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.12 141.93 32.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 108.684 -3.871 . . . . 0.0 113.437 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.488 HG23 ' CD2' ' A' ' 65' ' ' PHE . 39.1 t -131.02 131.37 64.07 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 125.699 1.6 . . . . 0.0 108.673 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.261 99.2 m -156.42 170.73 21.64 Favored 'General case' 0 CA--C 1.476 -1.89 0 CA-C-N 113.02 -1.9 . . . . 0.0 111.412 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.678 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 31.1 m95 -100.37 143.54 30.43 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 129.134 2.973 . . . . 0.0 106.61 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.453 ' CG ' ' CG2' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -99.07 -12.49 20.49 Favored 'General case' 0 CA--C 1.477 -1.852 0 CA-C-O 127.237 3.399 . . . . 0.0 113.286 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 128.31 -29.61 4.04 Favored Glycine 0 C--O 1.196 -2.264 0 CA-C-N 109.961 -3.29 . . . . 0.0 105.226 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -150.11 24.15 0.83 Allowed 'General case' 0 N--CA 1.434 -1.257 1 O-C-N 130.041 4.024 . . . . 0.0 111.841 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.445 ' O ' ' N ' ' A' ' 90' ' ' GLU . 5.3 t -174.01 163.48 4.01 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.562 2.43 . . . . 0.0 117.562 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.436 ' N ' ' OG1' ' A' ' 93' ' ' THR . 1.1 tp -92.99 98.41 11.33 Favored 'General case' 0 C--O 1.209 -1.046 0 CA-C-O 125.332 2.491 . . . . 0.0 114.343 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.453 ' CG2' ' CG ' ' A' ' 90' ' ' GLU 0.271 90.6 t -100.0 112.2 31.83 Favored 'Isoleucine or valine' 0 C--N 1.363 1.159 0 CA-C-N 110.406 -3.088 . . . . 0.0 112.623 179.672 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.416 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -139.42 150.04 44.78 Favored 'General case' 0 C--O 1.196 -1.726 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.36 139.48 43.66 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 128.102 3.376 . . . . 0.0 114.489 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.404 ' CB ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -111.07 107.69 17.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.328 1.851 . . . . 0.0 107.266 179.065 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.45 ' N ' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.69 98.92 3.5 Favored 'General case' 0 C--O 1.201 -1.464 0 C-N-CA 115.203 -2.599 . . . . 0.0 112.797 -179.329 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -165.92 57.36 0.25 Allowed Glycine 0 C--O 1.212 -1.239 0 CA-C-O 124.428 2.127 . . . . 0.0 111.95 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 62.3 145.65 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.188 1 CA-C-N 106.365 -4.918 . . . . 0.0 113.916 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.455 ' CD ' ' HG2' ' A' ' 103' ' ' GLU . 0.3 OUTLIER 99.17 -49.71 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 110.94 -2.846 . . . . 0.0 116.348 179.357 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.455 ' HG2' ' CD ' ' A' ' 102' ' ' LYS . 14.7 pt-20 -156.11 -177.87 6.9 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 108.46 -3.973 . . . . 0.0 114.899 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -128.22 88.63 2.78 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 113.633 -3.079 . . . . 0.0 104.107 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.468 ' CD ' ' HB3' ' A' ' 122' ' ' CYS . 10.3 mmm-85 -68.59 -9.27 48.6 Favored 'General case' 0 C--O 1.201 -1.468 1 O-C-N 130.508 4.88 . . . . 0.0 113.345 179.419 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -33.43 114.85 0.11 Allowed Glycine 0 C--N 1.352 1.441 1 O-C-N 130.483 4.864 . . . . 0.0 116.983 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.416 ' CZ2' ' SG ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -123.1 142.34 50.99 Favored 'General case' 0 C--N 1.32 -0.693 1 O-C-N 132.051 5.207 . . . . 0.0 109.878 178.738 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.461 ' HD3' ' CH2' ' A' ' 110' ' ' TRP . 0.3 OUTLIER -165.27 170.85 14.29 Favored 'General case' 0 CA--C 1.505 -0.786 1 O-C-N 129.442 4.214 . . . . 0.0 112.697 -179.292 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.453 ' C ' ' CG ' ' A' ' 110' ' ' TRP . 3.9 mp0 -132.71 -178.35 4.9 Favored 'General case' 0 C--N 1.365 1.265 0 C-N-CA 115.989 -2.284 . . . . 0.0 108.616 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.461 ' CH2' ' HD3' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -159.67 15.75 0.15 Allowed 'General case' 0 CA--C 1.501 -0.925 1 O-C-N 129.279 4.112 . . . . 0.0 118.063 -179.823 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.3 t 39.87 71.13 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.628 0 CA-C-O 125.821 2.724 . . . . 0.0 115.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.402 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 2.8 mm-40 -97.02 84.8 3.6 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-O 125.924 2.773 . . . . 0.0 117.308 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.58 87.79 0.01 OUTLIER Glycine 0 C--O 1.197 -2.206 0 O-C-N 119.048 -2.283 . . . . 0.0 117.347 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 41.16 51.79 3.44 Favored 'General case' 0 CA--C 1.501 -0.936 0 C-N-CA 128.576 2.75 . . . . 0.0 118.39 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.401 ' HB2' ' C ' ' A' ' 131' ' ' PHE . 6.4 pttt 177.14 146.12 0.1 Allowed 'General case' 0 C--N 1.32 -0.713 0 O-C-N 129.057 3.973 . . . . 0.0 109.982 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.9 mp -105.3 104.56 14.32 Favored 'General case' 0 C--O 1.199 -1.563 0 O-C-N 128.308 3.505 . . . . 0.0 118.605 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.402 ' CD2' ' HB2' ' A' ' 112' ' ' GLU . 6.8 m-30 -70.2 93.27 0.82 Allowed 'General case' 0 C--O 1.203 -1.369 0 O-C-N 127.988 3.305 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.494 HD13 ' CZ ' ' A' ' 131' ' ' PHE . 1.2 mt -82.73 69.4 9.51 Favored 'General case' 0 C--N 1.346 0.449 1 CA-C-N 108.356 -4.02 . . . . 0.0 107.338 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -73.88 111.01 8.62 Favored 'General case' 0 CA--C 1.501 -0.938 1 O-C-N 129.316 4.135 . . . . 0.0 110.26 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.44 160.13 23.73 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 126.821 2.576 . . . . 0.0 113.46 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.23 160.4 36.25 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 127.006 2.691 . . . . 0.0 105.175 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.468 ' HB3' ' CD ' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -163.95 70.57 0.21 Allowed 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 125.197 2.427 . . . . 0.0 110.952 -179.647 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.2 -57.59 0.44 Allowed Glycine 0 CA--C 1.525 0.708 0 CA-C-N 111.76 -2.473 . . . . 0.0 108.769 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.8 t0 166.8 53.05 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 125.933 1.693 . . . . 0.0 106.549 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -119.8 10.23 11.57 Favored 'General case' 0 N--CA 1.475 0.776 1 O-C-N 129.259 4.099 . . . . 0.0 109.06 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 12.6 p 4.39 72.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.967 1 O-C-N 130.082 4.614 . . . . 0.0 116.761 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 64.1 m -64.33 133.44 52.67 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 119.744 -1.847 . . . . 0.0 112.019 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.28 93.32 4.43 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 128.241 3.463 . . . . 0.0 113.701 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -84.54 157.07 21.38 Favored 'General case' 0 CA--C 1.499 -1.001 0 C-N-CA 116.12 -2.232 . . . . 0.0 115.311 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 74.3 t -140.43 123.54 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 126.482 3.039 . . . . 0.0 106.958 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.494 ' CZ ' HD13 ' A' ' 118' ' ' LEU . 4.3 m-85 -100.74 -177.75 3.57 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 110.226 -3.17 . . . . 0.0 115.82 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.464 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.257 0.0 OUTLIER -157.89 124.29 4.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 110.751 -2.931 . . . . 0.0 103.885 179.895 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.528 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 30.6 tttt -75.66 113.77 13.48 Favored 'General case' 0 C--O 1.198 -1.643 1 O-C-N 129.147 4.029 . . . . 0.0 112.406 179.609 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.405 ' CB ' HG21 ' A' ' 8' ' ' THR . 32.5 ttmt . . . . . 0 CA--C 1.498 -1.039 0 N-CA-C 116.547 2.055 . . . . 0.0 116.547 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.5 mmm . . . . . 0 N--CA 1.498 1.928 0 N-CA-C 105.844 -1.91 . . . . 0.0 105.844 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.69 -50.84 3.45 Favored 'General case' 0 C--O 1.202 -1.433 0 O-C-N 125.303 1.627 . . . . 0.0 109.453 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.513 ' HD3' ' CZ3' ' A' ' 89' ' ' TRP . 9.4 mttm -93.37 -137.17 0.19 Allowed 'General case' 0 CA--C 1.504 -0.822 0 C-N-CA 118.331 -1.348 . . . . 0.0 113.96 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -80.52 -97.32 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 102.704 -3.073 . . . . 0.0 102.704 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -175.28 -94.18 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 113.506 -3.14 . . . . 0.0 107.692 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 158.25 112.83 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.018 1 O-C-N 130.116 4.635 . . . . 0.0 111.771 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 177.65 -141.17 5.1 Favored Glycine 0 C--O 1.209 -1.456 0 CA-C-O 117.057 -1.968 . . . . 0.0 114.967 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.512 ' CG2' ' CG2' ' A' ' 40' ' ' THR . 63.2 m -147.31 148.86 31.83 Favored 'General case' 0 C--O 1.215 -0.715 1 O-C-N 130.193 4.114 . . . . 0.0 104.003 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.536 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.258 0.0 OUTLIER -139.26 118.06 12.38 Favored 'General case' 0 CA--C 1.508 -0.65 1 O-C-N 130.128 4.642 . . . . 0.0 111.594 -179.112 . . . . . . . . 5 4 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.94 -6.29 32.0 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 126.891 2.62 . . . . 0.0 115.581 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.9 ttm 83.56 -79.91 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 112.857 -3.449 . . . . 0.0 107.219 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 123.8 -28.23 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.069 0 O-C-N 128.875 3.859 . . . . 0.0 106.62 -179.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.288 3.1 p 164.18 160.97 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 110.872 -2.876 . . . . 0.0 110.182 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -121.67 136.23 54.95 Favored 'General case' 0 CA--C 1.486 -1.514 0 O-C-N 128.55 3.656 . . . . 0.0 115.96 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -87.45 -137.38 0.09 Allowed 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 110.902 -2.863 . . . . 0.0 111.279 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -41.34 95.81 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.186 0 C-N-CA 124.37 1.068 . . . . 0.0 113.077 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -111.07 -36.92 5.5 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-O 126.646 3.117 . . . . 0.0 110.454 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.04 -29.39 60.77 Favored 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 119.758 -1.838 . . . . 0.0 115.455 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.414 ' N ' ' HG3' ' A' ' 18' ' ' GLU . . . -78.29 -23.78 64.89 Favored Glycine 0 N--CA 1.485 1.909 0 O-C-N 127.723 3.14 . . . . 0.0 109.194 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -71.79 -20.37 61.87 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 123.747 1.737 . . . . 0.0 107.966 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.52 -34.68 47.08 Favored 'General case' 0 CA--C 1.488 -1.417 0 C-N-CA 116.705 -1.998 . . . . 0.0 109.237 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.44 ' HD3' ' HB3' ' A' ' 28' ' ' PHE . 2.7 mtmt -71.61 -27.74 63.32 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-N 109.668 -3.424 . . . . 0.0 115.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.64 72.38 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 108.764 -3.835 . . . . 0.0 111.369 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.498 ' CD2' ' N ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -93.36 -24.61 18.04 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 128.462 3.601 . . . . 0.0 107.579 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t0 65.7 74.88 0.36 Allowed 'General case' 0 C--O 1.2 -1.534 1 O-C-N 129.4 4.188 . . . . 0.0 105.38 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.1 tt -104.64 -54.88 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 CA-C-N 109.426 -3.534 . . . . 0.0 115.316 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -167.2 32.44 0.03 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 115.138 -2.363 . . . . 0.0 113.874 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.44 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -16.99 129.35 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 O-C-N 127.975 3.297 . . . . 0.0 117.916 179.568 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 92.91 66.53 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 127.66 3.1 . . . . 0.0 107.745 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -119.69 -47.5 2.42 Favored 'General case' 0 C--O 1.218 -0.598 2 CA-C-N 105.576 -5.284 . . . . 0.0 112.949 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.51 113.51 0.46 Allowed 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 129.691 4.369 . . . . 0.0 107.805 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttt 179.62 -47.76 0.01 OUTLIER 'General case' 0 CA--C 1.491 -1.319 0 O-C-N 127.892 3.245 . . . . 0.0 110.23 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -124.11 -11.18 6.54 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.241 0 O-C-N 126.987 2.68 . . . . 0.0 112.894 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -101.61 19.09 18.69 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-O 124.071 1.891 . . . . 0.0 112.091 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.4 t -49.27 -37.34 10.36 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.374 0 CA-C-N 109.519 -3.491 . . . . 0.0 109.386 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.716 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -171.38 151.01 2.97 Favored 'General case' 0 C--O 1.21 -0.991 1 CA-C-N 106.42 -4.9 . . . . 0.0 112.123 179.833 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.716 ' N ' ' HG3' ' A' ' 36' ' ' ARG . 2.5 pt? 153.99 -19.12 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.991 2 O-C-N 134.88 7.613 . . . . 0.0 106.282 177.026 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.466 ' HA ' ' HB2' ' A' ' 56' ' ' SER . 16.1 m -46.36 -29.46 1.69 Allowed 'General case' 0 N--CA 1.485 1.281 1 O-C-N 132.269 5.981 . . . . 0.0 109.455 175.231 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.557 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.0 OUTLIER 42.57 -171.66 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 118.556 2.798 . . . . 0.0 118.556 179.313 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.557 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 57.5 m -20.13 90.99 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 131.575 3.95 . . . . 0.0 115.522 178.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.521 ' HE3' ' CD1' ' A' ' 9' ' ' TRP 0.262 0.0 OUTLIER -75.33 161.28 29.42 Favored 'General case' 0 N--CA 1.492 1.631 1 O-C-N 129.414 4.196 . . . . 0.0 101.889 178.94 . . . . . . . . 5 4 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.479 ' N ' ' O ' ' A' ' 53' ' ' LYS . 11.6 mt -137.72 164.34 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.282 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.458 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 5.8 tt -140.02 150.02 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.485 0 O-C-N 127.489 2.993 . . . . 0.0 108.932 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.3 t -130.62 -46.67 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 C-N-CA 115.014 -2.674 . . . . 0.0 115.973 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? 32.47 101.53 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 126.052 2.834 . . . . 0.0 115.205 -179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.18 51.88 1.75 Allowed 'General case' 0 CA--C 1.494 -1.179 0 CA-C-N 110.465 -3.061 . . . . 0.0 114.021 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.06 98.28 0.01 OUTLIER Glycine 0 N--CA 1.475 1.267 0 CA-C-N 115.349 -0.841 . . . . 0.0 115.028 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 84.16 -60.49 0.11 Allowed 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 127.645 2.615 . . . . 0.0 110.935 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.37 124.45 33.4 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 128.541 3.651 . . . . 0.0 107.755 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.654 ' CD1' ' CZ ' ' A' ' 65' ' ' PHE . 3.3 t80 -125.12 138.37 54.17 Favored 'General case' 0 CA--C 1.484 -1.583 1 O-C-N 131.059 5.224 . . . . 0.0 117.796 -178.56 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.435 ' HD3' ' HB3' ' A' ' 64' ' ' ASP . 54.0 mttt -145.15 100.32 3.45 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 178.137 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.468 ' CB ' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -84.52 160.66 20.46 Favored 'General case' 0 N--CA 1.473 0.694 1 O-C-N 129.568 4.292 . . . . 0.0 106.251 177.176 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 42' ' ' ILE . 20.1 tttt -158.91 137.72 11.1 Favored 'General case' 0 CA--C 1.481 -1.696 0 C-N-CA 114.119 -3.032 . . . . 0.0 112.327 -177.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.94 123.39 32.0 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 110.343 -3.117 . . . . 0.0 108.877 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.436 ' O ' ' NE2' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -102.41 11.59 37.79 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 113.849 -2.977 . . . . 0.0 114.883 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.466 ' HB2' ' HA ' ' A' ' 38' ' ' THR . 5.6 p -39.6 173.31 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.695 1 O-C-N 133.288 6.617 . . . . 0.0 112.385 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.72 6.08 25.37 Favored 'General case' 0 N--CA 1.48 1.031 1 CA-C-N 107.16 -4.564 . . . . 0.0 102.801 178.886 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.613 ' CE1' ' CD1' ' A' ' 37' ' ' LEU . 2.6 m-30 -121.57 -78.81 0.6 Allowed 'General case' 0 C--N 1.357 0.905 0 O-C-N 126.831 2.582 . . . . 0.0 116.659 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.404 ' N ' ' OG ' ' A' ' 56' ' ' SER . 5.2 mtt180 -106.85 123.55 48.32 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 109.073 -3.694 . . . . 0.0 116.143 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.37 62.35 1.52 Allowed 'General case' 0 C--O 1.198 -1.62 1 O-C-N 129.76 4.412 . . . . 0.0 105.792 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -95.75 16.29 17.87 Favored 'General case' 0 N--CA 1.448 -0.553 2 O-C-N 131.458 5.474 . . . . 0.0 111.271 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 1.89 126.42 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.131 1 O-C-N 133.076 6.485 . . . . 0.0 117.156 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.522 ' HG ' ' CE1' ' A' ' 65' ' ' PHE . 4.2 tp -78.17 61.81 2.76 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.751 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.435 ' HB3' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -101.37 101.12 11.7 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 126.354 2.284 . . . . 0.0 111.112 -179.788 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.654 ' CZ ' ' CD1' ' A' ' 50' ' ' PHE . 17.2 p90 -133.29 -152.38 0.49 Allowed 'General case' 0 CA--C 1.486 -1.5 0 CA-C-O 124.991 2.329 . . . . 0.0 107.527 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -159.08 141.47 13.95 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 118.408 -2.683 . . . . 0.0 104.582 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.408 ' HA ' ' CG1' ' A' ' 87' ' ' VAL . 2.5 t -65.25 131.24 31.05 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.836 0 O-C-N 128.771 3.794 . . . . 0.0 115.823 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 61.92 24.73 65.09 Favored Glycine 0 N--CA 1.474 1.18 0 CA-C-N 112.188 -2.278 . . . . 0.0 116.398 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.316 1.8 p -93.77 -16.5 7.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 O-C-N 126.013 1.655 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 72.88 107.37 0.07 Allowed 'General case' 0 C--N 1.355 0.814 1 O-C-N 129.405 4.19 . . . . 0.0 108.195 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.426 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.7 t80 -97.71 31.63 2.56 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 128.11 3.382 . . . . 0.0 113.649 -178.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -16.8 103.08 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.3 0 C-N-CA 127.245 2.218 . . . . 0.0 116.416 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.434 ' HG3' ' CB ' ' A' ' 82' ' ' ASN . 2.7 tt0 69.92 -168.58 0.17 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-O 124.533 2.111 . . . . 0.0 112.254 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 82.39 85.83 0.04 OUTLIER 'General case' 0 C--O 1.21 -1.002 0 CA-C-O 125.6 2.619 . . . . 0.0 116.798 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.252 0.6 OUTLIER -114.96 -52.11 2.71 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 110.525 -3.034 . . . . 0.0 111.99 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.8 pttt -27.18 111.72 0.05 OUTLIER 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 128.633 3.708 . . . . 0.0 115.302 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 155.41 -33.97 0.64 Allowed Glycine 0 C--O 1.212 -1.223 0 CA-C-N 110.993 -2.821 . . . . 0.0 112.624 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.02 -52.04 2.7 Favored 'General case' 0 N--CA 1.474 0.747 1 CA-C-N 106.896 -4.652 . . . . 0.0 115.587 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.44 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 58.6 t0 -109.84 -60.33 1.8 Allowed 'General case' 0 C--O 1.215 -0.756 0 O-C-N 120.035 -1.666 . . . . 0.0 112.85 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.02 75.05 1.22 Allowed Glycine 0 N--CA 1.477 1.403 0 CA-C-O 126.336 3.187 . . . . 0.0 110.7 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -142.0 -130.2 0.1 Allowed 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 108.807 -3.697 . . . . 0.0 113.2 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.434 ' CB ' ' HG3' ' A' ' 73' ' ' GLU . 0.7 OUTLIER -176.3 111.39 0.1 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 120.006 1.276 . . . . 0.0 110.931 -179.865 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 58.8 t -137.59 144.58 31.01 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.174 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.77 -75.94 0.03 OUTLIER 'General case' 0 CA--C 1.507 -0.703 1 O-C-N 130.108 4.63 . . . . 0.0 110.69 -179.589 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.426 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 7.7 m 71.23 61.56 0.17 Allowed 'General case' 0 CA--C 1.497 -1.067 0 C-N-CA 128.758 2.823 . . . . 0.0 112.878 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.419 ' HG ' ' N ' ' A' ' 87' ' ' VAL . 1.4 tp -82.23 136.38 35.1 Favored 'General case' 0 N--CA 1.43 -1.459 1 CA-C-N 107.723 -4.308 . . . . 0.0 110.44 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.491 HG23 ' CD2' ' A' ' 65' ' ' PHE . 47.8 t -108.83 147.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 125.244 1.418 . . . . 0.0 108.449 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.429 ' N ' HG11 ' A' ' 87' ' ' VAL 0.259 53.3 m -161.12 152.35 18.85 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 111.419 -2.628 . . . . 0.0 112.07 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.654 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.268 19.1 m95 -92.47 121.97 34.45 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 127.341 2.256 . . . . 0.0 105.043 179.738 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.428 ' HG3' HG22 ' A' ' 95' ' ' VAL . 3.4 tt0 -88.22 -148.75 0.16 Allowed 'General case' 0 CA--C 1.477 -1.864 0 CA-C-O 126.381 2.991 . . . . 0.0 112.189 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -42.22 95.86 Favored Glycine 0 N--CA 1.488 2.119 0 N-CA-C 103.342 -3.903 . . . . 0.0 103.342 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -169.8 67.35 0.05 Allowed 'General case' 0 C--O 1.21 -1.008 1 O-C-N 130.04 4.023 . . . . 0.0 110.809 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.42 ' O ' ' CE3' ' A' ' 89' ' ' TRP . 1.7 t 176.15 169.9 0.42 Allowed 'General case' 0 C--O 1.2 -1.549 0 N-CA-C 117.19 2.293 . . . . 0.0 117.19 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.474 HD12 ' CG ' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -96.8 94.22 7.14 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 129.103 2.961 . . . . 0.0 113.921 179.364 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.428 HG22 ' HG3' ' A' ' 90' ' ' GLU 0.319 50.5 t -103.75 141.28 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.898 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 179.776 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -143.81 127.77 17.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 125.433 1.708 . . . . 0.0 107.705 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.401 HG21 ' HB3' ' A' ' 86' ' ' LEU . 35.4 m -104.63 98.8 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.442 0 CA-C-O 127.234 3.397 . . . . 0.0 118.437 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.424 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -73.75 92.24 1.99 Allowed 'General case' 0 C--N 1.355 0.826 0 O-C-N 117.594 -3.191 . . . . 0.0 109.045 179.683 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.41 87.29 4.09 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 108.649 -3.887 . . . . 0.0 111.403 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -145.59 91.83 0.16 Allowed Glycine 0 C--O 1.211 -1.306 0 C-N-CA 117.16 -2.448 . . . . 0.0 113.571 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 49.63 -70.78 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 110.712 -2.744 . . . . 0.0 115.401 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.431 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -100.45 -73.44 0.64 Allowed 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -179.004 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -48.78 160.21 0.2 Allowed 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -128.84 76.91 1.75 Allowed 'General case' 0 N--CA 1.491 1.599 2 O-C-N 131.759 5.662 . . . . 0.0 102.344 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.438 ' HD2' ' HA ' ' A' ' 122' ' ' CYS . 13.7 mmm-85 -87.13 -3.7 59.08 Favored 'General case' 0 C--O 1.212 -0.901 0 O-C-N 127.637 3.086 . . . . 0.0 114.383 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -34.86 86.21 0.01 OUTLIER Glycine 0 CA--C 1.535 1.322 2 CA-C-N 105.796 -5.184 . . . . 0.0 117.24 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.554 ' CD1' ' C ' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -84.66 132.44 34.47 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 127.275 2.397 . . . . 0.0 110.289 178.892 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.422 ' C ' ' NE2' ' A' ' 109' ' ' GLN . 0.3 OUTLIER -159.78 168.87 24.87 Favored 'General case' 0 C--O 1.2 -1.511 1 O-C-N 129.403 4.189 . . . . 0.0 118.458 -179.558 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.437 ' NE2' ' CD1' ' A' ' 107' ' ' TRP . 8.8 mm-40 -128.78 169.61 14.33 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 110.152 -3.204 . . . . 0.0 110.125 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.518 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.2 OUTLIER -166.46 14.39 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.074 1 O-C-N 129.351 4.157 . . . . 0.0 118.565 179.263 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 25.4 t 29.86 105.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.475 -1.912 0 CA-C-O 127.72 3.628 . . . . 0.0 119.673 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.4 ' HG3' ' CD1' ' A' ' 117' ' ' TYR . 3.6 mt-10 -123.05 49.64 1.63 Allowed 'General case' 0 N--CA 1.484 1.271 0 O-C-N 118.479 -2.638 . . . . 0.0 114.033 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.33 -132.82 6.38 Favored Glycine 0 C--O 1.202 -1.854 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.429 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.94 38.59 1.61 Allowed 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 127.677 2.391 . . . . 0.0 114.113 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.441 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 54.9 pttt -168.2 162.17 12.7 Favored 'General case' 0 CA--C 1.515 -0.384 1 O-C-N 130.747 5.029 . . . . 0.0 110.129 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.4 tt -118.8 104.59 10.71 Favored 'General case' 0 C--O 1.207 -1.165 0 O-C-N 126.285 2.241 . . . . 0.0 114.371 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.4 ' CD1' ' HG3' ' A' ' 112' ' ' GLU . 51.7 m-85 -57.94 110.35 0.9 Allowed 'General case' 0 C--O 1.201 -1.491 1 O-C-N 129.554 4.283 . . . . 0.0 115.343 179.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.52 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -98.37 71.52 2.05 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 127.803 3.19 . . . . 0.0 106.533 179.89 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.518 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.3 mt-10 -83.5 105.58 14.55 Favored 'General case' 0 CA--C 1.484 -1.564 1 O-C-N 130.294 4.746 . . . . 0.0 112.277 -179.883 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.15 155.57 20.87 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 114.151 -1.386 . . . . 0.0 108.376 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.9 m -109.9 161.48 15.44 Favored 'General case' 0 CA--C 1.489 -1.391 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.438 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -161.45 72.39 0.41 Allowed 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 121.259 1.845 . . . . 0.0 115.008 -179.957 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 34.6 67.1 0.28 Allowed Glycine 0 N--CA 1.435 -1.374 0 C-N-CA 126.397 1.951 . . . . 0.0 114.557 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 119.43 -56.15 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.342 0 O-C-N 128.888 3.346 . . . . 0.0 109.85 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -75.44 162.13 28.61 Favored 'General case' 0 C--N 1.352 0.683 0 O-C-N 127.972 3.295 . . . . 0.0 107.627 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 7.7 t -146.18 82.7 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 CA-C-N 109.214 -3.63 . . . . 0.0 113.335 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 38.8 t -51.26 144.53 9.46 Favored 'General case' 0 CA--C 1.504 -0.805 0 O-C-N 124.644 1.215 . . . . 0.0 109.614 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -135.39 63.79 1.6 Allowed 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 116.953 -1.498 . . . . 0.0 113.215 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -48.18 168.07 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.727 1 O-C-N 129.767 4.417 . . . . 0.0 115.484 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.35 120.73 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 102.71 -3.071 . . . . 0.0 102.71 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.52 ' CE1' ' CB ' ' A' ' 118' ' ' LEU . 30.8 m-85 -102.12 178.87 4.48 Favored 'General case' 0 CA--C 1.475 -1.934 0 CA-C-O 127.098 3.332 . . . . 0.0 118.538 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.424 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.1 OUTLIER -168.85 117.78 0.69 Allowed 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 110.593 -3.003 . . . . 0.0 108.947 -179.55 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.524 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 28.2 ttpt -59.38 108.07 0.66 Allowed 'General case' 0 CA--C 1.488 -1.421 0 O-C-N 128.104 3.377 . . . . 0.0 116.156 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.501 -0.91 0 CA-C-O 114.786 -2.53 . . . . 0.0 113.489 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.885 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.667 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.422 HG23 ' HA ' ' A' ' 92' ' ' ASN . 24.8 m 66.21 -62.91 0.25 Allowed 'General case' 0 C--O 1.202 -1.417 0 O-C-N 125.712 1.882 . . . . 0.0 110.82 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.537 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 0.5 OUTLIER -78.61 -52.43 8.47 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 119.32 3.081 . . . . 0.0 119.32 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.32 122.2 27.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -134.05 31.38 3.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 113.744 -3.026 . . . . 0.0 108.621 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -24.41 128.16 0.03 OUTLIER 'General case' 0 C--O 1.236 0.381 1 O-C-N 130.136 4.648 . . . . 0.0 110.63 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.37 -118.15 0.51 Allowed Glycine 0 C--O 1.221 -0.693 0 C-N-CA 115.746 -3.121 . . . . 0.0 114.511 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.56 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 98.4 m 177.67 144.54 0.11 Allowed 'General case' 0 N--CA 1.476 0.85 1 O-C-N 132.504 5.473 . . . . 0.0 106.018 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.56 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -144.5 90.07 2.06 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -179.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -57.69 100.75 0.06 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 128.493 3.621 . . . . 0.0 106.779 179.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.403 ' O ' ' CB ' ' A' ' 12' ' ' GLU . 32.2 ttm -32.61 -59.89 0.31 Allowed 'General case' 0 N--CA 1.479 0.99 0 O-C-N 129.099 4.0 . . . . 0.0 109.611 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.403 ' CB ' ' O ' ' A' ' 11' ' ' MET . 1.9 tt0 98.58 -44.54 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.012 0 O-C-N 125.946 2.029 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.25 15.7 m -174.62 149.41 1.25 Allowed 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 110.015 -3.266 . . . . 0.0 113.711 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -125.38 139.62 53.51 Favored 'General case' 0 C--O 1.213 -0.867 2 O-C-N 129.816 4.447 . . . . 0.0 110.495 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -71.08 -95.53 0.01 OUTLIER 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 109.375 -3.557 . . . . 0.0 111.31 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 5.1 p30 -83.94 147.18 27.62 Favored 'General case' 0 C--O 1.204 -1.297 0 O-C-N 119.225 -2.172 . . . . 0.0 109.004 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -116.8 -68.39 0.92 Allowed 'General case' 0 C--O 1.204 -1.316 0 O-C-N 127.041 2.713 . . . . 0.0 111.263 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 -46.73 87.01 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 117.747 2.499 . . . . 0.0 117.747 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.49 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.18 -25.36 25.11 Favored Glycine 0 CA--C 1.491 -1.415 0 O-C-N 128.786 3.804 . . . . 0.0 113.308 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.506 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -75.14 -43.18 54.05 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 104.734 -2.321 . . . . 0.0 104.734 179.399 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -72.12 -21.54 61.46 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 116.487 -2.085 . . . . 0.0 112.302 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.49 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 1.3 ttmt -76.87 -40.92 45.86 Favored 'General case' 0 C--O 1.207 -1.135 0 O-C-N 129.023 3.952 . . . . 0.0 113.084 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.45 ' CB ' ' HB2' ' A' ' 122' ' ' CYS . . . -56.3 -44.38 79.83 Favored 'General case' 0 C--O 1.214 -0.815 0 O-C-N 128.905 3.878 . . . . 0.0 115.222 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.502 ' CD1' ' HB2' ' A' ' 79' ' ' ASP . 0.1 OUTLIER -88.96 1.6 55.21 Favored 'General case' 0 N--CA 1.491 1.576 2 O-C-N 130.76 5.038 . . . . 0.0 109.177 -178.661 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 50.22 82.92 0.05 OUTLIER 'General case' 0 CA--C 1.48 -1.726 0 CA-C-O 127.83 3.681 . . . . 0.0 114.447 178.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.438 HD13 ' HA ' ' A' ' 78' ' ' LEU . 2.2 tt -110.8 -33.56 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.632 0 CA-C-N 110.946 -2.843 . . . . 0.0 111.873 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 179.82 127.59 0.08 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.539 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -79.18 12.88 2.08 Favored 'General case' 0 CA--C 1.5 -0.946 0 C-N-CA 116.162 -2.215 . . . . 0.0 116.485 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -172.61 75.05 0.04 OUTLIER 'General case' 0 C--O 1.208 -1.102 0 CA-C-O 123.09 1.424 . . . . 0.0 110.712 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.66 -31.67 6.1 Favored 'General case' 0 C--N 1.353 0.724 2 CA-C-N 106.348 -4.933 . . . . 0.0 115.872 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.418 ' CG ' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -57.04 -164.57 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.963 1 O-C-N 129.654 4.346 . . . . 0.0 112.514 -179.775 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' A' ' 31' ' ' ARG . 14.5 tttm 67.76 39.61 2.63 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 125.658 1.849 . . . . 0.0 108.58 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -166.0 -49.78 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.93 2 O-C-N 130.095 4.622 . . . . 0.0 111.534 179.934 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.14 18.55 9.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.657 -1.902 . . . . 0.0 113.912 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.6 t -40.31 -36.35 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.278 0 CA-C-O 124.231 1.967 . . . . 0.0 110.372 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.606 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -154.69 153.86 31.99 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 109.831 -3.349 . . . . 0.0 107.687 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.655 HD11 ' CG ' ' A' ' 58' ' ' PHE . 2.1 pt? 148.79 -18.21 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 2 O-C-N 135.608 8.068 . . . . 0.0 110.811 178.755 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.501 ' HA ' ' CB ' ' A' ' 56' ' ' SER 0.265 0.5 OUTLIER -77.13 51.32 0.81 Allowed 'General case' 0 CA--C 1.48 -1.728 0 C-N-CA 130.547 3.539 . . . . 0.0 119.063 -176.837 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.465 ' HG2' ' N ' ' A' ' 40' ' ' THR . 38.9 tt0 -122.42 144.25 49.16 Favored 'General case' 0 CA--C 1.493 -1.224 0 O-C-N 119.106 -2.246 . . . . 0.0 116.69 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.465 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 99.6 m 97.85 64.5 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.327 0 C-N-CA 130.352 3.461 . . . . 0.0 111.072 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.456 ' HD3' ' C ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -76.46 150.07 36.73 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 108.406 -3.997 . . . . 0.0 101.93 179.752 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.489 ' CD1' ' HD2' ' A' ' 53' ' ' LYS . 2.3 mt -143.0 158.5 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 125.65 1.844 . . . . 0.0 109.246 179.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.408 HG13 ' CE2' ' A' ' 50' ' ' PHE 0.292 18.2 tt -132.95 148.17 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 1 O-C-N 129.399 4.187 . . . . 0.0 111.428 -179.685 . . . . . . . . 4 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 77.7 t -154.95 85.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.658 0 CA-C-N 111.93 -2.395 . . . . 0.0 110.066 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.74 84.72 6.3 Favored 'General case' 0 CA--C 1.485 -1.519 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.07 -13.7 59.92 Favored 'General case' 0 C--N 1.364 1.198 0 O-C-N 126.933 2.646 . . . . 0.0 117.985 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 146.33 -103.3 0.27 Allowed Glycine 0 C--O 1.212 -1.273 0 N-CA-C 111.432 -0.667 . . . . 0.0 111.432 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.07 40.24 1.36 Allowed 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 124.58 0.812 . . . . 0.0 110.776 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -176.29 86.39 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 O-C-N 127.048 2.717 . . . . 0.0 109.318 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.515 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 1.8 t80 -99.19 135.12 41.06 Favored 'General case' 0 CA--C 1.486 -1.499 1 O-C-N 131.187 5.304 . . . . 0.0 112.105 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -144.48 90.53 2.1 Favored 'General case' 0 CA--C 1.481 -1.71 0 O-C-N 128.63 3.706 . . . . 0.0 117.421 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.75 120.06 15.8 Favored 'General case' 0 CA--C 1.501 -0.917 0 O-C-N 128.276 3.485 . . . . 0.0 106.907 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.489 ' HD2' ' CD1' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.83 146.17 49.4 Favored 'General case' 0 CA--C 1.49 -1.344 0 C-N-CA 117.407 -1.717 . . . . 0.0 107.967 -178.605 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.495 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 5.7 t -105.95 175.18 5.58 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.147 1.529 . . . . 0.0 113.22 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -148.96 37.53 0.79 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.501 ' CB ' ' HA ' ' A' ' 38' ' ' THR . 1.1 p -62.54 142.15 58.11 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 128.513 2.725 . . . . 0.0 108.314 179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 37' ' ' LEU 0.254 0.1 OUTLIER -39.45 -50.56 2.13 Favored 'General case' 0 N--CA 1.489 1.518 1 O-C-N 130.608 4.942 . . . . 0.0 106.669 -179.952 . . . . . . . . 5 4 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.655 ' CG ' HD11 ' A' ' 37' ' ' LEU . 12.2 p90 -166.57 76.38 0.19 Allowed 'General case' 0 C--N 1.366 1.318 0 O-C-N 126.967 2.667 . . . . 0.0 115.203 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.62 51.29 0.0 OUTLIER 'General case' 0 C--N 1.363 1.186 1 CA-C-N 107.298 -4.501 . . . . 0.0 111.235 179.788 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.495 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 15.6 m-80 -86.59 107.17 18.03 Favored 'General case' 0 C--O 1.219 -0.543 2 CA-C-N 107.799 -4.273 . . . . 0.0 112.777 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -124.94 98.3 5.63 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 127.943 3.277 . . . . 0.0 106.816 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.63 152.68 41.56 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.495 2.997 . . . . 0.0 115.552 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.527 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 11.9 tp -117.8 47.17 1.6 Allowed 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 112.95 -1.932 . . . . 0.0 111.456 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -87.1 94.37 9.62 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 124.479 2.085 . . . . 0.0 112.544 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.527 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -140.05 -153.01 0.44 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 126.103 1.761 . . . . 0.0 106.528 179.447 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.417 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -151.03 -178.63 6.72 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-O 116.873 -1.537 . . . . 0.0 108.017 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.417 ' N ' ' OG1' ' A' ' 66' ' ' THR . 63.4 t -80.64 119.24 29.81 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.642 1 O-C-N 133.74 6.9 . . . . 0.0 112.597 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.52 9.48 55.42 Favored Glycine 0 N--CA 1.484 1.885 0 CA-C-N 109.451 -3.522 . . . . 0.0 117.447 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.447 HG12 ' N ' ' A' ' 71' ' ' PHE 0.285 14.0 p -59.78 -17.79 13.91 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 O-C-N 124.902 1.001 . . . . 0.0 111.312 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.61 63.17 1.2 Allowed 'General case' 0 CA--C 1.543 0.681 0 O-C-N 128.546 3.654 . . . . 0.0 107.433 -179.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.447 ' N ' HG12 ' A' ' 69' ' ' VAL . 12.0 t80 -64.85 141.46 58.77 Favored 'General case' 0 CA--C 1.494 -1.211 2 CA-C-N 106.33 -4.941 . . . . 0.0 118.954 -178.164 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -100.32 104.15 15.59 Favored 'General case' 0 C--O 1.21 -1.026 0 O-C-N 119.347 -2.096 . . . . 0.0 110.225 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -72.11 74.32 0.93 Allowed 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 125.336 2.493 . . . . 0.0 109.642 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -80.24 116.59 20.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 109.509 -3.496 . . . . 0.0 112.008 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.469 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.2 OUTLIER -157.66 -179.47 8.19 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 114.013 -1.449 . . . . 0.0 113.04 -179.62 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.469 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -150.54 -52.2 0.14 Allowed 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 127.185 3.374 . . . . 0.0 110.43 179.51 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -44.65 -32.88 3.1 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 108.793 -3.821 . . . . 0.0 108.261 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.438 ' HA ' HD13 ' A' ' 26' ' ' ILE . 5.0 tp -124.05 79.89 1.77 Allowed 'General case' 0 CA--C 1.529 0.165 0 O-C-N 129.22 3.541 . . . . 0.0 115.536 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.502 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 17.7 t70 85.82 -63.81 0.05 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.807 3.192 . . . . 0.0 110.333 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.83 119.58 2.46 Favored Glycine 0 C--O 1.213 -1.177 0 CA-C-N 109.02 -3.718 . . . . 0.0 115.868 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.414 ' HD3' ' CG2' ' A' ' 83' ' ' VAL . 0.0 OUTLIER -171.02 -123.55 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 O-C-N 126.818 2.128 . . . . 0.0 113.413 179.836 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.0 p30 168.8 63.44 0.0 OUTLIER 'General case' 0 C--O 1.197 -1.698 0 CA-C-N 119.923 1.238 . . . . 0.0 112.417 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.414 ' CG2' ' HD3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -90.84 158.93 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.027 0 CA-C-O 116.418 -1.753 . . . . 0.0 112.717 179.948 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.416 ' HE2' ' N ' ' A' ' 84' ' ' LYS . 7.8 mmpt? -68.28 169.0 11.29 Favored 'General case' 0 C--N 1.326 -0.44 1 O-C-N 129.392 4.183 . . . . 0.0 107.053 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.425 HG23 ' HB3' ' A' ' 71' ' ' PHE . 1.2 m -171.32 77.3 0.06 Allowed 'General case' 0 C--O 1.194 -1.823 1 O-C-N 131.11 5.256 . . . . 0.0 111.107 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.1 tt -68.38 141.52 55.7 Favored 'General case' 0 N--CA 1.431 -1.398 1 CA-C-N 105.975 -5.102 . . . . 0.0 109.886 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.51 HG12 ' CE1' ' A' ' 65' ' ' PHE . 46.1 t -129.91 144.43 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.069 1.347 . . . . 0.0 108.446 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.9 t -163.49 177.26 9.0 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 126.378 2.99 . . . . 0.0 110.482 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.666 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 65.3 m95 -102.12 133.99 46.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 128.484 2.714 . . . . 0.0 110.236 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.1 -37.82 15.91 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-O 131.651 5.501 . . . . 0.0 111.605 179.871 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.08 65.32 0.32 Allowed Glycine 0 N--CA 1.481 1.655 2 CA-C-N 106.429 -4.896 . . . . 0.0 102.226 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.428 ' ND2' ' HB ' ' A' ' 93' ' ' THR . 1.0 OUTLIER 149.26 -36.2 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 132.888 5.699 . . . . 0.0 111.007 -179.87 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.428 ' HB ' ' ND2' ' A' ' 92' ' ' ASN . 0.7 OUTLIER -136.46 174.55 10.5 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 119.19 3.033 . . . . 0.0 119.19 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.87 82.6 2.27 Favored 'General case' 0 CA--C 1.485 -1.548 0 C-N-CA 129.596 3.159 . . . . 0.0 115.766 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.339 97.9 t -77.19 131.53 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-N 108.888 -3.778 . . . . 0.0 113.188 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.546 ' CB ' ' CZ2' ' A' ' 107' ' ' TRP . 0.5 OUTLIER -141.39 134.17 28.77 Favored 'General case' 0 C--O 1.201 -1.449 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -131.63 123.2 51.7 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.107 0 CA-C-N 109.58 -3.463 . . . . 0.0 116.035 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.509 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 1.4 tt0 -85.37 98.67 10.69 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 126.747 3.165 . . . . 0.0 110.382 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -81.65 158.79 24.17 Favored 'General case' 0 C--O 1.205 -1.251 1 CA-C-N 108.11 -4.132 . . . . 0.0 106.846 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.4 138.93 5.85 Favored Glycine 0 C--O 1.211 -1.306 0 O-C-N 126.947 2.654 . . . . 0.0 107.212 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 63.24 163.26 0.11 Allowed 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 109.48 -3.36 . . . . 0.0 108.718 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -39.96 -58.48 1.4 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 112.114 -2.312 . . . . 0.0 111.548 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.17 146.22 0.93 Allowed 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 111.128 -2.76 . . . . 0.0 113.192 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -127.17 64.55 1.32 Allowed 'General case' 0 N--CA 1.483 1.22 2 O-C-N 130.141 4.65 . . . . 0.0 103.576 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.509 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 3.6 mmm180 -67.33 69.73 0.1 Allowed 'General case' 0 N--CA 1.478 0.972 0 O-C-N 128.127 3.392 . . . . 0.0 113.853 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -114.08 95.92 0.76 Allowed Glycine 0 C--O 1.205 -1.67 0 CA-C-O 113.689 -3.84 . . . . 0.0 111.769 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.546 ' CZ2' ' CB ' ' A' ' 96' ' ' CYS . 9.3 p90 -88.71 1.8 54.48 Favored 'General case' 0 C--O 1.195 -1.791 2 O-C-N 134.226 6.486 . . . . 0.0 115.656 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.518 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 7.0 ptpt -24.5 141.63 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.359 2 O-C-N 130.482 4.864 . . . . 0.0 113.819 -179.338 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.607 ' N ' HE21 ' A' ' 109' ' ' GLN 0.287 0.3 OUTLIER -102.96 169.98 8.25 Favored 'General case' 0 C--N 1.362 1.147 0 CA-C-N 112.539 -2.119 . . . . 0.0 109.793 -179.786 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.518 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 19.0 m95 -127.11 -57.93 1.3 Allowed 'General case' 0 C--O 1.208 -1.11 1 O-C-N 129.587 4.304 . . . . 0.0 116.968 179.47 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 21.2 t 93.05 68.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-O 127.635 3.588 . . . . 0.0 108.654 -175.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.21 120.27 40.19 Favored 'General case' 0 CA--C 1.478 -1.818 1 CA-C-N 108.069 -4.15 . . . . 0.0 118.302 -176.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 14.79 83.73 0.01 OUTLIER Glycine 0 C--O 1.215 -1.073 0 C-N-CA 127.289 2.376 . . . . 0.0 116.183 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 49.38 81.11 0.06 Allowed 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 115.81 -2.043 . . . . 0.0 116.239 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.453 ' HB2' ' HB3' ' A' ' 131' ' ' PHE . 0.4 OUTLIER 148.13 -167.77 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.132 1 O-C-N 133.79 6.931 . . . . 0.0 110.46 -179.855 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.481 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -145.99 71.26 1.26 Allowed 'General case' 0 CA--C 1.493 -1.245 0 O-C-N 128.938 3.899 . . . . 0.0 115.589 -179.936 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.435 ' CZ ' ' HE3' ' A' ' 115' ' ' LYS . 4.2 m-30 -44.67 126.23 5.42 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 126.727 2.517 . . . . 0.0 116.255 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.486 ' CD2' ' HG3' ' A' ' 109' ' ' GLN . 28.4 mt -110.24 117.7 34.37 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 111.396 -2.638 . . . . 0.0 106.578 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.37 105.22 13.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 115.728 -2.082 . . . . 0.0 106.198 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.13 118.96 34.83 Favored 'General case' 0 N--CA 1.489 1.487 1 O-C-N 131.328 5.392 . . . . 0.0 114.023 -179.739 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.2 m -96.72 145.81 25.46 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 110.643 -2.981 . . . . 0.0 103.758 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.45 ' HB2' ' CB ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -133.62 39.68 3.18 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 125.382 2.515 . . . . 0.0 111.295 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 114.06 -80.97 0.29 Allowed Glycine 0 C--O 1.218 -0.851 0 CA-C-N 113.428 -1.715 . . . . 0.0 109.96 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.24 -18.77 13.52 Favored 'General case' 0 CA--C 1.494 -1.202 0 C-N-CA 125.547 1.539 . . . . 0.0 111.876 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -103.55 159.93 15.17 Favored 'General case' 0 C--O 1.198 -1.643 0 O-C-N 125.855 1.972 . . . . 0.0 107.611 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 11.0 m -134.01 131.53 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 CA-C-N 109.215 -3.629 . . . . 0.0 112.542 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.7 m -117.86 119.64 35.49 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 116.297 -1.811 . . . . 0.0 110.006 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.24 102.95 12.64 Favored 'General case' 0 N--CA 1.484 1.269 1 O-C-N 129.258 4.099 . . . . 0.0 110.885 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -68.4 167.17 15.19 Favored 'General case' 0 CA--C 1.491 -1.309 0 C-N-CA 114.121 -3.032 . . . . 0.0 116.049 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.3 t -141.8 81.07 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.605 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.453 ' HB3' ' HB2' ' A' ' 115' ' ' LYS . 16.2 m-85 -66.92 175.58 2.42 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 109.968 -3.287 . . . . 0.0 117.976 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.258 4.3 tptt -159.93 99.7 1.39 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 109.036 -3.711 . . . . 0.0 107.872 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.54 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 28.1 ttpt -57.56 110.03 0.8 Allowed 'General case' 0 C--O 1.218 -0.585 0 CA-C-O 115.539 -2.172 . . . . 0.0 109.904 178.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.492 -1.262 0 N-CA-C 118.756 2.873 . . . . 0.0 118.756 -178.65 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ttt . . . . . 0 N--CA 1.503 2.192 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.464 ' CG2' ' HB3' ' A' ' 92' ' ' ASN . 0.2 OUTLIER -70.08 149.98 47.06 Favored 'General case' 0 C--N 1.353 0.748 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.508 179.75 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.528 ' HE2' ' CE3' ' A' ' 89' ' ' TRP . 1.4 mtmt 63.07 176.97 0.15 Allowed 'General case' 0 N--CA 1.439 -1.015 0 O-C-N 126.437 2.335 . . . . 0.0 116.166 179.907 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 29.2 t0 44.9 71.37 0.27 Allowed 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 124.501 2.096 . . . . 0.0 107.759 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -97.57 -75.88 0.53 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.205 -179.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.424 ' OD1' ' N ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 47.26 135.05 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.629 1 O-C-N 131.897 5.748 . . . . 0.0 114.473 -176.677 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.3 -133.87 1.63 Allowed Glycine 0 C--O 1.206 -1.603 0 CA-C-N 109.874 -3.33 . . . . 0.0 114.431 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.9 t -174.47 62.36 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.321 1 O-C-N 131.476 4.868 . . . . 0.0 108.129 -179.023 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.613 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.253 0.0 OUTLIER -51.82 106.77 0.16 Allowed 'General case' 0 CA--C 1.507 -0.675 1 O-C-N 130.677 4.986 . . . . 0.0 115.595 -179.495 . . . . . . . . 5 4 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -48.8 -25.81 2.05 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 116.966 -1.493 . . . . 0.0 114.162 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.5 ttp 83.65 -74.39 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.9 1 O-C-N 129.609 4.318 . . . . 0.0 105.744 -179.855 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 102.1 -48.08 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.527 0 O-C-N 128.028 3.33 . . . . 0.0 111.773 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.6 137.13 28.12 Favored 'General case' 0 C--N 1.361 1.087 0 CA-C-N 110.143 -3.208 . . . . 0.0 110.006 -179.803 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -121.01 100.23 6.95 Favored 'General case' 0 C--O 1.197 -1.686 0 N-CA-C 117.942 2.571 . . . . 0.0 117.942 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.434 ' HB2' ' N ' ' A' ' 128' ' ' ARG . 15.9 pt-20 5.37 -133.5 0.0 OUTLIER 'General case' 0 CA--C 1.473 -1.987 2 O-C-N 136.34 8.525 . . . . 0.0 117.005 178.402 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.41 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 0.3 OUTLIER -112.64 137.25 51.18 Favored 'General case' 0 C--O 1.203 -1.354 1 O-C-N 114.651 -5.031 . . . . 0.0 106.755 -179.519 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.52 ' CE2' HG23 ' A' ' 35' ' ' VAL . 1.9 p90 -118.19 -30.15 5.37 Favored 'General case' 0 CA--C 1.487 -1.469 0 O-C-N 127.565 3.041 . . . . 0.0 114.908 -178.563 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 22' ' ' LYS . 12.3 tt0 -74.78 -53.84 8.44 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 115.778 -2.058 . . . . 0.0 110.551 179.757 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.517 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -59.3 -24.35 58.9 Favored Glycine 0 N--CA 1.474 1.217 1 O-C-N 132.869 6.356 . . . . 0.0 111.479 178.741 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.444 ' HH ' ' NH1' ' A' ' 105' ' ' ARG . 15.6 t80 -70.77 -46.74 62.38 Favored 'General case' 0 C--O 1.195 -1.767 0 CA-C-O 125.752 2.692 . . . . 0.0 106.047 179.676 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.9 mmt -73.35 -23.71 60.25 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.495 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.517 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -78.99 -28.06 43.41 Favored 'General case' 0 C--O 1.206 -1.231 0 O-C-N 127.901 3.251 . . . . 0.0 110.124 -179.862 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -63.9 -37.62 88.06 Favored 'General case' 0 C--O 1.208 -1.097 1 O-C-N 129.517 4.26 . . . . 0.0 111.734 -179.778 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.472 ' CD1' ' HB2' ' A' ' 79' ' ' ASP 0.361 1.5 mm? -81.45 -56.23 4.17 Favored 'General case' 0 C--O 1.208 -1.128 2 CA-C-N 105.517 -5.31 . . . . 0.0 108.501 179.98 . . . . . . . . 4 3 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.291 19.3 t0 83.71 79.01 0.02 OUTLIER 'General case' 0 CA--C 1.484 -1.577 3 O-C-N 133.48 6.738 . . . . 0.0 107.258 -179.523 . . . . . . . . 3 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 14.0 tt -102.29 41.13 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 128.397 3.951 . . . . 0.0 110.052 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.04 164.35 0.28 Allowed 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 109.701 -3.409 . . . . 0.0 111.641 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -87.45 84.69 7.13 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 118.812 0.733 . . . . 0.0 112.422 179.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 169.53 156.61 0.05 Allowed 'General case' 0 C--N 1.364 1.231 0 O-C-N 126.382 2.301 . . . . 0.0 106.07 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.274 0.4 OUTLIER 101.06 -19.22 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.847 1 O-C-N 130.876 5.11 . . . . 0.0 113.935 179.669 . . . . . . . . 4 3 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.6 162.16 15.99 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 130.562 3.545 . . . . 0.0 108.865 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 84.36 3.14 0.79 Allowed 'General case' 0 C--N 1.31 -1.139 0 O-C-N 128.431 3.582 . . . . 0.0 111.827 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 mp -128.87 -33.82 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.137 1 O-C-N 130.191 4.682 . . . . 0.0 111.404 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.566 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -99.52 16.05 24.54 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.914 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.52 HG23 ' CE2' ' A' ' 17' ' ' PHE . 12.1 t -26.78 -52.23 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.2 -1.547 0 O-C-N 127.167 2.792 . . . . 0.0 111.0 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.99 117.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 2 O-C-N 131.132 5.27 . . . . 0.0 109.144 179.674 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 58' ' ' PHE . 2.5 pp -87.3 -45.01 10.99 Favored 'General case' 0 N--CA 1.433 -1.288 1 O-C-N 129.406 4.191 . . . . 0.0 110.664 -179.923 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.466 ' N ' ' CD1' ' A' ' 37' ' ' LEU . 1.3 m 145.64 117.31 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.206 1 O-C-N 134.569 7.418 . . . . 0.0 116.915 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.522 ' HG2' ' N ' ' A' ' 56' ' ' SER . 5.4 tp60 -158.12 -98.94 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 115.677 -2.409 . . . . 0.0 116.456 179.148 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.518 ' N ' ' HG3' ' A' ' 39' ' ' GLN . 1.9 m 157.72 151.55 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.597 1 O-C-N 132.633 6.208 . . . . 0.0 111.768 -175.359 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.539 ' HE3' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -110.27 131.93 54.62 Favored 'General case' 0 N--CA 1.492 1.649 1 O-C-N 129.791 4.432 . . . . 0.0 101.656 177.979 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.456 ' HB ' ' HB3' ' A' ' 53' ' ' LYS . 3.2 mp -107.8 164.43 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 126.333 2.271 . . . . 0.0 111.19 179.511 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.445 ' N ' ' CG2' ' A' ' 42' ' ' ILE . 0.5 OUTLIER -141.94 143.59 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.407 0 CA-C-N 112.386 -2.188 . . . . 0.0 106.855 179.789 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.9 t -117.15 -66.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.223 0 C-N-CA 115.735 -2.386 . . . . 0.0 109.844 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 57.84 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 117.156 2.28 . . . . 0.0 117.156 -179.88 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -121.43 29.11 7.39 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 127.209 2.818 . . . . 0.0 116.685 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 117.57 -74.52 0.28 Allowed Glycine 0 C--O 1.213 -1.17 0 CA-C-O 118.698 -1.056 . . . . 0.0 111.914 -179.799 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -111.23 -37.62 5.25 Favored 'General case' 0 N--CA 1.438 -1.037 0 O-C-N 126.463 1.92 . . . . 0.0 112.753 -179.828 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -83.75 85.43 7.29 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.519 1.928 . . . . 0.0 111.915 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.511 ' CE2' HD21 ' A' ' 94' ' ' LEU . 76.7 t80 -86.96 79.89 8.61 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 127.293 2.871 . . . . 0.0 112.315 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -95.96 77.13 3.15 Favored 'General case' 0 CA--C 1.481 -1.7 1 O-C-N 129.678 4.361 . . . . 0.0 118.807 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.521 ' CG2' ' N ' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -65.37 168.92 6.45 Favored 'General case' 0 C--N 1.367 1.332 0 O-C-N 128.221 3.451 . . . . 0.0 107.319 179.812 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.521 ' N ' ' CG2' ' A' ' 52' ' ' THR 0.279 13.1 ttpt -160.3 164.99 32.14 Favored 'General case' 0 N--CA 1.488 1.473 1 O-C-N 129.125 4.016 . . . . 0.0 111.369 -175.856 . . . . . . . . 4 3 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.4 m -140.45 103.31 4.53 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 110.386 -3.097 . . . . 0.0 107.233 178.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -78.01 -20.17 53.01 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 111.374 -2.648 . . . . 0.0 116.187 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.522 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 2.6 t -31.17 117.96 0.19 Allowed 'General case' 0 N--CA 1.469 0.505 1 O-C-N 132.649 6.218 . . . . 0.0 106.156 -179.838 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.465 ' CG2' HD23 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -52.85 -27.16 17.13 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 129.085 3.991 . . . . 0.0 108.396 -179.775 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.566 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 0.4 OUTLIER -61.49 -80.88 0.02 OUTLIER 'General case' 0 C--N 1.355 0.813 0 O-C-N 126.298 2.249 . . . . 0.0 111.297 179.907 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.48 110.01 13.96 Favored 'General case' 0 C--N 1.368 1.373 0 O-C-N 126.842 2.589 . . . . 0.0 112.534 -179.849 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.18 83.82 1.98 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 128.421 3.576 . . . . 0.0 108.599 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.23 -27.95 29.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.812 3.195 . . . . 0.0 111.427 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 155.35 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 127.665 3.103 . . . . 0.0 115.257 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.481 ' CD2' ' CZ2' ' A' ' 107' ' ' TRP . 8.6 tp -121.16 45.28 2.31 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.371 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -81.44 99.51 8.77 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 126.28 2.238 . . . . 0.0 110.736 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.532 ' CG ' ' N ' ' A' ' 66' ' ' THR . 0.0 OUTLIER -149.34 173.76 13.17 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 112.831 -1.986 . . . . 0.0 107.367 179.657 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.532 ' N ' ' CG ' ' A' ' 65' ' ' PHE . 2.1 m -132.13 135.07 46.14 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-O 117.099 -1.429 . . . . 0.0 107.683 179.65 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.41 HG21 ' N ' ' A' ' 68' ' ' GLY . 2.1 p -49.22 146.65 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.674 0 O-C-N 126.947 2.655 . . . . 0.0 114.705 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.41 ' N ' HG21 ' A' ' 67' ' ' VAL . . . 65.79 16.01 63.07 Favored Glycine 0 N--CA 1.485 1.904 0 O-C-N 128.688 3.742 . . . . 0.0 115.952 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.305 1.2 t -86.06 -23.44 6.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.71 -179.642 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 72.97 72.1 0.13 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 128.559 3.662 . . . . 0.0 108.204 -178.832 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.438 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -58.28 94.8 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.723 1 CA-C-N 107.107 -4.588 . . . . 0.0 116.014 -179.662 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.25 96.22 2.76 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.894 -179.854 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.26 107.93 15.32 Favored 'General case' 0 CA--C 1.498 -1.028 0 CA-C-O 122.535 1.16 . . . . 0.0 111.827 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -75.11 -24.07 58.01 Favored 'General case' 0 C--O 1.215 -0.741 0 C-N-CA 117.539 -1.664 . . . . 0.0 110.985 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.5 m 47.75 62.9 2.24 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 112.56 -2.109 . . . . 0.0 114.501 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.58 -34.54 10.54 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 128.014 3.769 . . . . 0.0 114.318 -179.961 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.81 -20.84 76.3 Favored Glycine 0 C--O 1.209 -1.416 0 CA-C-N 109.903 -3.317 . . . . 0.0 113.175 -179.76 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.2 tp -112.81 -11.02 13.53 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 128.103 2.884 . . . . 0.0 115.33 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.472 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . 2.7 t70 -173.78 -73.82 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.856 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.613 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.61 76.35 0.26 Allowed Glycine 0 N--CA 1.472 1.047 0 C-N-CA 128.17 2.795 . . . . 0.0 110.681 -179.596 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -116.1 -127.86 0.29 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 109.768 -3.216 . . . . 0.0 109.977 -179.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 165.55 61.14 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.24 1.382 . . . . 0.0 110.887 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -93.27 179.41 0.52 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-N 111.909 -2.405 . . . . 0.0 114.628 -179.812 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -126.2 151.71 47.01 Favored 'General case' 0 C--N 1.314 -0.949 1 O-C-N 133.682 6.864 . . . . 0.0 107.521 179.525 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.442 HG22 ' CZ3' ' A' ' 107' ' ' TRP . 24.2 m -149.01 74.16 1.24 Allowed 'General case' 0 C--O 1.203 -1.353 1 O-C-N 129.171 4.044 . . . . 0.0 113.603 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 132.64 54.43 Favored 'General case' 0 N--CA 1.428 -1.529 2 CA-C-N 106.524 -4.853 . . . . 0.0 109.691 -179.614 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.508 ' HB ' ' CE2' ' A' ' 65' ' ' PHE . 2.0 t -122.77 155.35 28.17 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.139 0 CA-C-O 123.705 1.717 . . . . 0.0 110.606 -179.734 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.7 t -162.68 157.86 22.35 Favored 'General case' 0 CA--C 1.493 -1.247 0 CA-C-N 109.188 -3.642 . . . . 0.0 111.742 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.66 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.266 26.4 m95 -83.38 128.09 34.21 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-O 114.743 -2.551 . . . . 0.0 105.295 179.863 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.444 ' CG ' ' CG2' ' A' ' 95' ' ' VAL . 0.2 OUTLIER -81.59 -5.74 58.33 Favored 'General case' 0 CA--C 1.474 -1.955 1 CA-C-O 130.227 4.822 . . . . 0.0 114.223 -179.644 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 105.86 -3.63 38.88 Favored Glycine 0 C--O 1.197 -2.184 1 N-CA-C 103.098 -4.001 . . . . 0.0 103.098 -179.758 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.464 ' HB3' ' CG2' ' A' ' 2' ' ' THR . 0.2 OUTLIER 179.17 78.68 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.46 0 O-C-N 127.026 2.251 . . . . 0.0 107.568 179.831 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.418 ' O ' ' CE3' ' A' ' 89' ' ' TRP . 4.3 t 124.46 163.86 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.361 0 C-N-CA 129.612 3.165 . . . . 0.0 116.944 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.511 HD21 ' CE2' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -103.32 78.15 1.59 Allowed 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 127.641 3.088 . . . . 0.0 116.913 179.989 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.444 ' CG2' ' CG ' ' A' ' 90' ' ' GLU 0.4 98.7 t -71.55 128.83 35.07 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.254 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.41 ' HB3' HG21 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -125.7 134.61 51.75 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 120.764 1.62 . . . . 0.0 106.668 -179.943 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.9 t -117.64 119.15 60.78 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.475 0 CA-C-O 127.783 3.658 . . . . 0.0 115.413 -179.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.5 ' HG3' ' CA ' ' A' ' 105' ' ' ARG 0.301 16.7 mm100 -78.43 98.67 6.11 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 111.49 -2.595 . . . . 0.0 115.736 179.929 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.6 ttmm -85.95 66.98 9.86 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 115.045 -2.662 . . . . 0.0 109.826 179.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -108.82 -156.4 17.81 Favored Glycine 0 C--O 1.203 -1.806 0 CA-C-O 126.051 3.028 . . . . 0.0 113.71 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.1 tm-20 -159.0 140.24 13.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 108.266 -3.967 . . . . 0.0 107.752 179.879 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 95.0 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 128.352 2.661 . . . . 0.0 111.737 -179.469 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -157.42 170.31 22.74 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 125.156 2.408 . . . . 0.0 113.401 179.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -120.02 95.48 4.78 Favored 'General case' 0 CA--C 1.515 -0.389 1 CA-C-N 106.277 -4.965 . . . . 0.0 104.469 179.973 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.5 ' CA ' ' HG3' ' A' ' 98' ' ' GLN . 5.7 mmm-85 -72.66 -8.48 55.5 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 128.276 3.485 . . . . 0.0 113.969 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.451 ' N ' ' CG ' ' A' ' 98' ' ' GLN . . . -10.7 95.79 0.01 OUTLIER Glycine 0 N--CA 1.431 -1.687 1 O-C-N 133.467 6.729 . . . . 0.0 114.591 179.436 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.547 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.278 0.0 OUTLIER -116.03 116.15 27.39 Favored 'General case' 0 C--O 1.194 -1.825 0 O-C-N 128.308 3.005 . . . . 0.0 109.235 179.317 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.449 ' HA ' ' NE2' ' A' ' 109' ' ' GLN . 2.1 ptpt -149.72 170.28 19.09 Favored 'General case' 0 C--O 1.211 -0.957 1 O-C-N 130.353 4.783 . . . . 0.0 112.238 -179.198 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.463 ' NE2' ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -132.82 171.82 13.4 Favored 'General case' 0 C--N 1.366 1.285 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.771 179.974 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.416 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 0.4 OUTLIER -176.27 93.83 0.05 Allowed 'General case' 0 C--N 1.311 -1.077 1 O-C-N 131.332 5.395 . . . . 0.0 117.24 179.32 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 49.0 t -39.07 107.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 C-N-CA 126.969 2.108 . . . . 0.0 113.029 179.473 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.23 88.88 3.01 Favored 'General case' 0 CA--C 1.488 -1.433 0 CA-C-N 109.981 -3.281 . . . . 0.0 114.208 -179.966 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.48 -112.97 3.75 Favored Glycine 0 C--O 1.2 -2.023 0 N-CA-C 117.524 1.769 . . . . 0.0 117.524 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -122.57 39.85 3.82 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 125.241 1.417 . . . . 0.0 113.74 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.512 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -178.44 162.53 1.48 Allowed 'General case' 0 C--N 1.313 -1.015 1 O-C-N 130.091 4.619 . . . . 0.0 109.407 -179.767 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.515 ' CD1' ' CZ2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -92.96 173.21 7.86 Favored 'General case' 0 CA--C 1.482 -1.669 0 O-C-N 128.656 3.722 . . . . 0.0 115.607 -179.617 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -142.42 80.72 1.71 Allowed 'General case' 0 C--N 1.366 1.292 1 CA-C-N 107.74 -4.3 . . . . 0.0 114.27 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.88 87.56 4.72 Favored 'General case' 0 CA--C 1.516 -0.346 1 CA-C-N 107.648 -4.342 . . . . 0.0 108.342 -179.851 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -94.7 124.96 39.04 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 127.955 3.284 . . . . 0.0 106.689 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.72 145.55 44.8 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 125.001 1.438 . . . . 0.0 108.875 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.5 t -127.55 174.27 9.19 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 125.227 1.579 . . . . 0.0 108.703 179.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 36.5 t -169.01 84.57 0.15 Allowed 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 125.052 1.47 . . . . 0.0 112.345 -179.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.49 -83.37 1.23 Allowed Glycine 0 N--CA 1.442 -0.934 0 O-C-N 127.993 3.308 . . . . 0.0 112.809 179.885 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -113.04 -20.04 11.66 Favored 'General case' 0 CA--C 1.497 -1.064 0 O-C-N 126.736 2.08 . . . . 0.0 112.082 179.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 54.8 mm-40 -91.73 163.65 14.0 Favored 'General case' 0 C--O 1.201 -1.488 0 O-C-N 126.995 2.684 . . . . 0.0 110.435 179.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.6 p -142.8 94.86 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.794 0 CA-C-N 110.006 -3.27 . . . . 0.0 112.077 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 32.0 m -82.67 135.06 35.13 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-O 117.201 -1.38 . . . . 0.0 112.064 -179.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.434 ' N ' ' HB2' ' A' ' 15' ' ' GLU . 1.5 ttp180 -117.93 113.49 21.79 Favored 'General case' 0 CA--C 1.486 -1.492 0 O-C-N 128.276 3.485 . . . . 0.0 115.902 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -88.25 157.52 18.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 115.977 -2.289 . . . . 0.0 112.037 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.5 t -140.13 131.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 N-CA-C 103.01 -2.959 . . . . 0.0 103.01 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.577 ' CD2' ' CB ' ' A' ' 9' ' ' TRP 0.25 4.3 m-30 -119.73 -178.3 3.6 Favored 'General case' 0 CA--C 1.502 -0.89 1 O-C-N 129.247 4.092 . . . . 0.0 113.418 -179.981 . . . . . . . . 4 3 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.435 ' N ' ' HB2' ' A' ' 115' ' ' LYS 0.274 0.0 OUTLIER -167.21 41.56 0.05 OUTLIER 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 114.558 -2.639 . . . . 0.0 104.479 179.516 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.613 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 44.59 -151.87 0.04 OUTLIER 'General case' 0 CA--C 1.49 -1.33 1 O-C-N 131.071 5.232 . . . . 0.0 112.881 -179.387 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.513 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.853 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.673 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 mmt . . . . . 0 N--CA 1.51 2.575 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 96.9 m -158.06 -53.41 0.07 Allowed 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 113.494 -1.685 . . . . 0.0 108.45 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.36 -179.84 8.11 Favored 'General case' 0 CA--C 1.496 -1.108 0 C-N-CA 117.891 -1.523 . . . . 0.0 113.917 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.42 ' HA ' ' NE2' ' A' ' 45' ' ' GLN . 2.2 m-20 56.63 77.53 0.25 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.97 98.61 3.2 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 116.17 -2.212 . . . . 0.0 109.426 179.895 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -65.77 153.66 41.2 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 130.242 3.417 . . . . 0.0 110.606 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 169.02 -148.46 12.27 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-O 114.41 -3.439 . . . . 0.0 109.796 -179.904 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -158.8 136.8 10.49 Favored 'General case' 0 C--N 1.315 -0.927 1 O-C-N 130.773 4.455 . . . . 0.0 103.695 179.919 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.545 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.8 OUTLIER -120.99 124.84 45.84 Favored 'General case' 0 CA--C 1.495 -1.158 1 O-C-N 131.88 5.738 . . . . 0.0 117.854 -179.765 . . . . . . . . 4 4 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 132' ' ' LYS . 9.3 mt-10 -83.0 109.76 17.38 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 116.546 -2.062 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.278 8.4 ttm -67.69 81.62 0.18 Allowed 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 125.131 1.52 . . . . 0.0 108.266 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -37.42 -48.67 0.96 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.989 2.915 . . . . 0.0 110.187 179.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.276 4.0 m -165.8 153.84 10.89 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 108.663 -3.88 . . . . 0.0 110.532 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -105.62 137.93 42.65 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-N 110.31 -3.132 . . . . 0.0 114.293 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.41 -62.48 1.6 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 128.446 3.591 . . . . 0.0 111.562 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.433 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -135.71 138.69 43.0 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 125.623 1.569 . . . . 0.0 108.735 179.803 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 37.0 p90 -123.52 -41.88 2.25 Favored 'General case' 0 C--O 1.207 -1.148 0 CA-C-O 124.502 2.096 . . . . 0.0 112.002 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.574 ' N ' ' CD1' ' A' ' 17' ' ' PHE . 1.8 tm-20 -75.55 -34.06 60.7 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-O 115.065 -2.398 . . . . 0.0 112.216 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.519 ' HA2' ' CG ' ' A' ' 22' ' ' LYS . . . -63.96 -29.65 75.45 Favored Glycine 0 N--CA 1.48 1.578 1 O-C-N 133.469 6.73 . . . . 0.0 111.968 -179.941 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.481 ' CD1' HD22 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -80.05 -43.25 22.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-O 125.935 2.779 . . . . 0.0 109.945 179.716 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.403 ' HB3' ' CG2' ' A' ' 26' ' ' ILE . 19.5 mtt -55.66 -42.95 75.8 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 113.812 -1.54 . . . . 0.0 113.685 -179.579 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.519 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.36 -20.38 59.02 Favored 'General case' 0 C--O 1.213 -0.827 1 O-C-N 129.828 4.455 . . . . 0.0 114.768 179.131 . . . . . . . . 4 4 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.418 ' HB2' HD21 ' A' ' 24' ' ' LEU . . . -65.44 -42.46 92.4 Favored 'General case' 0 C--O 1.212 -0.897 1 O-C-N 132.304 6.003 . . . . 0.0 113.314 -179.979 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.481 HD22 ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -89.12 -10.62 46.62 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 108.897 -3.774 . . . . 0.0 106.656 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 66.52 72.71 0.37 Allowed 'General case' 0 N--CA 1.436 -1.14 0 C-N-CA 129.805 3.242 . . . . 0.0 112.973 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.403 ' CG2' ' HB3' ' A' ' 21' ' ' MET . 8.2 tp -107.48 13.62 8.32 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-O 128.475 3.988 . . . . 0.0 109.456 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -50.25 100.38 0.02 OUTLIER 'General case' 0 C--N 1.357 0.915 0 CA-C-N 109.696 -3.411 . . . . 0.0 111.148 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -144.12 24.67 1.62 Allowed 'General case' 0 CA--C 1.501 -0.907 0 O-C-N 126.604 2.44 . . . . 0.0 112.263 179.71 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.38 49.88 8.31 Favored 'General case' 0 C--O 1.201 -1.481 0 O-C-N 126.966 2.666 . . . . 0.0 110.018 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.57 -26.77 13.72 Favored 'General case' 0 N--CA 1.48 1.032 2 CA-C-N 105.782 -5.19 . . . . 0.0 110.307 -179.855 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.42 ' HG2' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -74.21 -166.99 0.46 Allowed 'General case' 0 C--N 1.315 -0.918 1 O-C-N 129.83 4.456 . . . . 0.0 109.695 -179.763 . . . . . . . . 4 4 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 90.06 -28.06 0.04 OUTLIER 'General case' 0 C--O 1.202 -1.431 1 O-C-N 130.084 4.615 . . . . 0.0 113.676 179.815 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -131.37 8.1 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 O-C-N 127.629 3.081 . . . . 0.0 110.317 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.72 37.08 2.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.102 179.657 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 66.9 t -50.04 -48.75 22.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 126.257 2.223 . . . . 0.0 109.57 179.665 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.497 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 6.8 tpp85 -141.89 144.09 33.64 Favored 'General case' 0 C--O 1.211 -0.938 2 O-C-N 129.908 4.505 . . . . 0.0 108.29 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.637 ' O ' ' N ' ' A' ' 39' ' ' GLN . 1.2 mp -89.02 96.08 10.58 Favored 'General case' 0 C--O 1.209 -1.046 2 O-C-N 132.892 6.37 . . . . 0.0 103.736 177.06 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.522 ' CG2' ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER 5.23 -51.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 1 O-C-N 137.34 9.15 . . . . 0.0 109.865 -177.879 . . . . . . . . 4 4 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.637 ' N ' ' O ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.72 -166.42 2.52 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 118.96 2.948 . . . . 0.0 118.96 179.658 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.579 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 17.6 m -42.26 149.08 0.17 Allowed 'General case' 0 N--CA 1.426 -1.659 1 C-N-CA 132.782 4.433 . . . . 0.0 115.359 179.293 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.513 ' HD3' ' C ' ' A' ' 41' ' ' LYS 0.289 0.1 OUTLIER -109.28 149.86 28.81 Favored 'General case' 0 N--CA 1.49 1.529 2 O-C-N 131.27 5.356 . . . . 0.0 101.421 178.185 . . . . . . . . 5 4 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.486 ' N ' ' O ' ' A' ' 53' ' ' LYS . 2.3 mp -127.02 163.14 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 125.102 1.501 . . . . 0.0 111.534 179.342 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -132.77 143.16 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 CA-C-N 111.181 -2.736 . . . . 0.0 109.568 179.615 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.265 86.9 t -151.77 118.12 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 116.612 -2.035 . . . . 0.0 111.286 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.447 ' HG2' ' CD1' ' A' ' 50' ' ' PHE . 36.9 mt-30 -118.62 111.56 18.71 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -100.32 26.53 6.49 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 128.856 3.847 . . . . 0.0 111.37 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 109.51 -121.59 6.15 Favored Glycine 0 C--O 1.213 -1.156 0 O-C-N 120.844 -1.16 . . . . 0.0 115.345 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -59.69 -27.25 66.27 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 117.469 -1.692 . . . . 0.0 113.883 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -100.79 109.99 22.03 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 128.855 3.847 . . . . 0.0 110.593 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.541 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 0.5 OUTLIER -113.61 111.95 22.7 Favored 'General case' 0 C--N 1.311 -1.088 1 O-C-N 129.119 4.012 . . . . 0.0 110.78 179.9 . . . . . . . . 4 4 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -123.48 102.28 7.79 Favored 'General case' 0 C--O 1.196 -1.754 1 O-C-N 129.473 4.233 . . . . 0.0 117.8 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.486 ' CB ' ' HB3' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.3 160.71 28.64 Favored 'General case' 0 N--CA 1.473 0.676 1 O-C-N 130.256 4.722 . . . . 0.0 106.176 179.172 . . . . . . . . 4 4 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -166.16 146.56 6.38 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 179.738 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.8 t -111.64 162.91 14.68 Favored 'General case' 0 C--N 1.31 -1.131 0 O-C-N 126.707 2.504 . . . . 0.0 113.406 -179.725 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.413 ' HB3' ' NE2' ' A' ' 39' ' ' GLN . 1.7 t-20 -106.8 -12.42 15.51 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 115.622 -2.132 . . . . 0.0 112.287 -179.764 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.455 ' HB2' ' HB3' ' A' ' 37' ' ' LEU . 98.8 p -23.61 120.36 0.04 OUTLIER 'General case' 0 CA--C 1.509 -0.63 1 O-C-N 131.634 5.584 . . . . 0.0 107.687 178.409 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.522 ' HB ' ' CG2' ' A' ' 38' ' ' THR . 0.6 OUTLIER -51.31 -31.3 21.09 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 128.031 3.332 . . . . 0.0 107.472 179.816 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.468 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 13.6 m-85 -57.09 -73.45 0.07 Allowed 'General case' 0 C--N 1.351 0.658 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 179.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -155.78 129.93 8.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 113.415 -1.721 . . . . 0.0 111.084 -179.655 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -105.53 54.75 0.7 Allowed 'General case' 0 C--O 1.211 -0.942 0 O-C-N 127.82 3.2 . . . . 0.0 111.992 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -75.02 73.93 2.2 Favored 'General case' 0 N--CA 1.47 0.556 1 O-C-N 129.766 4.416 . . . . 0.0 106.85 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.416 ' CB ' ' HB3' ' A' ' 53' ' ' LYS . 5.0 p30 -45.54 114.22 0.72 Allowed 'General case' 0 C--O 1.202 -1.412 0 O-C-N 128.379 3.549 . . . . 0.0 116.05 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.547 ' CD2' ' CZ ' ' A' ' 65' ' ' PHE . 4.0 tp -65.86 79.69 0.08 Allowed 'General case' 0 C--O 1.214 -0.791 1 O-C-N 129.65 4.344 . . . . 0.0 110.579 179.32 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.413 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 5.7 m-20 -111.01 96.95 6.46 Favored 'General case' 0 CA--C 1.486 -1.483 0 C-N-CA 115.917 -2.313 . . . . 0.0 113.568 -178.348 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.551 ' CE2' ' CZ2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -130.12 -176.05 3.82 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 125.875 2.75 . . . . 0.0 106.5 178.665 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.452 ' CG2' HG22 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -137.33 156.01 48.74 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.447 ' HA ' ' CG1' ' A' ' 87' ' ' VAL . 20.5 t -64.5 149.26 11.24 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.203 0 O-C-N 128.923 3.889 . . . . 0.0 115.515 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 32.53 31.93 0.01 OUTLIER Glycine 0 N--CA 1.468 0.803 1 O-C-N 130.445 4.841 . . . . 0.0 117.359 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.452 HG22 ' CG2' ' A' ' 66' ' ' THR . 0.9 OUTLIER -91.14 -16.38 8.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.609 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 68.03 90.91 0.09 Allowed 'General case' 0 C--N 1.355 0.816 1 O-C-N 129.121 4.013 . . . . 0.0 109.787 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.448 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.1 OUTLIER -80.46 82.22 6.54 Favored 'General case' 0 CA--C 1.494 -1.194 0 O-C-N 127.13 2.769 . . . . 0.0 114.882 179.834 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.04 88.58 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 113.618 -1.628 . . . . 0.0 111.33 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.48 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 60.8 161.76 0.06 Allowed 'General case' 0 C--O 1.209 -1.055 0 C-N-CA 126.638 1.975 . . . . 0.0 112.821 179.994 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 149.8 73.58 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 128.387 3.554 . . . . 0.0 113.983 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.295 0.8 OUTLIER -132.3 97.27 4.07 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 116.072 -1.918 . . . . 0.0 109.504 179.931 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -151.01 124.62 9.03 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 128.684 3.74 . . . . 0.0 111.776 179.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.44 -41.09 1.89 Allowed Glycine 0 C--O 1.216 -1.027 0 CA-C-N 109.717 -3.401 . . . . 0.0 112.889 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.1 tp -106.01 -9.45 17.05 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 129.619 3.776 . . . . 0.0 114.629 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -149.18 -62.74 0.23 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.824 -179.85 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.75 52.18 3.59 Favored Glycine 0 C--O 1.214 -1.132 0 CA-C-O 126.442 3.246 . . . . 0.0 112.611 -179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.98 -156.86 0.71 Allowed 'General case' 0 C--N 1.354 0.792 0 CA-C-N 110.616 -2.792 . . . . 0.0 113.847 -179.773 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.48 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -151.92 109.58 3.63 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.805 1.288 . . . . 0.0 107.88 178.265 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.493 ' CG1' ' HB3' ' A' ' 98' ' ' GLN . 72.6 t -140.48 127.78 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.524 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -176.811 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -59.79 88.28 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 112.467 -2.152 . . . . 0.0 109.608 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.448 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 52.5 m -85.88 67.22 9.95 Favored 'General case' 0 C--O 1.196 -1.711 0 O-C-N 128.504 3.628 . . . . 0.0 116.214 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -58.59 146.97 34.01 Favored 'General case' 0 C--O 1.211 -0.925 1 CA-C-N 107.713 -4.312 . . . . 0.0 115.73 -179.744 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.447 ' CG1' ' HA ' ' A' ' 67' ' ' VAL . 59.7 t -130.54 132.4 64.55 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.29 0 C-N-CA 127.499 2.32 . . . . 0.0 107.268 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.417 ' HB ' HG13 ' A' ' 95' ' ' VAL 0.358 27.8 m -142.57 -156.62 0.7 Allowed 'General case' 0 CA--C 1.48 -1.729 0 CA-C-N 112.698 -2.046 . . . . 0.0 105.698 -179.554 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.714 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.279 10.9 m95 -154.18 143.51 21.38 Favored 'General case' 0 CA--C 1.51 -0.595 0 O-C-N 118.349 -2.72 . . . . 0.0 105.492 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -111.21 -146.38 0.41 Allowed 'General case' 0 CA--C 1.483 -1.605 0 O-C-N 126.583 2.427 . . . . 0.0 111.268 179.39 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -74.28 -30.93 59.92 Favored Glycine 0 N--CA 1.487 2.072 1 N-CA-C 101.144 -4.782 . . . . 0.0 101.144 179.741 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.29 69.3 0.18 Allowed 'General case' 0 C--O 1.197 -1.695 1 O-C-N 133.2 5.883 . . . . 0.0 111.625 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.645 ' O ' ' N ' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.94 133.09 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 119.395 3.109 . . . . 0.0 119.395 178.049 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.586 ' N ' ' CZ3' ' A' ' 89' ' ' TRP . 0.5 OUTLIER -61.06 10.84 0.02 OUTLIER 'General case' 0 CA--C 1.478 -1.807 0 N-CA-C 120.246 3.424 . . . . 0.0 120.246 -178.293 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.417 HG13 ' HB ' ' A' ' 88' ' ' THR . 15.0 t 3.92 114.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.482 -1.656 0 N-CA-C 119.318 3.081 . . . . 0.0 119.318 -178.603 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.432 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 7.0 p -132.94 140.39 47.81 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 124.847 2.26 . . . . 0.0 108.313 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.421 ' O ' ' N ' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -135.32 80.75 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 CA-C-N 110.013 -3.267 . . . . 0.0 116.533 179.794 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.493 ' HB3' ' CG1' ' A' ' 83' ' ' VAL . 10.8 mt-30 -50.21 93.8 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 123.937 1.827 . . . . 0.0 108.358 -179.942 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.421 ' N ' ' O ' ' A' ' 97' ' ' VAL . 0.0 OUTLIER -88.98 106.7 18.6 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 109.258 -3.61 . . . . 0.0 111.395 -179.767 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.457 ' CA ' HG23 ' A' ' 83' ' ' VAL . . . -105.57 -83.98 1.7 Allowed Glycine 0 C--O 1.197 -2.188 1 CA-C-O 127.9 4.056 . . . . 0.0 110.141 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -176.4 -54.2 0.01 OUTLIER 'General case' 0 C--N 1.355 0.819 1 CA-C-N 107.051 -4.575 . . . . 0.0 112.765 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -87.25 -52.62 5.29 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 125.971 2.796 . . . . 0.0 115.666 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -102.28 158.76 15.96 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 110.362 -3.108 . . . . 0.0 116.424 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -117.2 85.08 2.26 Favored 'General case' 0 N--CA 1.49 1.565 1 CA-C-N 107.309 -4.496 . . . . 0.0 102.158 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -79.13 7.4 7.57 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 126.366 2.291 . . . . 0.0 115.921 -179.188 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -49.75 131.62 27.27 Favored Glycine 0 C--O 1.204 -1.756 1 O-C-N 129.372 4.17 . . . . 0.0 110.582 179.25 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.551 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE . 6.5 p90 -117.17 8.78 13.34 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 129.723 3.837 . . . . 0.0 119.387 -179.593 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -28.47 142.81 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 1 CA-C-N 108.26 -4.064 . . . . 0.0 112.757 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.515 ' CG ' ' CD2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -123.16 148.65 45.52 Favored 'General case' 0 C--N 1.362 1.127 0 CA-C-O 113.709 -3.043 . . . . 0.0 108.954 179.876 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.488 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.2 OUTLIER -145.64 84.6 1.68 Allowed 'General case' 0 C--N 1.303 -1.44 1 O-C-N 132.097 5.873 . . . . 0.0 115.066 179.59 . . . . . . . . 4 4 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 18.5 t -22.75 104.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.491 -1.311 0 C-N-CA 126.671 1.988 . . . . 0.0 115.802 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -134.85 153.77 51.91 Favored 'General case' 0 CA--C 1.481 -1.678 0 CA-C-N 111.137 -2.756 . . . . 0.0 118.183 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 50.29 -93.14 0.01 OUTLIER Glycine 0 C--O 1.198 -2.1 0 CA-C-O 123.599 1.666 . . . . 0.0 113.813 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -147.63 31.86 0.88 Allowed 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.18 -169.23 2.86 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 128.164 3.415 . . . . 0.0 111.189 -179.611 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 37.1 tp -128.62 88.06 2.68 Favored 'General case' 0 C--O 1.201 -1.493 0 CA-C-O 127.226 3.393 . . . . 0.0 111.435 179.795 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -44.86 97.11 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.731 1 CA-C-N 107.823 -4.262 . . . . 0.0 117.383 -179.177 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.41 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -78.87 120.63 23.76 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 113.545 -3.121 . . . . 0.0 105.403 178.26 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.488 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 7.6 mt-10 -134.13 85.63 2.21 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 126.923 2.639 . . . . 0.0 106.682 -178.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.426 ' CB ' ' HA ' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -98.48 148.04 24.14 Favored 'General case' 0 CA--C 1.483 -1.61 1 O-C-N 129.757 4.41 . . . . 0.0 108.857 -179.956 . . . . . . . . 4 4 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -110.09 160.54 16.37 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 111.429 -2.623 . . . . 0.0 105.135 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -159.96 47.24 0.26 Allowed 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 125.899 2.761 . . . . 0.0 112.275 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.13 -98.33 1.96 Allowed Glycine 0 N--CA 1.438 -1.195 0 CA-C-N 111.739 -2.482 . . . . 0.0 110.709 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -83.61 -29.61 27.6 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 109.305 -3.448 . . . . 0.0 111.026 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -103.15 160.45 14.64 Favored 'General case' 0 C--O 1.207 -1.174 0 O-C-N 127.531 3.02 . . . . 0.0 109.75 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.57 101.14 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.5 -0.97 1 CA-C-N 108.303 -4.044 . . . . 0.0 112.327 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.2 m -79.67 149.7 31.16 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 113.307 -1.769 . . . . 0.0 109.726 179.789 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -140.58 76.14 1.54 Allowed 'General case' 0 N--CA 1.476 0.866 0 O-C-N 127.74 3.15 . . . . 0.0 110.491 179.953 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.86 176.1 0.58 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 117.747 -1.581 . . . . 0.0 114.501 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.259 83.9 t -149.64 87.55 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.563 0 CA-C-O 125.037 2.351 . . . . 0.0 105.624 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 3.4 m-85 -70.57 -178.67 1.86 Allowed 'General case' 0 CA--C 1.486 -1.496 0 CA-C-N 109.015 -3.72 . . . . 0.0 117.625 -179.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 10' ' ' GLU . 0.8 OUTLIER -163.96 117.01 1.43 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 111.461 -2.609 . . . . 0.0 108.067 -179.907 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.545 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -56.14 49.85 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 119.918 3.303 . . . . 0.0 119.918 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.444 ' HA ' ' HG3' ' A' ' 10' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.788 0 CA-C-O 113.062 -3.351 . . . . 0.0 118.352 -178.697 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mtp . . . . . 0 N--CA 1.501 2.11 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.1 m -70.58 -23.71 62.64 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 179.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm -102.47 10.87 38.65 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 -179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -96.82 84.45 3.6 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 116.577 -1.678 . . . . 0.0 107.284 -179.853 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -117.79 145.85 44.24 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 103.85 -2.648 . . . . 0.0 103.85 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -154.54 149.35 26.61 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 129.43 3.092 . . . . 0.0 110.933 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.64 -173.56 44.09 Favored Glycine 0 C--O 1.21 -1.349 0 CA-C-O 116.15 -2.472 . . . . 0.0 110.722 179.788 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.485 HG21 ' CG ' ' A' ' 134' ' ' LYS . 5.6 t -139.29 22.2 2.57 Favored 'General case' 0 C--O 1.208 -1.114 0 O-C-N 129.859 3.917 . . . . 0.0 109.83 179.858 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.602 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.291 0.0 OUTLIER -23.66 124.45 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.443 1 O-C-N 133.768 6.917 . . . . 0.0 112.081 179.552 . . . . . . . . 5 4 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -74.09 -3.21 28.11 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -179.172 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.487 ' HB3' ' CG ' ' A' ' 39' ' ' GLN 0.313 1.0 OUTLIER 49.59 35.97 9.56 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 114.074 -2.87 . . . . 0.0 103.269 179.707 . . . . . . . . 4 4 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.468 ' HB2' ' CB ' ' A' ' 132' ' ' LYS . 4.8 tt0 -26.77 -46.92 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.256 2 O-C-N 132.542 6.152 . . . . 0.0 113.919 -178.876 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.2 t -121.72 -152.22 0.5 Allowed 'General case' 0 C--O 1.245 0.817 0 C-N-CA 117.894 -1.522 . . . . 0.0 112.312 -178.522 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.51 ' ND2' ' N ' ' A' ' 15' ' ' GLU . 2.4 t-20 157.34 136.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 O-C-N 125.371 1.669 . . . . 0.0 111.797 179.437 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.51 ' N ' ' ND2' ' A' ' 14' ' ' ASN . 8.5 mm-40 -91.71 -70.16 0.7 Allowed 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 127.795 3.184 . . . . 0.0 108.16 179.505 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -96.15 157.74 15.76 Favored 'General case' 0 C--O 1.202 -1.413 0 O-C-N 120.812 -1.18 . . . . 0.0 112.872 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -149.01 -48.39 0.15 Allowed 'General case' 0 C--O 1.22 -0.49 0 O-C-N 125.257 1.598 . . . . 0.0 111.284 -179.942 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.465 ' CG ' ' HB2' ' A' ' 31' ' ' ARG . 1.3 mt-10 -67.58 -45.69 74.83 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 111.924 -2.398 . . . . 0.0 115.848 179.782 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.23 -22.92 65.76 Favored Glycine 0 N--CA 1.483 1.77 0 O-C-N 129.1 4.0 . . . . 0.0 111.345 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.5 ' CE1' HD23 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -78.78 -43.67 24.96 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-O 124.962 2.315 . . . . 0.0 107.666 179.992 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.434 ' CB ' HG23 ' A' ' 26' ' ' ILE . 17.8 mtt -66.42 -33.08 74.9 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.69 179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -73.4 -25.54 60.59 Favored 'General case' 0 C--O 1.214 -0.773 0 O-C-N 128.053 3.346 . . . . 0.0 114.436 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.34 -52.49 32.77 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.968 3.918 . . . . 0.0 111.029 179.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.5 HD23 ' CE1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -86.18 -6.39 59.0 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 110.056 -3.247 . . . . 0.0 108.633 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 39.64 73.91 0.11 Allowed 'General case' 0 CA--C 1.484 -1.566 0 O-C-N 127.653 3.095 . . . . 0.0 108.115 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.45 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 10.8 tt -65.68 -26.34 38.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.029 1 CA-C-N 108.191 -4.095 . . . . 0.0 109.069 -179.964 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 145.97 134.58 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 111.277 -2.692 . . . . 0.0 109.208 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -94.45 87.61 5.22 Favored 'General case' 0 N--CA 1.483 1.182 1 O-C-N 129.913 4.508 . . . . 0.0 108.477 179.358 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 150.31 65.84 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 1 O-C-N 129.493 4.246 . . . . 0.0 104.229 -179.363 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.8 m 142.28 66.58 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.247 2 O-C-N 132.815 6.322 . . . . 0.0 109.009 -179.894 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.465 ' HB2' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -138.08 -56.24 0.66 Allowed 'General case' 0 N--CA 1.447 -0.61 2 O-C-N 130.254 4.721 . . . . 0.0 108.987 -179.711 . . . . . . . . 4 4 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.44 1.27 55.11 Favored 'General case' 0 C--O 1.205 -1.255 0 O-C-N 127.156 2.785 . . . . 0.0 113.715 179.886 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.476 ' CD1' ' N ' ' A' ' 33' ' ' ILE . 1.7 mp -108.23 -47.63 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 2 O-C-N 129.394 4.184 . . . . 0.0 114.681 -179.621 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.478 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -54.73 -44.42 73.53 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 122.491 1.139 . . . . 0.0 113.214 179.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 78.4 t 25.81 -74.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.204 -1.342 0 CA-C-N 110.388 -3.096 . . . . 0.0 115.123 -179.806 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 34' ' ' ALA . 2.8 tmm_? -176.3 100.56 0.06 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.683 -1.599 . . . . 0.0 111.012 179.856 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.503 ' HB3' ' CE2' ' A' ' 58' ' ' PHE . 0.8 OUTLIER -94.84 -0.6 53.94 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 129.05 3.969 . . . . 0.0 110.59 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 16.6 m 133.84 88.33 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.752 1 O-C-N 132.964 6.415 . . . . 0.0 111.503 -179.662 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.487 ' CG ' ' HB3' ' A' ' 11' ' ' MET . 0.0 OUTLIER -88.25 -179.05 6.06 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 116.288 -2.165 . . . . 0.0 115.581 -179.584 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.6 m -178.6 137.39 0.16 Allowed 'General case' 0 N--CA 1.431 -1.384 1 O-C-N 129.913 4.508 . . . . 0.0 112.498 179.583 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.567 ' HD2' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -122.54 157.13 32.73 Favored 'General case' 0 N--CA 1.489 1.494 1 O-C-N 129.321 4.138 . . . . 0.0 102.523 179.694 . . . . . . . . 4 4 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.51 ' N ' ' O ' ' A' ' 53' ' ' LYS . 6.7 mt -149.82 104.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.433 0 O-C-N 127.547 3.03 . . . . 0.0 112.287 -178.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.495 HD12 ' CE1' ' A' ' 50' ' ' PHE 0.258 0.1 OUTLIER -83.39 135.4 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 2 CA-C-N 106.444 -4.889 . . . . 0.0 110.525 -179.855 . . . . . . . . 5 4 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -143.95 96.58 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 CA-C-N 111.77 -2.468 . . . . 0.0 116.419 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -94.84 126.73 40.35 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.154 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -132.83 31.85 3.88 Favored 'General case' 0 CA--C 1.49 -1.328 1 O-C-N 130.373 4.795 . . . . 0.0 111.99 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.85 120.36 0.66 Allowed Glycine 0 C--O 1.204 -1.764 0 O-C-N 126.061 2.101 . . . . 0.0 112.685 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 70.43 -69.69 0.17 Allowed 'General case' 0 C--O 1.212 -0.869 0 CA-C-O 116.683 -1.627 . . . . 0.0 112.015 179.854 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.2 m-20 -95.91 114.14 25.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 128.074 3.359 . . . . 0.0 111.493 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.522 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 3.0 t80 -115.39 139.98 49.53 Favored 'General case' 0 CA--C 1.489 -1.385 1 O-C-N 129.52 4.262 . . . . 0.0 114.968 -179.806 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.522 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 67.5 mttt -144.86 102.19 3.75 Favored 'General case' 0 CA--C 1.489 -1.378 0 N-CA-C 118.952 2.945 . . . . 0.0 118.952 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.511 ' CB ' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.29 160.96 28.35 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 128.652 3.72 . . . . 0.0 105.67 178.449 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 42' ' ' ILE 0.25 0.0 OUTLIER -158.03 127.4 5.82 Favored 'General case' 0 CA--C 1.482 -1.669 1 O-C-N 130.449 4.843 . . . . 0.0 112.08 -175.681 . . . . . . . . 5 4 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.4 ' N ' ' HE3' ' A' ' 53' ' ' LYS 0.283 0.4 OUTLIER -94.88 147.65 23.14 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 124.277 1.989 . . . . 0.0 112.853 179.708 . . . . . . . . 4 4 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -132.36 59.33 1.72 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 110.282 -3.145 . . . . 0.0 116.958 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 m -93.85 -176.39 4.02 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 130.695 3.598 . . . . 0.0 106.214 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.447 ' HB ' ' CD2' ' A' ' 37' ' ' LEU . 92.2 m -113.27 -50.39 2.87 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 128.902 3.876 . . . . 0.0 107.659 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.503 ' CE2' ' HB3' ' A' ' 37' ' ' LEU . 9.0 m-85 -50.06 -57.36 7.79 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 128.579 3.675 . . . . 0.0 110.368 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -154.34 105.82 2.71 Favored 'General case' 0 C--O 1.213 -0.836 1 O-C-N 130.812 5.07 . . . . 0.0 114.112 -179.729 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -86.63 80.84 8.45 Favored 'General case' 0 C--O 1.205 -1.276 1 O-C-N 130.563 4.915 . . . . 0.0 112.066 -179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -68.06 166.86 15.11 Favored 'General case' 0 C--O 1.219 -0.521 0 O-C-N 128.79 3.806 . . . . 0.0 107.174 179.627 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -140.2 89.37 2.29 Favored 'General case' 0 C--O 1.207 -1.145 1 O-C-N 129.819 4.45 . . . . 0.0 113.014 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.529 ' HG ' ' CD2' ' A' ' 65' ' ' PHE . 4.6 tp -72.85 64.35 0.67 Allowed 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.62 -1.627 . . . . 0.0 112.4 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.413 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 2.9 t0 -95.5 104.9 16.82 Favored 'General case' 0 C--O 1.21 -0.983 0 CA-C-N 112.636 -2.075 . . . . 0.0 105.551 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.529 ' CD2' ' HG ' ' A' ' 63' ' ' LEU . 9.6 m-85 -123.03 -178.48 3.97 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.354 2.262 . . . . 0.0 110.716 179.824 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.412 ' CG2' HG21 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -150.68 133.3 15.73 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 179.34 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 54.8 t -52.75 137.77 12.36 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 O-C-N 126.994 2.684 . . . . 0.0 114.973 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 87' ' ' VAL . . . 33.12 45.23 0.26 Allowed Glycine 0 N--CA 1.468 0.831 1 O-C-N 130.969 5.168 . . . . 0.0 117.363 179.94 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.412 HG21 ' CG2' ' A' ' 66' ' ' THR 0.319 0.4 OUTLIER -88.72 -14.04 9.58 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.62 179.928 . . . . . . . . 4 4 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 65.41 71.33 0.44 Allowed 'General case' 0 C--N 1.364 1.235 1 O-C-N 129.568 4.293 . . . . 0.0 109.547 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.407 ' HB3' HG23 ' A' ' 85' ' ' THR . 2.3 t80 -65.46 72.22 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.86 2 O-C-N 130.835 5.085 . . . . 0.0 112.763 -179.805 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.43 101.72 0.05 OUTLIER 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 113.127 -1.851 . . . . 0.0 115.427 179.784 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.503 ' HG3' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 63.07 -164.26 0.26 Allowed 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 123.694 1.712 . . . . 0.0 113.224 179.328 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 75.28 88.23 0.09 Allowed 'General case' 0 C--O 1.203 -1.378 0 CA-C-N 109.086 -3.688 . . . . 0.0 113.411 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.26 72.8 p -116.67 -8.38 11.45 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 111.132 -2.758 . . . . 0.0 116.1 -179.74 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.36 151.67 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.925 1 O-C-N 129.214 4.071 . . . . 0.0 116.411 -179.684 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.19 -55.04 4.93 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 110.165 -3.198 . . . . 0.0 113.565 179.712 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.45 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 12.9 tp -80.93 -47.88 13.09 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.017 2.834 . . . . 0.0 113.158 179.911 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.454 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . 0.9 OUTLIER -112.56 -58.97 2.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 125.772 2.701 . . . . 0.0 112.142 179.847 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.59 49.6 5.69 Favored Glycine 0 C--O 1.207 -1.593 0 CA-C-N 111.748 -2.478 . . . . 0.0 111.968 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.44 ' CG ' ' N ' ' A' ' 82' ' ' ASN . 2.0 ttm-85 -121.04 -104.58 0.39 Allowed 'General case' 0 C--N 1.366 1.315 0 CA-C-N 109.968 -3.116 . . . . 0.0 114.644 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.503 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 6.5 m-20 156.02 103.31 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.836 0 O-C-N 125.729 1.893 . . . . 0.0 108.341 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.423 ' N ' ' HG3' ' A' ' 73' ' ' GLU . 1.5 t -153.72 145.31 14.47 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.372 0 O-C-N 126.852 2.595 . . . . 0.0 117.267 -179.332 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.17 161.24 2.53 Favored 'General case' 0 C--O 1.235 0.335 1 O-C-N 129.455 4.222 . . . . 0.0 106.87 178.791 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.407 HG23 ' HB3' ' A' ' 71' ' ' PHE . 1.2 m -161.28 95.23 1.02 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-O 126.389 2.995 . . . . 0.0 110.77 -179.936 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tp -101.7 111.76 24.12 Favored 'General case' 0 N--CA 1.429 -1.483 1 CA-C-N 108.106 -4.134 . . . . 0.0 116.993 -179.176 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.458 HG23 ' CG ' ' A' ' 65' ' ' PHE . 81.0 t -82.5 144.48 10.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 179.272 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.43 ' N ' HG11 ' A' ' 87' ' ' VAL 0.315 1.1 m -162.17 168.75 21.97 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-O 126.734 3.159 . . . . 0.0 110.732 -179.774 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.688 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 56.4 m95 -98.17 139.4 34.02 Favored 'General case' 0 C--N 1.361 1.078 0 CA-C-O 114.755 -2.545 . . . . 0.0 106.658 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.53 -49.49 8.01 Favored 'General case' 0 CA--C 1.483 -1.609 1 CA-C-O 132.231 5.777 . . . . 0.0 112.41 179.797 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -170.56 -56.4 0.04 OUTLIER Glycine 0 C--O 1.213 -1.189 1 CA-C-N 108.119 -4.128 . . . . 0.0 103.285 -179.763 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -141.38 49.37 1.63 Allowed 'General case' 0 N--CA 1.444 -0.731 1 O-C-N 131.949 5.147 . . . . 0.0 109.694 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.1 t -176.45 155.99 1.48 Allowed 'General case' 0 C--O 1.203 -1.385 0 N-CA-C 118.063 2.616 . . . . 0.0 118.063 -179.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.474 ' CD1' ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -85.6 98.83 10.87 Favored 'General case' 0 CA--C 1.487 -1.47 0 O-C-N 127.907 3.254 . . . . 0.0 115.168 -179.798 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.425 ' HA ' ' HB3' ' A' ' 108' ' ' LYS . 49.9 t -99.68 120.96 49.78 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.377 0 CA-C-N 110.897 -2.865 . . . . 0.0 114.017 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.588 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 12.1 m -132.5 134.26 44.8 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 103.373 -2.825 . . . . 0.0 103.373 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -120.1 116.3 49.96 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 108.715 -3.857 . . . . 0.0 119.268 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.424 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -87.99 109.26 19.69 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-N 112.459 -2.155 . . . . 0.0 107.436 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.12 116.18 27.98 Favored 'General case' 0 C--O 1.195 -1.773 0 O-C-N 128.05 3.344 . . . . 0.0 113.619 -179.017 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.422 ' O ' ' N ' ' A' ' 102' ' ' LYS . . . 172.41 176.5 41.19 Favored Glycine 0 C--O 1.199 -2.062 0 CA-C-N 113.172 -1.831 . . . . 0.0 112.402 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.403 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 4.5 tt0 3.45 -61.15 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.275 2 O-C-N 130.996 4.586 . . . . 0.0 114.537 179.645 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER -149.51 -37.21 0.16 Allowed 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 179.474 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -52.19 124.39 12.98 Favored 'General case' 0 N--CA 1.441 -0.918 0 O-C-N 126.544 2.403 . . . . 0.0 116.349 -179.771 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -112.02 67.97 0.66 Allowed 'General case' 0 N--CA 1.484 1.268 2 O-C-N 130.039 4.587 . . . . 0.0 102.148 179.781 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.424 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 23.5 mmm-85 -94.84 36.73 1.17 Allowed 'General case' 0 C--O 1.203 -1.364 1 O-C-N 129.321 4.138 . . . . 0.0 110.167 179.772 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -77.58 67.82 2.81 Favored Glycine 0 N--CA 1.445 -0.759 0 O-C-N 128.297 3.498 . . . . 0.0 111.445 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.588 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -80.98 141.65 34.22 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 129.699 3.823 . . . . 0.0 110.553 179.397 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.425 ' HB3' ' HA ' ' A' ' 95' ' ' VAL . 3.0 ptpt -164.61 165.78 20.76 Favored 'General case' 0 N--CA 1.443 -0.786 1 O-C-N 129.265 4.103 . . . . 0.0 114.159 -178.728 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -116.28 175.27 5.63 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 109.729 -3.396 . . . . 0.0 106.415 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -125.78 -56.24 1.48 Allowed 'General case' 0 C--N 1.306 -1.311 1 O-C-N 130.659 4.974 . . . . 0.0 116.242 179.713 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.9 t 78.31 44.27 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-O 127.453 3.501 . . . . 0.0 108.485 -176.06 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.545 ' HG3' ' CZ ' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -103.07 129.88 50.03 Favored 'General case' 0 CA--C 1.477 -1.841 1 CA-C-N 107.081 -4.6 . . . . 0.0 110.823 -178.388 . . . . . . . . 4 4 . 1 . 023 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . 0.423 ' O ' ' NZ ' ' A' ' 115' ' ' LYS . . . 48.14 67.42 1.61 Allowed Glycine 0 C--O 1.194 -2.352 0 C-N-CA 125.026 1.298 . . . . 0.0 115.711 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 72.67 -43.4 0.56 Allowed 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 129.027 2.931 . . . . 0.0 118.679 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.429 ' CG ' ' CD1' ' A' ' 117' ' ' TYR . 4.6 ptpp? -100.78 -174.91 2.74 Favored 'General case' 0 C--N 1.312 -1.062 0 O-C-N 128.831 3.832 . . . . 0.0 108.064 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.565 ' HG ' ' CZ3' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -138.09 62.24 1.57 Allowed 'General case' 0 C--O 1.194 -1.838 0 O-C-N 126.914 2.634 . . . . 0.0 108.672 178.928 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.567 ' CB ' ' HB3' ' A' ' 129' ' ' GLN . 0.0 OUTLIER -32.27 131.81 0.14 Allowed 'General case' 0 C--N 1.365 1.258 1 O-C-N 130.521 4.888 . . . . 0.0 116.005 -177.093 . . . . . . . . 4 4 . 1 . 023 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.605 ' HB2' ' CE2' ' A' ' 131' ' ' PHE . 0.7 OUTLIER -87.83 65.84 8.53 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 128.661 3.726 . . . . 0.0 111.628 -178.87 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -77.8 122.5 25.5 Favored 'General case' 0 CA--C 1.485 -1.541 0 O-C-N 127.692 3.12 . . . . 0.0 108.014 -179.629 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.447 HD22 ' CB ' ' A' ' 127' ' ' CYS . 0.9 OUTLIER -146.15 -179.79 6.97 Favored 'General case' 0 CA--C 1.486 -1.512 0 C-N-CA 117.213 -1.795 . . . . 0.0 114.092 -179.791 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 44.8 m -128.36 160.89 30.8 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . 0.263 0.3 OUTLIER -173.6 107.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.953 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 12.12 76.9 0.01 OUTLIER Glycine 0 C--O 1.218 -0.849 1 O-C-N 129.896 4.498 . . . . 0.0 114.725 179.593 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 38.9 m-20 101.15 -53.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.391 0 O-C-N 129.048 3.44 . . . . 0.0 111.032 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -77.35 171.06 15.45 Favored 'General case' 0 C--O 1.2 -1.543 1 O-C-N 130.611 4.944 . . . . 0.0 110.323 -179.8 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.1 m -145.17 102.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 1 CA-C-N 107.28 -4.509 . . . . 0.0 111.31 179.454 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.447 ' CB ' HD22 ' A' ' 120' ' ' LEU . 0.1 OUTLIER -64.45 175.18 1.43 Allowed 'General case' 0 CA--C 1.494 -1.208 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 -179.625 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.523 ' C ' ' HG3' ' A' ' 129' ' ' GLN . 0.0 OUTLIER -142.04 64.63 1.38 Allowed 'General case' 0 C--N 1.346 0.446 0 C-N-CA 114.165 -3.014 . . . . 0.0 116.679 179.647 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.567 ' HB3' ' CB ' ' A' ' 117' ' ' TYR . 8.9 mt-30 57.24 -169.09 0.11 Allowed 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 120.815 3.635 . . . . 0.0 120.815 175.616 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.501 HG11 ' CA ' ' A' ' 14' ' ' ASN 0.256 1.5 m -173.5 -46.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 O-C-N 126.568 2.418 . . . . 0.0 113.448 -178.775 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.605 ' CE2' ' HB2' ' A' ' 118' ' ' LEU . 43.7 m-85 -29.94 158.94 0.0 OUTLIER 'General case' 0 CA--C 1.477 -1.853 0 N-CA-C 120.929 3.677 . . . . 0.0 120.929 -174.913 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.468 ' CB ' ' HB2' ' A' ' 12' ' ' GLU 0.338 0.0 OUTLIER -169.46 108.67 0.42 Allowed 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 108.729 -3.85 . . . . 0.0 104.964 -178.86 . . . . . . . . 4 4 . 1 . 023 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.602 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 31.6 ttpt -64.93 73.01 0.04 OUTLIER 'General case' 0 CA--C 1.478 -1.79 0 C-N-CA 117.717 -1.593 . . . . 0.0 113.7 -179.331 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.485 ' CG ' HG21 ' A' ' 8' ' ' THR . 14.9 mttt . . . . . 0 CA--C 1.496 -1.119 0 O-C-N 119.981 -1.699 . . . . 0.0 114.782 179.812 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 N--CA 1.505 2.284 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 95.9 m -158.1 -47.93 0.06 Allowed 'General case' 0 C--O 1.207 -1.175 0 CA-C-O 123.539 1.637 . . . . 0.0 109.41 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.59 -157.04 0.02 OUTLIER 'General case' 0 CA--C 1.493 -1.22 0 C-N-CA 117.573 -1.651 . . . . 0.0 114.604 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.68 -173.73 0.8 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.87 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -122.39 -144.2 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 104.368 -2.456 . . . . 0.0 104.368 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.47 131.72 12.8 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 128.317 2.647 . . . . 0.0 110.713 179.713 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 178.16 -119.43 0.67 Allowed Glycine 0 C--O 1.22 -0.758 0 C-N-CA 115.832 -3.08 . . . . 0.0 115.864 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.446 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -179.75 151.07 0.42 Allowed 'General case' 0 C--O 1.211 -0.926 1 O-C-N 133.457 6.034 . . . . 0.0 105.441 -178.85 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.552 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -145.12 114.14 6.94 Favored 'General case' 0 CA--C 1.495 -1.153 1 O-C-N 129.298 4.124 . . . . 0.0 116.117 -179.446 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.61 95.08 7.67 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 114.846 -2.742 . . . . 0.0 106.94 179.643 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.486 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 32.5 ttm -28.28 -46.54 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 O-C-N 128.351 3.532 . . . . 0.0 107.148 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 93.35 -63.34 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.728 1 O-C-N 129.301 4.125 . . . . 0.0 111.729 179.291 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.98 -178.53 4.93 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 108.901 -3.772 . . . . 0.0 111.416 -179.568 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.475 ' ND2' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -165.5 154.94 12.43 Favored 'General case' 0 C--O 1.2 -1.51 0 O-C-N 126.289 2.243 . . . . 0.0 115.799 179.975 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 16' ' ' ASN . 3.1 tt0 -125.7 145.48 50.16 Favored 'General case' 0 N--CA 1.476 0.854 2 O-C-N 132.825 6.328 . . . . 0.0 110.738 -179.986 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.417 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 53.3 t30 36.82 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.138 0 CA-C-O 124.252 1.977 . . . . 0.0 115.744 -179.713 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -112.43 -39.5 4.37 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 111.636 -2.529 . . . . 0.0 109.562 -179.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -75.17 -35.02 61.62 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.956 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.02 -27.15 58.81 Favored Glycine 0 C--N 1.351 1.379 0 O-C-N 128.909 3.881 . . . . 0.0 107.028 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.31 -29.6 64.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 123.483 1.611 . . . . 0.0 108.576 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.8 mtt -77.76 -25.31 49.06 Favored 'General case' 0 CA--C 1.494 -1.208 0 C-N-CA 116.594 -2.042 . . . . 0.0 111.004 179.901 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -75.5 -27.01 58.6 Favored 'General case' 0 C--O 1.204 -1.304 0 O-C-N 127.799 3.187 . . . . 0.0 115.02 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.447 ' CB ' ' HG3' ' A' ' 125' ' ' GLN . . . -71.48 -44.93 63.82 Favored 'General case' 0 C--O 1.215 -0.718 1 O-C-N 134.461 7.351 . . . . 0.0 112.807 -179.859 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.502 ' CD1' ' HB ' ' A' ' 26' ' ' ILE . 2.6 pp -90.46 -6.05 55.33 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 110.24 -3.164 . . . . 0.0 108.202 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.6 t0 32.12 91.28 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 127.606 3.574 . . . . 0.0 113.01 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.502 ' HB ' ' CD1' ' A' ' 24' ' ' LEU . 9.9 tt -106.03 41.11 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.959 1 CA-C-N 107.472 -4.422 . . . . 0.0 111.17 179.69 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 80.47 134.54 0.06 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 109.887 -3.324 . . . . 0.0 113.323 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -67.59 137.03 55.36 Favored 'General case' 0 CA--C 1.505 -0.751 0 O-C-N 125.626 1.829 . . . . 0.0 111.795 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 73.99 74.29 0.12 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 125.811 2.72 . . . . 0.0 109.155 179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 34.1 m -140.76 40.73 1.84 Allowed 'General case' 0 N--CA 1.478 0.974 1 CA-C-N 106.85 -4.704 . . . . 0.0 110.794 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.79 -170.21 3.47 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 111.231 -2.713 . . . . 0.0 109.329 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.495 ' C ' ' CG1' ' A' ' 33' ' ' ILE . 4.6 tttp 76.38 30.69 0.65 Allowed 'General case' 0 C--N 1.314 -0.96 1 O-C-N 129.498 4.249 . . . . 0.0 112.425 -179.62 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.495 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -162.11 -55.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 2 O-C-N 129.834 4.459 . . . . 0.0 111.539 -179.959 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -87.62 50.3 1.97 Allowed 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 124.887 2.28 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.0 t -71.76 -44.21 68.78 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.578 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.186 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.428 ' C ' ' CD2' ' A' ' 37' ' ' LEU . 0.0 OUTLIER 160.04 132.51 0.0 OUTLIER 'General case' 0 N--CA 1.433 -1.299 1 O-C-N 130.684 4.99 . . . . 0.0 111.664 179.706 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -150.11 117.35 6.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 108.738 -3.847 . . . . 0.0 106.351 -179.981 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.431 ' HB ' ' HB ' ' A' ' 57' ' ' THR . 7.8 m 47.32 46.57 16.93 Favored 'General case' 0 CA--C 1.506 -0.742 1 O-C-N 131.096 5.247 . . . . 0.0 112.755 179.872 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.486 ' HG2' ' CB ' ' A' ' 11' ' ' MET . 0.4 OUTLIER -56.84 123.23 14.32 Favored 'General case' 0 CA--C 1.494 -1.174 0 O-C-N 125.135 1.522 . . . . 0.0 113.555 179.873 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.443 HG21 HG21 ' A' ' 8' ' ' THR . 45.3 m -147.95 67.85 1.1 Allowed 'General case' 0 C--N 1.313 -0.994 1 O-C-N 130.114 4.634 . . . . 0.0 117.457 -179.114 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 55' ' ' ASN . 0.1 OUTLIER -66.47 144.82 56.26 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 115.29 -2.29 . . . . 0.0 104.921 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.536 ' CD1' ' HB ' ' A' ' 54' ' ' THR . 2.6 mt -125.83 166.17 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 1 O-C-N 131.806 5.692 . . . . 0.0 113.263 -177.343 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.532 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.274 0.5 OUTLIER -149.85 143.37 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-N 110.829 -2.896 . . . . 0.0 112.484 179.405 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 41.1 t -111.68 -71.1 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.322 0 CA-C-N 111.799 -2.455 . . . . 0.0 114.445 -179.786 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 60.8 116.5 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 124.099 1.905 . . . . 0.0 113.206 -179.899 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -137.98 -4.12 1.76 Allowed 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 110.365 -3.107 . . . . 0.0 116.326 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.72 114.24 3.39 Favored Glycine 0 CA--C 1.493 -1.343 0 CA-C-N 121.16 1.8 . . . . 0.0 112.2 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 52.46 30.6 8.54 Favored 'General case' 0 C--O 1.212 -0.876 0 O-C-N 125.39 1.288 . . . . 0.0 111.693 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.5 t30 177.79 90.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.504 2.322 . . . . 0.0 109.218 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.414 ' O ' ' CG ' ' A' ' 50' ' ' PHE . 32.9 t80 -103.3 95.4 6.07 Favored 'General case' 0 CA--C 1.482 -1.657 1 O-C-N 130.25 4.719 . . . . 0.0 116.648 -179.551 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -106.9 173.29 6.39 Favored 'General case' 0 C--O 1.197 -1.66 0 C-N-CA 114.899 -2.72 . . . . 0.0 111.438 178.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.443 HG23 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -138.28 136.79 36.82 Favored 'General case' 0 N--CA 1.472 0.647 2 O-C-N 132.542 6.151 . . . . 0.0 104.921 177.592 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.603 ' CE ' ' O ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -156.42 115.38 3.43 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 127.722 3.139 . . . . 0.0 113.887 -176.704 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.566 ' HA ' ' CB ' ' A' ' 60' ' ' ASN . 3.0 m 96.93 147.08 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 130.033 3.333 . . . . 0.0 105.276 177.393 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.563 ' HA ' ' HA ' ' A' ' 41' ' ' LYS . 5.9 p30 -171.76 47.2 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.378 1 O-C-N 129.667 4.354 . . . . 0.0 116.513 -176.832 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 m 148.5 168.46 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 O-C-N 128.867 3.855 . . . . 0.0 107.884 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.431 ' HB ' ' HB ' ' A' ' 38' ' ' THR . 5.1 t -83.1 -36.97 24.42 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 111.853 -2.431 . . . . 0.0 106.204 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.435 ' N ' HD13 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -61.15 -29.83 70.02 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 125.682 1.864 . . . . 0.0 110.622 -179.937 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.505 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.1 OUTLIER -178.2 162.4 1.56 Allowed 'General case' 0 CA--C 1.504 -0.818 1 O-C-N 131.375 5.422 . . . . 0.0 116.392 -179.938 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.566 ' CB ' ' HA ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -138.47 86.58 2.17 Favored 'General case' 0 CA--C 1.503 -0.853 2 O-C-N 130.778 5.049 . . . . 0.0 114.078 -177.546 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -81.53 93.03 6.6 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 127.186 2.804 . . . . 0.0 110.186 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -43.42 148.25 0.33 Allowed 'General case' 0 C--O 1.206 -1.206 1 O-C-N 129.877 4.486 . . . . 0.0 111.406 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.514 ' HG ' ' CD2' ' A' ' 65' ' ' PHE . 4.7 tp -128.9 62.25 1.5 Allowed 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.321 4.138 . . . . 0.0 110.791 179.903 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -79.97 94.24 5.86 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 127.748 3.155 . . . . 0.0 110.363 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.634 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 6.9 m-85 -129.59 137.75 50.89 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 127.103 3.335 . . . . 0.0 109.854 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -125.4 108.8 12.03 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 109.039 -3.71 . . . . 0.0 103.027 179.594 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.516 HG23 ' CD1' ' A' ' 89' ' ' TRP . 12.5 t -41.77 129.79 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.419 1 O-C-N 130.854 5.096 . . . . 0.0 114.716 -179.771 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.18 12.81 69.9 Favored Glycine 0 N--CA 1.48 1.583 1 O-C-N 129.277 4.111 . . . . 0.0 116.287 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.275 1.7 t -73.82 -34.01 39.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.864 -179.792 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 72' ' ' ASP . 27.2 tt0 65.43 73.81 0.39 Allowed 'General case' 0 C--N 1.366 1.306 0 C-N-CA 112.489 -3.685 . . . . 0.0 108.442 -179.374 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.462 ' CB ' HG23 ' A' ' 85' ' ' THR . 0.2 OUTLIER -63.16 77.92 0.02 OUTLIER 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 126.905 3.24 . . . . 0.0 112.569 -179.488 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 70' ' ' GLU . 77.8 m-20 -61.72 78.21 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -179.82 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.492 ' HG2' ' CA ' ' A' ' 83' ' ' VAL . 21.4 mt-10 56.35 108.98 0.01 OUTLIER 'General case' 0 CA--C 1.49 -1.352 1 CA-C-O 129.061 4.267 . . . . 0.0 114.642 179.679 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.62 97.84 0.05 Allowed 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 109.772 -3.376 . . . . 0.0 115.641 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.92 130.8 5.75 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 111.391 -2.641 . . . . 0.0 111.336 -179.932 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.93 148.79 20.95 Favored 'General case' 0 CA--C 1.508 -0.656 0 O-C-N 128.448 3.592 . . . . 0.0 111.899 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.54 -3.99 72.41 Favored Glycine 0 C--O 1.21 -1.369 0 CA-C-N 109.405 -3.543 . . . . 0.0 113.067 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.463 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 0.9 OUTLIER -146.93 19.87 1.27 Allowed 'General case' 0 C--N 1.347 0.494 0 O-C-N 127.868 2.746 . . . . 0.0 116.982 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.7 t0 174.66 -59.5 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.53 0.519 . . . . 0.0 110.96 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.51 72.95 0.97 Allowed Glycine 0 CA--C 1.503 -0.668 0 CA-C-O 126.545 3.303 . . . . 0.0 111.989 -179.797 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.54 -177.63 3.87 Favored 'General case' 0 C--N 1.363 1.194 1 CA-C-N 107.965 -4.118 . . . . 0.0 111.239 179.954 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.472 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.11 82.68 1.2 Allowed 'General case' 0 C--O 1.202 -1.407 0 O-C-N 127.533 3.021 . . . . 0.0 108.145 179.643 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.492 ' CA ' ' HG2' ' A' ' 73' ' ' GLU . 2.3 t -134.19 143.79 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 CA-C-N 111.194 -2.73 . . . . 0.0 117.926 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -50.89 155.3 1.22 Allowed 'General case' 0 N--CA 1.465 0.291 1 O-C-N 130.139 4.649 . . . . 0.0 106.999 179.299 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.462 HG23 ' CB ' ' A' ' 71' ' ' PHE . 1.1 m -158.47 78.46 0.79 Allowed 'General case' 0 C--O 1.194 -1.848 0 CA-C-O 127.764 3.65 . . . . 0.0 111.823 -179.452 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.5 tt -68.9 139.13 55.12 Favored 'General case' 0 N--CA 1.431 -1.381 1 CA-C-N 107.412 -4.449 . . . . 0.0 111.864 -179.953 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 14.8 p -132.73 132.45 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 C-N-CA 126.085 1.754 . . . . 0.0 110.759 179.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -155.21 175.13 14.24 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 126.886 3.231 . . . . 0.0 110.92 179.847 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' TRP . . . . . 0.681 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 42.0 m95 -96.22 144.25 26.6 Favored 'General case' 0 CA--C 1.506 -0.732 0 C-N-CA 127.569 2.347 . . . . 0.0 107.874 180.0 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.433 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 6.6 tp10 -91.98 -45.46 8.32 Favored 'General case' 0 C--O 1.21 -1.016 1 CA-C-O 131.706 5.527 . . . . 0.0 111.324 179.878 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -178.95 -49.21 0.08 OUTLIER Glycine 0 C--N 1.359 1.85 1 CA-C-N 105.586 -5.279 . . . . 0.0 105.405 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.64 30.42 1.7 Allowed 'General case' 0 C--O 1.212 -0.9 1 O-C-N 131.678 4.987 . . . . 0.0 111.225 179.912 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.411 ' O ' ' N ' ' A' ' 90' ' ' GLU . 2.6 t -161.54 154.05 20.16 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -179.964 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.497 ' HB3' ' CG ' ' A' ' 109' ' ' GLN . 2.0 tp -89.61 88.14 7.3 Favored 'General case' 0 CA--C 1.486 -1.496 0 O-C-N 129.048 3.968 . . . . 0.0 118.101 179.742 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.433 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.359 40.9 t -86.29 114.97 26.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.251 0 CA-C-N 110.403 -3.09 . . . . 0.0 112.556 179.681 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.402 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -138.55 137.4 37.0 Favored 'General case' 0 C--O 1.2 -1.532 0 CA-C-O 122.227 1.013 . . . . 0.0 108.362 -179.491 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.6 t -122.92 137.28 56.92 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 179.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.455 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -94.06 94.21 8.28 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 125.369 2.509 . . . . 0.0 107.921 179.399 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -91.19 128.73 37.12 Favored 'General case' 0 C--O 1.201 -1.467 1 CA-C-N 107.501 -4.409 . . . . 0.0 113.236 -179.9 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 102' ' ' LYS . . . 157.4 171.26 23.2 Favored Glycine 0 C--O 1.203 -1.836 0 CA-C-N 112.964 -1.925 . . . . 0.0 108.538 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 14.09 -70.23 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.959 2 O-C-N 130.254 4.149 . . . . 0.0 114.414 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -153.1 -43.01 0.1 Allowed 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 127.37 2.268 . . . . 0.0 115.028 179.636 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.496 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 2.8 mp0 -35.91 105.96 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.221 3.045 . . . . 0.0 119.221 -179.527 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.419 ' O ' ' N ' ' A' ' 122' ' ' CYS . 5.9 m120 -94.52 71.57 3.68 Favored 'General case' 0 N--CA 1.492 1.671 3 CA-C-N 106.96 -4.655 . . . . 0.0 99.436 177.415 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.405 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 14.5 tpt85 -107.17 12.64 28.16 Favored 'General case' 0 C--N 1.31 -1.136 1 O-C-N 134.314 7.259 . . . . 0.0 111.623 -176.908 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.455 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -75.52 141.71 28.02 Favored Glycine 0 C--O 1.203 -1.783 2 O-C-N 130.98 5.175 . . . . 0.0 111.42 179.949 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . 0.634 ' CH2' ' CE2' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -123.93 145.47 49.12 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 129.832 3.901 . . . . 0.0 111.112 179.532 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 6.4 ptpp? -156.11 172.58 18.18 Favored 'General case' 0 C--O 1.202 -1.411 0 O-C-N 128.283 3.489 . . . . 0.0 111.975 -179.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.497 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -133.54 175.47 9.39 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 110.279 -3.146 . . . . 0.0 109.565 -179.627 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.506 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -172.27 84.29 0.07 Allowed 'General case' 0 CA--C 1.502 -0.891 1 O-C-N 130.05 4.594 . . . . 0.0 115.208 179.73 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.5 t -37.32 90.8 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.83 0 CA-C-O 124.654 2.168 . . . . 0.0 111.859 179.399 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -91.87 47.49 1.35 Allowed 'General case' 0 CA--C 1.486 -1.492 0 CA-C-N 110.079 -3.237 . . . . 0.0 116.662 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.23 -103.36 1.22 Allowed Glycine 0 C--O 1.212 -1.239 0 O-C-N 121.034 -1.041 . . . . 0.0 115.483 179.752 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -100.08 -8.09 24.16 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -135.21 177.84 7.5 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 128.898 3.874 . . . . 0.0 108.345 179.884 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.12 117.99 13.28 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 126.734 2.521 . . . . 0.0 113.146 179.723 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.506 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.3 m-85 -71.06 151.36 44.62 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 111.514 -2.584 . . . . 0.0 114.432 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -121.18 52.53 1.2 Allowed 'General case' 0 CA--C 1.5 -0.946 2 O-C-N 131.729 5.643 . . . . 0.0 108.733 -179.991 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.91 146.29 32.62 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 127.876 2.47 . . . . 0.0 108.43 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -156.5 162.14 39.97 Favored 'General case' 0 CA--C 1.486 -1.517 0 O-C-N 126.263 2.227 . . . . 0.0 111.231 -179.755 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.2 m -118.15 162.98 17.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 127.52 3.012 . . . . 0.0 105.134 -179.661 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.419 ' N ' ' O ' ' A' ' 104' ' ' ASN . 0.6 OUTLIER -166.32 47.72 0.07 Allowed 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 126.245 2.926 . . . . 0.0 110.918 179.52 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.19 61.48 2.64 Favored Glycine 0 C--O 1.238 0.38 0 CA-C-N 110.269 -3.15 . . . . 0.0 110.952 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 66.36 41.83 3.19 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 128.112 2.89 . . . . 0.0 111.774 179.69 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.447 ' HG3' ' CB ' ' A' ' 23' ' ' ALA . 5.4 mm-40 -131.58 31.53 4.28 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.569 3.043 . . . . 0.0 104.586 179.828 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 9.7 p -22.44 75.32 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 O-C-N 127.739 3.149 . . . . 0.0 114.764 179.819 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 13.1 t -68.31 139.77 55.92 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 119.51 -1.994 . . . . 0.0 111.19 -179.847 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.28 147.5 44.21 Favored 'General case' 0 N--CA 1.47 0.542 1 O-C-N 129.266 4.104 . . . . 0.0 110.667 179.657 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -132.48 178.87 6.5 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 128.267 3.479 . . . . 0.0 110.92 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.27 141.52 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 103.282 -2.858 . . . . 0.0 103.282 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.5 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 42.6 m-85 -127.18 171.04 11.78 Favored 'General case' 0 CA--C 1.486 -1.511 0 O-C-N 128.399 3.562 . . . . 0.0 114.861 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.404 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.322 0.1 OUTLIER -157.27 117.97 3.56 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 112.723 -3.513 . . . . 0.0 103.296 179.997 . . . . . . . . 4 4 . 1 . 024 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.545 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 10.9 pttt -52.94 130.61 34.05 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 130.292 4.745 . . . . 0.0 110.268 179.373 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.799 0 O-C-N 126.212 2.195 . . . . 0.0 115.902 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.508 -0.636 0 N-CA-C 117.851 2.537 . . . . 0.0 117.851 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -157.75 76.66 0.81 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -108.43 12.25 26.37 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 116.031 -1.938 . . . . 0.0 107.607 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -9.52 119.09 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.954 1 O-C-N 132.835 6.334 . . . . 0.0 115.382 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.494 ' O ' HG23 ' A' ' 8' ' ' THR . . . -170.26 -135.12 1.85 Allowed Glycine 0 C--O 1.21 -1.386 0 CA-C-O 116.693 -2.17 . . . . 0.0 110.259 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.494 HG23 ' O ' ' A' ' 7' ' ' GLY . 1.3 p -155.56 163.75 39.56 Favored 'General case' 0 C--O 1.208 -1.093 1 O-C-N 132.168 5.275 . . . . 0.0 107.201 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.514 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.254 0.0 OUTLIER -156.92 101.59 1.95 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 128.063 3.352 . . . . 0.0 111.391 179.965 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -56.48 -18.25 10.85 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.422 ' HG3' ' CE2' ' A' ' 131' ' ' PHE . 27.7 ttm 68.28 84.98 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 103.364 -2.828 . . . . 0.0 103.364 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.01 -29.67 0.62 Allowed 'General case' 0 C--N 1.312 -1.029 0 O-C-N 128.802 3.814 . . . . 0.0 111.698 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.265 1.5 m -176.15 162.9 2.55 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-N 113.718 -1.583 . . . . 0.0 112.052 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -128.96 121.25 27.61 Favored 'General case' 0 CA--C 1.501 -0.94 0 CA-C-N 111.194 -2.73 . . . . 0.0 114.354 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -70.74 -63.45 1.09 Allowed 'General case' 0 CA--C 1.491 -1.325 1 O-C-N 129.654 4.346 . . . . 0.0 109.288 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -115.13 135.21 54.44 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -128.44 -56.42 1.23 Allowed 'General case' 0 CA--C 1.495 -1.173 0 CA-C-O 124.183 1.944 . . . . 0.0 110.936 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.578 ' HB2' ' CB ' ' A' ' 31' ' ' ARG . 5.3 tp10 -76.71 -37.02 56.81 Favored 'General case' 0 CA--C 1.499 -0.992 0 O-C-N 120.391 -1.443 . . . . 0.0 113.204 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.522 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.15 -25.01 46.03 Favored Glycine 0 CA--C 1.5 -0.882 0 O-C-N 128.537 3.648 . . . . 0.0 112.609 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -75.0 -37.79 61.76 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 119.136 1.468 . . . . 0.0 107.934 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 mtm -77.23 -20.95 54.54 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 112.368 -2.196 . . . . 0.0 107.628 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.522 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 3.0 ttmt -75.09 -38.42 61.23 Favored 'General case' 0 C--O 1.199 -1.572 0 C-N-CA 128.845 2.858 . . . . 0.0 114.595 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.0 -36.39 83.41 Favored 'General case' 0 C--O 1.203 -1.379 1 O-C-N 130.971 5.169 . . . . 0.0 114.163 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.69 HD11 ' HB ' ' A' ' 26' ' ' ILE . 3.7 pp -94.58 -2.48 51.41 Favored 'General case' 0 C--O 1.215 -0.763 1 O-C-N 129.364 4.165 . . . . 0.0 107.969 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.7 t0 45.7 79.53 0.05 Allowed 'General case' 0 CA--C 1.483 -1.631 0 CA-C-O 128.159 3.838 . . . . 0.0 111.093 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.69 ' HB ' HD11 ' A' ' 24' ' ' LEU . 15.6 tt -84.0 -50.15 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.685 0 CA-C-N 109.452 -3.522 . . . . 0.0 108.274 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.452 ' N ' HG23 ' A' ' 26' ' ' ILE . 3.8 t0 -175.94 26.23 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 115.016 -2.421 . . . . 0.0 112.678 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 31.79 37.47 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.303 0 O-C-N 126.308 2.255 . . . . 0.0 117.039 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.0 172.82 17.48 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 112.363 -2.199 . . . . 0.0 106.729 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.287 0.6 OUTLIER 97.71 -7.01 0.06 Allowed 'General case' 0 N--CA 1.484 1.235 1 O-C-N 131.126 5.266 . . . . 0.0 112.667 -179.749 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.578 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -75.51 -16.82 60.25 Favored 'General case' 0 C--O 1.238 0.451 1 O-C-N 131.594 5.559 . . . . 0.0 107.524 179.475 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.8 -11.85 17.31 Favored 'General case' 0 C--O 1.213 -0.854 0 O-C-N 127.534 3.021 . . . . 0.0 111.476 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.3 mp -116.1 -53.36 4.55 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.194 1 O-C-N 130.349 4.781 . . . . 0.0 114.121 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.432 ' HB1' ' CE2' ' A' ' 58' ' ' PHE . . . -67.78 -10.38 52.26 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.9 t -15.82 -48.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.557 0 N-CA-C 116.866 2.173 . . . . 0.0 116.866 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.664 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.1 OUTLIER 162.2 115.38 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.604 2 O-C-N 129.814 4.446 . . . . 0.0 115.311 179.762 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.664 HD23 ' C ' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -142.42 68.79 1.31 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 110.825 -2.898 . . . . 0.0 106.906 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.4 m 93.49 -17.96 0.11 Allowed 'General case' 0 C--O 1.24 0.557 0 O-C-N 128.357 3.535 . . . . 0.0 117.42 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -12.7 89.16 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.007 0 O-C-N 127.678 3.111 . . . . 0.0 117.695 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -111.21 102.16 10.61 Favored 'General case' 0 N--CA 1.434 -1.273 1 O-C-N 132.169 5.918 . . . . 0.0 111.815 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.476 ' CD ' ' CD1' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -75.18 141.98 43.55 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 128.196 3.435 . . . . 0.0 107.425 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.534 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.7 mt -140.01 160.17 26.39 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 CA-C-O 123.291 1.519 . . . . 0.0 111.779 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.534 ' N ' HG22 ' A' ' 42' ' ' ILE 0.316 9.1 tt -132.3 142.99 41.28 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.476 0 CA-C-N 110.989 -2.823 . . . . 0.0 107.652 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.676 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.1 t -115.98 -68.16 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 CA-C-N 113.888 -1.506 . . . . 0.0 114.661 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.676 ' N ' HG12 ' A' ' 44' ' ' VAL . 2.1 mt-30 69.12 133.19 0.03 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 O-C-N 124.832 1.332 . . . . 0.0 113.317 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -132.58 -24.51 1.99 Allowed 'General case' 0 C--N 1.359 0.98 1 O-C-N 130.213 4.696 . . . . 0.0 117.124 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.11 -69.85 0.4 Allowed Glycine 0 C--O 1.218 -0.905 0 CA-C-O 122.958 1.31 . . . . 0.0 111.243 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -102.61 -8.25 21.11 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-N 111.227 -2.487 . . . . 0.0 112.037 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -118.48 177.77 4.7 Favored 'General case' 0 C--N 1.354 0.793 0 CA-C-O 114.45 -2.69 . . . . 0.0 111.316 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.744 ' CD2' HD22 ' A' ' 94' ' ' LEU . 5.9 t80 -172.22 113.68 0.31 Allowed 'General case' 0 C--N 1.313 -1.01 1 O-C-N 132.062 5.851 . . . . 0.0 115.828 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.448 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -133.72 79.92 1.85 Allowed 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 118.594 2.813 . . . . 0.0 118.594 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 43' ' ' ILE . 0.7 OUTLIER -60.41 149.71 33.16 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 112.458 -2.155 . . . . 0.0 107.153 179.712 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -146.06 162.6 37.53 Favored 'General case' 0 CA--C 1.49 -1.365 0 O-C-N 127.259 2.849 . . . . 0.0 111.516 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.02 123.03 49.36 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 127.602 3.064 . . . . 0.0 107.647 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.441 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -91.68 29.35 1.55 Allowed 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.511 ' HB3' ' CD1' ' A' ' 58' ' ' PHE . 0.6 OUTLIER -53.08 157.74 1.7 Allowed 'General case' 0 C--O 1.209 -1.051 0 O-C-N 128.853 3.845 . . . . 0.0 105.792 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.411 ' HB ' HD12 ' A' ' 37' ' ' LEU . 46.2 m -84.54 -7.6 59.21 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 109.212 -3.631 . . . . 0.0 109.163 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.584 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -101.75 -39.12 7.57 Favored 'General case' 0 C--N 1.366 1.296 0 CA-C-O 125.095 2.379 . . . . 0.0 110.466 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.79 149.56 27.55 Favored 'General case' 0 C--N 1.361 1.083 1 CA-C-N 107.794 -4.276 . . . . 0.0 117.93 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 79.71 1.62 Allowed 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 109.185 -3.643 . . . . 0.0 109.295 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -170.95 71.49 0.05 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 108.932 -3.758 . . . . 0.0 107.477 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.443 ' HB3' ' HA ' ' A' ' 53' ' ' LYS . 2.8 t0 -106.57 -127.13 0.25 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.6 2.438 . . . . 0.0 115.648 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.741 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -56.07 101.52 0.06 Allowed 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.368 -179.873 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -132.2 88.91 2.6 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 127.086 2.741 . . . . 0.0 112.369 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.576 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -166.52 179.62 5.41 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 124.088 1.899 . . . . 0.0 112.785 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.59 152.23 30.6 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.808 HG21 ' CD1' ' A' ' 89' ' ' TRP . 0.3 OUTLIER -71.76 144.01 13.68 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.866 0 O-C-N 128.915 3.884 . . . . 0.0 115.202 -179.744 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.71 7.54 22.24 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 128.607 3.692 . . . . 0.0 116.936 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 1.1 t -72.84 -26.46 23.49 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.575 0 O-C-N 125.312 1.242 . . . . 0.0 109.136 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 65.68 89.86 0.09 Allowed 'General case' 0 C--O 1.212 -0.896 2 O-C-N 131.028 5.205 . . . . 0.0 109.383 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 3.4 t80 -74.89 67.35 1.65 Allowed 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 127.265 2.853 . . . . 0.0 112.258 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -50.01 79.12 0.0 OUTLIER 'General case' 0 CA--C 1.484 -1.591 0 CA-C-N 113.593 -1.64 . . . . 0.0 113.625 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.47 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 11.1 mt-10 52.89 -165.76 0.07 Allowed 'General case' 0 C--O 1.212 -0.89 0 C-N-CA 125.311 1.444 . . . . 0.0 111.848 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.5 t60 72.49 78.8 0.15 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 125.449 2.547 . . . . 0.0 115.843 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.41 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -122.82 170.28 10.25 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 111.925 -2.398 . . . . 0.0 112.945 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.41 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.15 138.22 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 O-C-N 128.34 3.525 . . . . 0.0 113.68 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 125.94 -17.41 6.76 Favored Glycine 0 C--O 1.213 -1.181 0 CA-C-N 112.165 -2.288 . . . . 0.0 110.067 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.482 ' O ' HD12 ' A' ' 26' ' ' ILE . 3.7 tp -122.75 -67.85 0.92 Allowed 'General case' 0 N--CA 1.469 0.503 2 CA-C-N 106.734 -4.733 . . . . 0.0 112.869 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.486 ' HA ' HD13 ' A' ' 24' ' ' LEU . 2.3 t70 -104.51 -72.62 0.7 Allowed 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.2 76.2 1.18 Allowed Glycine 0 C--O 1.217 -0.96 0 CA-C-O 124.676 2.265 . . . . 0.0 111.439 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.452 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 11.6 tpp180 -150.22 -117.77 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.228 1 CA-C-N 107.195 -4.503 . . . . 0.0 113.112 179.682 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.47 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.3 OUTLIER -172.57 97.37 0.14 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.828 1.194 . . . . 0.0 112.256 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 87.8 t -135.77 126.91 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 N-CA-C 117.959 2.577 . . . . 0.0 117.959 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.456 ' CB ' ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -51.8 122.25 7.93 Favored 'General case' 0 C--O 1.218 -0.601 0 O-C-N 128.782 3.801 . . . . 0.0 106.837 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.561 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 21.5 m -133.33 83.27 2.04 Favored 'General case' 0 C--O 1.196 -1.735 0 O-C-N 128.417 3.573 . . . . 0.0 112.952 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.451 ' HG ' ' N ' ' A' ' 87' ' ' VAL . 1.1 tp -82.73 138.66 33.98 Favored 'General case' 0 N--CA 1.438 -1.047 1 CA-C-N 107.033 -4.621 . . . . 0.0 111.595 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.545 HG12 HG23 ' A' ' 67' ' ' VAL . 97.3 t -123.31 140.22 47.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 124.888 1.275 . . . . 0.0 110.602 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.9 m -154.68 152.08 29.52 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 112.647 -2.069 . . . . 0.0 110.625 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.808 ' CD1' HG21 ' A' ' 67' ' ' VAL . 38.8 m95 -89.9 139.23 30.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 129.082 2.953 . . . . 0.0 106.847 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.452 ' CB ' HG22 ' A' ' 93' ' ' THR . 0.4 OUTLIER -91.29 -16.18 27.94 Favored 'General case' 0 CA--C 1.478 -1.811 1 CA-C-O 130.146 4.784 . . . . 0.0 114.925 179.893 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.68 -30.88 3.5 Favored Glycine 0 C--N 1.362 1.98 1 CA-C-N 107.542 -4.39 . . . . 0.0 103.411 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -156.16 91.0 1.23 Allowed 'General case' 0 N--CA 1.428 -1.569 1 O-C-N 132.906 5.709 . . . . 0.0 106.296 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.452 HG22 ' CB ' ' A' ' 90' ' ' GLU . 1.2 t 116.59 160.47 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 128.852 2.861 . . . . 0.0 118.029 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.744 HD22 ' CD2' ' A' ' 50' ' ' PHE . 6.1 tp -102.81 99.07 8.99 Favored 'General case' 0 CA--C 1.49 -1.339 0 CA-C-O 125.216 2.436 . . . . 0.0 117.326 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.462 HG13 ' NZ ' ' A' ' 108' ' ' LYS 0.357 66.9 t -92.66 121.55 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 114.83 -2.509 . . . . 0.0 112.547 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -136.39 140.9 43.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 124.189 1.947 . . . . 0.0 109.387 -179.445 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.4 t -107.83 102.94 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.967 0 CA-C-N 109.267 -3.606 . . . . 0.0 118.08 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.489 ' HG3' ' C ' ' A' ' 105' ' ' ARG . 5.0 mm100 -83.09 86.34 7.03 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.128 -1.608 . . . . 0.0 107.959 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.456 ' HB3' ' CB ' ' A' ' 84' ' ' LYS . 0.6 OUTLIER -76.16 100.25 4.95 Favored 'General case' 0 C--O 1.2 -1.526 0 CA-C-N 109.498 -3.501 . . . . 0.0 107.769 -179.321 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -98.68 177.47 30.59 Favored Glycine 0 C--O 1.214 -1.1 0 O-C-N 127.597 3.061 . . . . 0.0 112.271 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -107.96 -39.91 5.39 Favored 'General case' 0 CA--C 1.494 -1.2 1 CA-C-N 106.675 -4.762 . . . . 0.0 111.989 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.43 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -117.06 -41.85 2.98 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 125.067 2.365 . . . . 0.0 115.433 179.68 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' A' ' 105' ' ' ARG . 2.0 pp20? -113.78 167.24 10.79 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 126.582 3.087 . . . . 0.0 112.561 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -126.65 90.11 3.11 Favored 'General case' 0 N--CA 1.489 1.514 1 CA-C-N 107.346 -4.479 . . . . 0.0 102.415 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.489 ' C ' ' HG3' ' A' ' 98' ' ' GLN . 5.8 mmm180 -79.74 -7.76 58.82 Favored 'General case' 0 C--N 1.317 -0.806 1 O-C-N 129.448 4.218 . . . . 0.0 113.011 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.493 ' O ' HG22 ' A' ' 121' ' ' THR . . . -22.51 98.59 0.01 OUTLIER Glycine 0 N--CA 1.442 -0.936 1 O-C-N 133.71 6.881 . . . . 0.0 112.333 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.741 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.333 0.0 OUTLIER -116.79 125.27 51.35 Favored 'General case' 0 C--O 1.219 -0.536 1 O-C-N 132.415 5.42 . . . . 0.0 111.34 -179.197 . . . . . . . . 5 4 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.479 ' HB2' ' CZ3' ' A' ' 110' ' ' TRP . 0.1 OUTLIER -151.19 153.61 35.28 Favored 'General case' 0 CA--C 1.507 -0.707 0 O-C-N 128.552 3.657 . . . . 0.0 116.318 -178.518 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.789 ' HG2' HD22 ' A' ' 118' ' ' LEU . 0.1 OUTLIER -116.53 167.51 10.99 Favored 'General case' 0 C--N 1.36 1.055 0 CA-C-N 109.725 -3.398 . . . . 0.0 110.248 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.479 ' CZ3' ' HB2' ' A' ' 108' ' ' LYS . 0.5 OUTLIER -177.36 99.34 0.05 OUTLIER 'General case' 0 C--O 1.211 -0.929 0 O-C-N 128.309 3.505 . . . . 0.0 114.87 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.0 t -47.23 97.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.825 0 CA-C-O 124.948 2.308 . . . . 0.0 112.988 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.475 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 9.2 mm-40 -94.21 50.91 1.42 Allowed 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 109.09 -3.687 . . . . 0.0 112.604 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.19 -130.14 9.14 Favored Glycine 0 C--O 1.201 -1.934 0 O-C-N 119.465 -2.022 . . . . 0.0 113.057 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -90.77 16.26 9.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 127.405 2.282 . . . . 0.0 117.093 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -142.97 -176.52 4.94 Favored 'General case' 0 C--O 1.223 -0.303 0 O-C-N 128.529 3.643 . . . . 0.0 108.305 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.452 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -140.75 108.17 5.56 Favored 'General case' 0 CA--C 1.485 -1.54 1 O-C-N 130.283 4.739 . . . . 0.0 117.598 -179.904 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.755 ' O ' HD23 ' A' ' 118' ' ' LEU . 17.4 m-30 -72.36 142.72 48.76 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 111.23 -2.714 . . . . 0.0 116.809 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.789 HD22 ' HG2' ' A' ' 109' ' ' GLN . 3.1 mt -130.48 86.37 2.38 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 109.141 -3.663 . . . . 0.0 107.542 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -96.98 92.41 6.07 Favored 'General case' 0 CA--C 1.495 -1.164 0 C-N-CA 128.278 2.631 . . . . 0.0 111.829 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.456 ' CD2' ' HB3' ' A' ' 127' ' ' CYS . 0.3 OUTLIER -110.64 -177.07 3.13 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 128.119 3.387 . . . . 0.0 108.645 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 106' ' ' GLY . 9.2 t -150.44 178.32 9.16 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.978 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.5 p -173.09 60.23 0.02 OUTLIER 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 126.066 2.841 . . . . 0.0 113.078 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.97 -74.77 1.09 Allowed Glycine 0 CA--C 1.521 0.439 0 CA-C-N 111.166 -2.743 . . . . 0.0 112.79 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.91 -50.47 3.05 Favored 'General case' 0 CA--C 1.493 -1.214 0 O-C-N 126.19 1.759 . . . . 0.0 110.966 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.28 174.94 1.06 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 128.466 3.604 . . . . 0.0 109.815 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.459 HG13 ' O ' ' A' ' 126' ' ' VAL . 3.6 p -153.81 88.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 CA-C-N 109.425 -3.534 . . . . 0.0 111.007 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.456 ' HB3' ' CD2' ' A' ' 120' ' ' LEU . 52.0 t -73.35 118.53 16.41 Favored 'General case' 0 CA--C 1.49 -1.349 0 CA-C-N 112.161 -2.29 . . . . 0.0 112.203 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -106.1 135.5 47.45 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 114.524 -2.655 . . . . 0.0 110.46 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -126.34 154.31 43.69 Favored 'General case' 0 CA--C 1.488 -1.422 1 O-C-N 129.671 4.357 . . . . 0.0 116.159 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.22 136.21 53.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.523 ' N ' ' CD1' ' A' ' 131' ' ' PHE . 52.4 m-85 -126.47 -179.43 4.76 Favored 'General case' 0 CA--C 1.477 -1.853 0 CA-C-N 111.709 -2.496 . . . . 0.0 113.916 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.483 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.318 0.0 OUTLIER -157.69 45.86 0.36 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 112.369 -3.681 . . . . 0.0 108.825 -179.759 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.509 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 35.6 ttpt 15.18 102.2 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.933 1 O-C-N 130.186 4.679 . . . . 0.0 118.294 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt . . . . . 0 CA--C 1.494 -1.189 0 CA-C-O 114.383 -2.722 . . . . 0.0 112.02 -179.581 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.455 ' HG2' ' CH2' ' A' ' 89' ' ' TRP . 0.6 OUTLIER . . . . . 0 N--CA 1.446 -0.633 0 N-CA-C 118.583 2.809 . . . . 0.0 118.583 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.28 105.27 0.07 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 125.898 1.679 . . . . 0.0 109.602 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -116.43 -143.57 0.38 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 112.743 -3.503 . . . . 0.0 102.073 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.9 m120 125.42 122.45 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 1 O-C-N 131.026 5.204 . . . . 0.0 115.337 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.02 -169.96 33.16 Favored Glycine 0 C--O 1.204 -1.722 0 CA-C-N 112.108 -2.315 . . . . 0.0 111.885 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.526 HG23 HG23 ' A' ' 40' ' ' THR . 0.3 OUTLIER -119.01 152.11 37.0 Favored 'General case' 0 C--O 1.202 -1.412 1 O-C-N 132.15 5.265 . . . . 0.0 104.216 179.735 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.563 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -149.11 108.05 3.88 Favored 'General case' 0 CA--C 1.486 -1.506 1 O-C-N 132.426 6.079 . . . . 0.0 112.517 -179.976 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -76.52 100.73 5.37 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 116.213 -2.195 . . . . 0.0 108.156 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.452 ' HB3' ' CD ' ' A' ' 39' ' ' GLN . 4.9 ttm -32.53 -42.42 0.07 Allowed 'General case' 0 N--CA 1.474 0.759 0 O-C-N 127.409 2.943 . . . . 0.0 108.78 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 85.25 -55.84 0.09 Allowed 'General case' 0 CA--C 1.51 -0.569 1 O-C-N 131.461 5.475 . . . . 0.0 112.224 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -157.44 -175.67 5.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 124.815 2.245 . . . . 0.0 111.419 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -155.26 168.0 28.51 Favored 'General case' 0 CA--C 1.483 -1.617 0 CA-C-N 111.513 -2.585 . . . . 0.0 114.109 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -89.9 -80.61 0.31 Allowed 'General case' 0 CA--C 1.503 -0.859 0 O-C-N 128.781 3.801 . . . . 0.0 110.01 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -114.14 126.84 55.53 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 123.216 1.484 . . . . 0.0 112.31 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.64 ' CZ ' HG22 ' A' ' 35' ' ' VAL . 5.7 p90 -109.74 -44.81 3.76 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-O 124.095 1.902 . . . . 0.0 107.883 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.438 ' HG3' ' CB ' ' A' ' 31' ' ' ARG . 5.2 tt0 -66.8 -37.22 84.12 Favored 'General case' 0 C--O 1.215 -0.721 0 O-C-N 120.685 -1.259 . . . . 0.0 113.732 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.18 -33.01 81.67 Favored Glycine 0 N--CA 1.475 1.24 1 O-C-N 129.36 4.163 . . . . 0.0 109.73 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.525 ' CE1' HD21 ' A' ' 24' ' ' LEU . 0.9 OUTLIER -73.69 -44.18 57.29 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-O 124.878 2.275 . . . . 0.0 107.447 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.673 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -61.28 -23.47 65.7 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 124.389 2.042 . . . . 0.0 113.282 -179.692 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -76.58 -27.3 55.77 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 108.441 -3.982 . . . . 0.0 112.684 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.26 -42.24 79.92 Favored 'General case' 0 N--CA 1.477 0.915 1 O-C-N 129.883 4.489 . . . . 0.0 111.679 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.721 HD22 ' NE ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -84.73 -16.33 42.04 Favored 'General case' 0 N--CA 1.483 1.184 1 O-C-N 130.194 4.684 . . . . 0.0 103.966 -179.698 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.4 t0 55.33 84.0 0.08 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 128.561 3.663 . . . . 0.0 110.587 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.673 HG22 ' O ' ' A' ' 21' ' ' MET . 20.2 tt -124.39 53.59 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 1 CA-C-N 107.988 -4.187 . . . . 0.0 107.237 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.55 -171.74 0.85 Allowed 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 113.239 -1.8 . . . . 0.0 113.584 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.444 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.5 m-85 65.75 46.92 2.22 Favored 'General case' 0 CA--C 1.501 -0.924 0 O-C-N 126.288 2.242 . . . . 0.0 116.518 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 88.86 163.04 0.06 Allowed 'General case' 0 C--O 1.2 -1.506 0 O-C-N 127.387 2.929 . . . . 0.0 107.858 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 t 122.38 -31.64 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.016 2 O-C-N 133.214 6.571 . . . . 0.0 109.142 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.438 ' CB ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -105.56 163.96 12.26 Favored 'General case' 0 C--O 1.243 0.725 1 O-C-N 132.357 6.036 . . . . 0.0 108.103 179.34 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 mttt 82.68 10.02 0.65 Allowed 'General case' 0 C--O 1.2 -1.53 0 O-C-N 127.63 3.081 . . . . 0.0 109.922 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.8 mp -145.36 -57.81 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.58 2 O-C-N 132.009 5.818 . . . . 0.0 107.357 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.486 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -82.92 62.15 6.33 Favored 'General case' 0 C--O 1.203 -1.377 0 CA-C-N 112.235 -2.257 . . . . 0.0 113.797 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.64 HG22 ' CZ ' ' A' ' 17' ' ' PHE . 3.2 t -83.81 -45.48 18.38 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.322 0 CA-C-N 111.032 -2.804 . . . . 0.0 109.589 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.447 ' CD ' ' HB2' ' A' ' 39' ' ' GLN . 1.0 OUTLIER 168.0 113.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.664 2 O-C-N 131.416 5.448 . . . . 0.0 109.475 179.793 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.689 HD12 ' N ' ' A' ' 38' ' ' THR . 0.4 OUTLIER -90.11 -9.08 49.7 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 127.496 2.997 . . . . 0.0 111.449 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.689 ' N ' HD12 ' A' ' 37' ' ' LEU . 0.8 OUTLIER 164.31 -65.19 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.135 0 O-C-N 128.158 3.411 . . . . 0.0 112.289 179.886 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.647 ' N ' HG22 ' A' ' 38' ' ' THR . 14.0 tm0? 66.58 146.5 0.04 OUTLIER 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.526 HG23 HG23 ' A' ' 8' ' ' THR . 20.1 m -162.01 104.77 1.17 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 130.837 3.655 . . . . 0.0 112.004 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.482 ' HZ3' ' HG ' ' A' ' 116' ' ' LEU . 0.8 OUTLIER -86.98 146.37 26.16 Favored 'General case' 0 N--CA 1.488 1.425 1 O-C-N 129.662 4.351 . . . . 0.0 109.054 -179.433 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.566 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.0 mt -134.84 154.91 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-N 114.506 -1.225 . . . . 0.0 110.574 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.568 HG13 ' CE1' ' A' ' 50' ' ' PHE . 13.7 tt -130.27 124.75 58.41 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 O-C-N 128.37 3.544 . . . . 0.0 107.463 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.2 t -98.36 -32.54 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.173 0 CA-C-N 113.303 -1.771 . . . . 0.0 111.501 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 8.16 91.03 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.02 0 O-C-N 127.38 2.925 . . . . 0.0 118.111 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.82 -35.05 15.03 Favored 'General case' 0 CA--C 1.477 -1.84 2 CA-C-N 106.678 -4.783 . . . . 0.0 114.857 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.17 -111.81 0.5 Allowed Glycine 0 C--O 1.204 -1.774 0 O-C-N 120.457 -1.402 . . . . 0.0 112.493 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -52.51 -28.11 19.2 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 125.964 1.626 . . . . 0.0 111.854 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -117.46 138.75 51.65 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 128.487 2.715 . . . . 0.0 109.279 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.621 ' CE2' HD22 ' A' ' 94' ' ' LEU . 1.7 t80 -149.73 113.54 5.07 Favored 'General case' 0 CA--C 1.483 -1.631 0 O-C-N 127.501 3.001 . . . . 0.0 113.014 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.4 mttm -119.19 82.81 1.93 Allowed 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.416 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -58.8 133.16 55.73 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 128.491 3.62 . . . . 0.0 106.719 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 62' ' ' ASP . 0.5 OUTLIER -144.43 154.3 42.81 Favored 'General case' 0 CA--C 1.488 -1.427 0 C-N-CA 115.087 -2.645 . . . . 0.0 111.453 -179.509 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 59' ' ' ARG . 0.9 OUTLIER -102.77 155.38 18.36 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 127.57 3.044 . . . . 0.0 111.658 -179.573 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -138.09 49.27 1.95 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.985 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -88.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 1 O-C-N 130.971 5.169 . . . . 0.0 107.93 179.796 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 155.88 -33.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.18 1 O-C-N 131.577 5.548 . . . . 0.0 104.313 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.486 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 8.6 m-85 -69.03 -49.37 58.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 125.955 2.035 . . . . 0.0 108.098 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.459 ' O ' HG22 ' A' ' 54' ' ' THR . 0.2 OUTLIER -155.23 120.18 4.85 Favored 'General case' 0 C--N 1.364 1.227 2 CA-C-N 106.869 -4.696 . . . . 0.0 112.845 179.378 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 m-20 -104.85 21.94 16.08 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 111.232 -2.713 . . . . 0.0 111.724 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -117.29 98.52 6.48 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 128.586 3.679 . . . . 0.0 109.622 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.465 ' HB2' ' HA ' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -108.95 -79.7 0.58 Allowed 'General case' 0 C--O 1.205 -1.25 1 O-C-N 129.298 4.124 . . . . 0.0 113.361 -179.994 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.586 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 1.1 tp -125.54 119.53 28.4 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -144.75 88.85 1.93 Allowed 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.568 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -150.12 -163.61 1.82 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 123.451 1.595 . . . . 0.0 110.23 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -145.59 152.24 39.38 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.415 HG21 ' CD1' ' A' ' 89' ' ' TRP . 3.1 t -61.55 130.94 26.35 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.586 0 C-N-CA 116.724 -1.991 . . . . 0.0 113.544 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.14 -0.73 89.33 Favored Glycine 0 N--CA 1.486 1.998 0 CA-C-N 110.763 -2.926 . . . . 0.0 116.461 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.579 HG12 ' N ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -49.85 -39.13 14.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 125.208 1.181 . . . . 0.0 109.66 -179.654 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.435 ' N ' HG12 ' A' ' 69' ' ' VAL . 4.3 tt0 57.17 65.14 1.44 Allowed 'General case' 0 C--O 1.211 -0.946 1 O-C-N 130.67 4.981 . . . . 0.0 108.546 -179.262 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.691 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.1 t80 -49.16 92.65 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.68 2 O-C-N 133.421 6.701 . . . . 0.0 110.866 -179.384 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.428 ' C ' ' HG3' ' A' ' 73' ' ' GLU . 39.6 t0 -57.29 63.84 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.997 0 O-C-N 126.403 2.314 . . . . 0.0 113.93 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.482 ' HB3' ' CB ' ' A' ' 82' ' ' ASN 0.258 5.3 mt-10 56.36 -170.59 0.08 Allowed 'General case' 0 CA--C 1.484 -1.574 0 CA-C-O 125.373 2.511 . . . . 0.0 110.05 179.743 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.75 93.11 0.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 109.225 -3.625 . . . . 0.0 109.004 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.43 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 2.0 p -96.07 -55.86 2.83 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 111.301 -2.681 . . . . 0.0 116.91 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.43 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 48.1 165.31 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.933 1 O-C-N 129.348 4.155 . . . . 0.0 115.562 -179.515 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.18 -51.39 3.42 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 112.36 -2.2 . . . . 0.0 112.497 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.647 ' O ' HD12 ' A' ' 26' ' ' ILE 0.267 2.5 tp -119.8 -0.79 10.63 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 127.975 2.809 . . . . 0.0 117.417 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -154.99 -74.08 0.11 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 116.545 -2.062 . . . . 0.0 113.199 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.93 72.88 1.28 Allowed Glycine 0 C--O 1.212 -1.219 0 CA-C-O 122.578 1.099 . . . . 0.0 111.825 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.423 ' CG ' ' H ' ' A' ' 82' ' ' ASN . 0.8 OUTLIER -136.89 -148.45 0.28 Allowed 'General case' 0 C--N 1.351 0.651 0 CA-C-N 110.185 -3.007 . . . . 0.0 109.107 -179.769 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.482 ' CB ' ' HB3' ' A' ' 73' ' ' GLU . 40.6 m-20 -161.69 100.15 1.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 125.637 1.835 . . . . 0.0 109.516 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 40.4 t -129.13 146.81 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 O-C-N 127.265 2.853 . . . . 0.0 118.534 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -79.87 88.23 5.29 Favored 'General case' 0 C--O 1.218 -0.595 1 O-C-N 130.423 4.827 . . . . 0.0 108.254 179.436 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.691 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 8.0 m -99.22 85.83 3.29 Favored 'General case' 0 C--O 1.193 -1.882 1 O-C-N 130.258 4.724 . . . . 0.0 114.034 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.644 HD23 ' N ' ' A' ' 87' ' ' VAL . 7.9 tt -89.63 155.71 19.06 Favored 'General case' 0 N--CA 1.442 -0.854 1 CA-C-N 107.509 -4.405 . . . . 0.0 110.238 179.822 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.644 ' N ' HD23 ' A' ' 86' ' ' LEU . 2.4 p -140.14 132.49 33.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 127.087 2.155 . . . . 0.0 109.692 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.473 ' HB ' HD21 ' A' ' 86' ' ' LEU . 6.8 t -155.8 -178.69 7.48 Favored 'General case' 0 CA--C 1.485 -1.55 0 CA-C-O 125.419 2.533 . . . . 0.0 111.584 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.732 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 58.5 m95 -99.25 145.6 27.1 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 118.577 -2.577 . . . . 0.0 108.647 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.648 ' HB2' HG23 ' A' ' 95' ' ' VAL . 7.2 tp10 -93.09 -44.45 8.37 Favored 'General case' 0 C--O 1.201 -1.455 1 CA-C-O 131.529 5.443 . . . . 0.0 112.15 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 174.93 -46.64 0.13 Allowed Glycine 0 N--CA 1.478 1.491 1 CA-C-N 106.634 -4.803 . . . . 0.0 104.464 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -141.48 36.53 1.67 Allowed 'General case' 0 C--O 1.202 -1.438 1 O-C-N 130.305 4.18 . . . . 0.0 110.881 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 90' ' ' GLU . 3.6 t -176.09 158.72 2.02 Favored 'General case' 0 C--O 1.203 -1.354 0 N-CA-C 118.048 2.61 . . . . 0.0 118.048 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.621 HD22 ' CE2' ' A' ' 50' ' ' PHE . 6.4 tp -90.01 94.55 9.84 Favored 'General case' 0 CA--C 1.492 -1.258 0 O-C-N 128.613 3.695 . . . . 0.0 117.244 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.648 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.366 38.2 t -91.91 126.72 44.47 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-N 108.816 -3.811 . . . . 0.0 111.923 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 4.4 m -131.64 123.74 28.47 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 127.077 2.736 . . . . 0.0 103.795 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.1 t -96.31 119.73 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 110.854 -2.884 . . . . 0.0 112.657 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.544 ' HG3' ' CB ' ' A' ' 105' ' ' ARG 0.307 0.0 OUTLIER -94.68 104.24 16.16 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 110.895 -2.866 . . . . 0.0 107.886 179.647 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.9 106.92 12.52 Favored 'General case' 0 C--O 1.206 -1.227 0 O-C-N 127.27 2.856 . . . . 0.0 110.681 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -120.47 -169.12 13.86 Favored Glycine 0 C--O 1.209 -1.415 0 CA-C-O 124.033 1.907 . . . . 0.0 109.57 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -72.69 -13.39 61.34 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 108.376 -3.912 . . . . 0.0 112.459 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -160.63 -43.24 0.05 OUTLIER 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 117.407 2.373 . . . . 0.0 117.407 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.505 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 28.4 mt-10 -56.04 144.78 27.69 Favored 'General case' 0 C--O 1.208 -1.121 0 O-C-N 126.716 2.51 . . . . 0.0 117.668 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.466 ' O ' HG23 ' A' ' 121' ' ' THR . 94.2 m-20 -127.11 60.56 1.38 Allowed 'General case' 0 N--CA 1.491 1.593 1 CA-C-N 107.597 -4.365 . . . . 0.0 102.0 179.651 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.721 ' NE ' HD22 ' A' ' 24' ' ' LEU . 0.7 OUTLIER -69.32 -15.54 63.36 Favored 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.118 5.261 . . . . 0.0 113.792 -179.667 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.518 ' N ' ' HG2' ' A' ' 98' ' ' GLN . . . -21.11 96.08 0.01 OUTLIER Glycine 0 C--O 1.21 -1.346 2 O-C-N 134.041 7.088 . . . . 0.0 115.351 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.586 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.315 0.0 OUTLIER -114.38 129.77 56.66 Favored 'General case' 0 C--O 1.196 -1.727 1 O-C-N 132.259 5.329 . . . . 0.0 110.389 179.762 . . . . . . . . 5 4 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.9 ptpt -158.03 168.02 28.27 Favored 'General case' 0 C--N 1.354 0.774 1 O-C-N 130.681 4.988 . . . . 0.0 117.91 -178.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.457 ' NE2' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -125.26 172.68 9.36 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 115.2 -2.333 . . . . 0.0 110.799 -179.15 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.464 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER 175.41 71.12 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.977 1 O-C-N 130.222 4.702 . . . . 0.0 117.948 -179.586 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 44.9 t -18.45 116.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.484 -1.583 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -127.18 68.99 1.28 Allowed 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.81 100.61 0.06 OUTLIER Glycine 0 C--O 1.207 -1.537 0 CA-C-O 118.129 -1.373 . . . . 0.0 115.647 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 39.58 41.77 0.81 Allowed 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 10.3 pttm 177.2 170.06 0.56 Allowed 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 128.978 3.924 . . . . 0.0 107.769 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.561 HD23 ' CZ2' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -148.85 121.1 8.37 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 115.362 -2.535 . . . . 0.0 113.038 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.464 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 8.9 m-85 -67.15 154.84 40.26 Favored 'General case' 0 C--N 1.362 1.138 0 CA-C-N 111.374 -2.648 . . . . 0.0 112.895 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.464 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -130.21 39.88 3.6 Favored 'General case' 0 N--CA 1.476 0.833 2 O-C-N 131.418 5.449 . . . . 0.0 106.501 179.632 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 120' ' ' LEU . 0.1 OUTLIER -51.9 122.17 7.89 Favored 'General case' 0 CA--C 1.508 -0.651 0 O-C-N 128.853 3.846 . . . . 0.0 110.889 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.573 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -141.15 168.37 19.94 Favored 'General case' 0 CA--C 1.486 -1.51 1 O-C-N 130.33 4.769 . . . . 0.0 109.579 -179.811 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' ' 126' ' ' VAL . 2.1 t -135.16 175.73 9.32 Favored 'General case' 0 C--O 1.198 -1.621 0 O-C-N 127.112 2.758 . . . . 0.0 105.224 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.6 p 174.2 84.87 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.52 0 O-C-N 124.925 1.391 . . . . 0.0 111.115 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 71.91 39.64 58.89 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-O 123.749 1.749 . . . . 0.0 111.223 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.14 37.05 6.83 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 109.53 -3.335 . . . . 0.0 112.482 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -96.3 -13.3 23.43 Favored 'General case' 0 C--O 1.199 -1.586 0 O-C-N 127.125 2.765 . . . . 0.0 107.851 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.538 ' HA ' ' HA ' ' A' ' 121' ' ' THR . 35.6 m 27.57 60.55 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 C-N-CA 127.505 2.322 . . . . 0.0 115.144 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.0 t -55.02 112.09 0.98 Allowed 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 125.344 1.458 . . . . 0.0 111.793 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 53.4 ttm-85 -105.76 100.88 10.43 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -85.01 173.78 10.26 Favored 'General case' 0 CA--C 1.489 -1.389 0 CA-C-N 112.962 -1.926 . . . . 0.0 113.545 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.449 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 2.2 m -135.88 157.12 38.34 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.464 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 63.6 m-85 -140.96 175.83 9.3 Favored 'General case' 0 CA--C 1.493 -1.215 0 O-C-N 128.196 3.435 . . . . 0.0 115.718 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.293 0.0 OUTLIER -163.96 119.81 1.62 Allowed 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 110.731 -2.941 . . . . 0.0 103.606 179.834 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.563 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 9.2 tttt -53.09 126.17 19.79 Favored 'General case' 0 C--O 1.198 -1.614 0 O-C-N 127.176 2.798 . . . . 0.0 110.72 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.124 0 O-C-N 125.712 1.882 . . . . 0.0 115.972 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.74 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -101.31 81.31 2.19 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -101.11 -83.45 0.45 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 113.725 -3.036 . . . . 0.0 108.127 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.9 113.02 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.733 1 O-C-N 129.191 4.057 . . . . 0.0 114.451 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.56 -130.72 1.84 Allowed Glycine 0 C--O 1.207 -1.569 0 O-C-N 126.52 2.388 . . . . 0.0 112.472 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.494 HG23 HG23 ' A' ' 40' ' ' THR . 1.2 m -174.57 144.01 0.84 Allowed 'General case' 0 C--N 1.314 -0.954 1 O-C-N 130.661 4.389 . . . . 0.0 106.398 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.592 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.2 134.8 22.15 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 111.967 -2.379 . . . . 0.0 114.621 -179.539 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -69.54 -14.81 63.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.599 ' HE2' ' HB2' ' A' ' 41' ' ' LYS . 5.2 ttp 55.2 57.74 5.26 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -17.88 -49.6 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.883 0 O-C-N 128.514 3.634 . . . . 0.0 111.903 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.3 165.39 28.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 110.273 -3.148 . . . . 0.0 111.406 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.24 129.91 11.56 Favored 'General case' 0 CA--C 1.482 -1.651 0 CA-C-N 110.42 -3.082 . . . . 0.0 111.466 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' A' ' 17' ' ' PHE . 7.0 mm-40 -88.46 -174.59 4.65 Favored 'General case' 0 CA--C 1.496 -1.125 1 O-C-N 129.471 4.232 . . . . 0.0 112.119 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 33.24 -81.76 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.55 0 C-N-CA 125.855 1.662 . . . . 0.0 113.763 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.424 ' N ' ' O ' ' A' ' 15' ' ' GLU . 1.4 t80 73.81 -59.39 0.56 Allowed 'General case' 0 C--O 1.203 -1.364 0 O-C-N 126.203 2.189 . . . . 0.0 113.165 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.418 ' OE1' ' N ' ' A' ' 19' ' ' GLY . 0.5 OUTLIER -76.4 -48.86 18.35 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.536 -1.665 . . . . 0.0 115.241 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.471 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.47 -19.92 28.36 Favored Glycine 0 CA--C 1.494 -1.222 0 CA-C-O 116.934 -2.037 . . . . 0.0 112.893 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -36.89 38.96 Favored 'General case' 0 C--O 1.21 -0.983 0 O-C-N 128.13 2.9 . . . . 0.0 106.387 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.595 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -75.45 -25.57 57.56 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 111.048 -2.796 . . . . 0.0 107.554 179.53 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.471 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -79.92 -28.76 39.74 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 129.065 2.946 . . . . 0.0 114.238 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.53 -28.67 66.21 Favored 'General case' 0 N--CA 1.477 0.912 2 O-C-N 130.818 5.074 . . . . 0.0 113.344 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.963 HD11 ' HB ' ' A' ' 26' ' ' ILE . 4.1 pp -103.04 -4.39 24.66 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 127.946 3.279 . . . . 0.0 108.999 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 54.25 82.59 0.09 Allowed 'General case' 0 CA--C 1.484 -1.571 0 C-N-CA 131.027 3.731 . . . . 0.0 114.519 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.963 ' HB ' HD11 ' A' ' 24' ' ' LEU . 16.2 tt -111.65 42.76 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-N 111.501 -2.591 . . . . 0.0 106.883 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.531 ' O ' ' CG ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -47.21 151.53 0.69 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 114.247 -2.787 . . . . 0.0 108.957 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.531 ' CG ' ' O ' ' A' ' 27' ' ' ASP . 4.8 m-30 147.12 -27.68 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.783 1 O-C-N 131.276 5.36 . . . . 0.0 111.28 179.169 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 90.52 73.32 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.542 0 O-C-N 127.049 2.718 . . . . 0.0 108.125 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -26.43 27.76 Favored 'General case' 0 C--O 1.212 -0.899 1 CA-C-N 105.708 -5.224 . . . . 0.0 111.816 179.761 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.412 ' HG2' ' CB ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -89.93 -171.24 3.08 Favored 'General case' 0 C--N 1.319 -0.739 1 O-C-N 129.283 4.114 . . . . 0.0 110.874 -179.925 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 96.64 -37.64 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.415 1 O-C-N 130.905 5.128 . . . . 0.0 112.848 -179.663 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.9 OUTLIER -145.06 34.16 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 128.514 3.634 . . . . 0.0 108.675 -179.753 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -129.57 20.9 5.59 Favored 'General case' 0 C--O 1.206 -1.185 1 CA-C-O 128.63 4.062 . . . . 0.0 111.373 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.27 -40.75 57.57 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-N 108.542 -3.936 . . . . 0.0 110.038 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HD2' ' CB ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -177.47 99.0 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.858 0 CA-C-N 110.562 -3.017 . . . . 0.0 115.717 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.746 HD21 ' N ' ' A' ' 58' ' ' PHE . 1.4 pp -100.08 -1.26 37.3 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 105.41 -2.071 . . . . 0.0 105.41 178.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.577 ' N ' HD12 ' A' ' 37' ' ' LEU . 2.9 m 142.72 128.38 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.161 1 O-C-N 131.098 5.249 . . . . 0.0 110.393 -178.71 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.585 ' HG2' ' HE3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -130.81 140.95 50.31 Favored 'General case' 0 CA--C 1.494 -1.178 0 O-C-N 126.3 2.25 . . . . 0.0 113.321 -179.359 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.494 HG23 HG23 ' A' ' 8' ' ' THR . 38.9 m -156.03 104.13 2.26 Favored 'General case' 0 C--O 1.21 -1.02 0 O-C-N 128.62 3.7 . . . . 0.0 114.371 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.621 ' HE3' HD11 ' A' ' 118' ' ' LEU . 0.0 OUTLIER -96.68 118.96 34.27 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.54 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.8 mp -105.92 155.79 6.83 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 1 O-C-N 129.289 4.118 . . . . 0.0 111.1 179.587 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.54 ' N ' HG22 ' A' ' 42' ' ' ILE 0.307 2.4 tt -132.05 141.18 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.41 0 O-C-N 127.555 3.035 . . . . 0.0 106.486 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.7 t -141.08 85.12 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.752 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.53 131.51 37.6 Favored 'General case' 0 CA--C 1.494 -1.182 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.439 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -140.78 -6.87 1.11 Allowed 'General case' 0 CA--C 1.483 -1.626 0 O-C-N 127.777 3.173 . . . . 0.0 118.06 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 115.21 102.88 2.42 Favored Glycine 0 N--CA 1.474 1.209 0 CA-C-N 120.752 1.615 . . . . 0.0 111.177 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 56.42 26.46 10.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 126.314 1.832 . . . . 0.0 112.102 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -173.5 85.57 0.05 Allowed 'General case' 0 C--O 1.22 -0.475 0 O-C-N 128.235 3.459 . . . . 0.0 112.704 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.683 ' CE1' HD22 ' A' ' 94' ' ' LEU . 35.9 t80 -108.36 119.18 38.75 Favored 'General case' 0 CA--C 1.502 -0.899 0 O-C-N 127.623 3.077 . . . . 0.0 113.99 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -128.15 100.72 5.97 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.536 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -78.21 124.1 27.68 Favored 'General case' 0 C--O 1.217 -0.638 0 O-C-N 129.019 3.95 . . . . 0.0 106.203 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.462 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -132.35 138.22 47.68 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 126.519 2.387 . . . . 0.0 111.232 -179.433 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.7 t -100.1 143.74 29.95 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 125.936 2.023 . . . . 0.0 110.11 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -118.16 37.54 3.97 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 112.148 -2.296 . . . . 0.0 115.626 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.464 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 63.3 m -96.51 106.79 19.1 Favored 'General case' 0 N--CA 1.476 0.864 1 O-C-N 131.643 5.589 . . . . 0.0 106.318 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.5 m -43.69 -48.42 7.88 Favored 'General case' 0 CA--C 1.501 -0.919 0 O-C-N 127.942 3.277 . . . . 0.0 110.761 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.746 ' N ' HD21 ' A' ' 37' ' ' LEU . 0.2 OUTLIER -50.89 -37.2 42.21 Favored 'General case' 0 C--N 1.365 1.245 0 O-C-N 126.421 2.325 . . . . 0.0 111.692 -179.714 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -169.31 124.84 0.87 Allowed 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 129.926 4.516 . . . . 0.0 117.941 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -115.56 79.07 1.24 Allowed 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 111.231 -2.713 . . . . 0.0 108.86 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -62.01 -47.31 85.34 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 126.934 2.646 . . . . 0.0 106.69 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 52.83 123.2 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 130.098 4.624 . . . . 0.0 117.154 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.915 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -86.06 95.04 9.4 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 127.173 2.796 . . . . 0.0 109.256 178.841 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -131.39 92.38 3.17 Favored 'General case' 0 C--O 1.208 -1.105 0 C-N-CA 116.409 -2.116 . . . . 0.0 109.597 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.433 ' CE2' ' HB ' ' A' ' 87' ' ' VAL . 0.1 OUTLIER -143.37 -141.78 0.13 Allowed 'General case' 0 CA--C 1.484 -1.582 0 CA-C-N 112.566 -2.106 . . . . 0.0 111.114 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.608 HG22 HG23 ' A' ' 69' ' ' VAL 0.26 0.8 OUTLIER -158.83 159.79 35.48 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 179.819 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.571 ' HA ' HG22 ' A' ' 87' ' ' VAL . 15.4 t -77.42 144.73 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 O-C-N 125.03 1.457 . . . . 0.0 111.732 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 75.21 1.48 64.12 Favored Glycine 0 CA--C 1.491 -1.434 0 CA-C-N 109.916 -3.311 . . . . 0.0 116.397 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.608 HG23 HG22 ' A' ' 66' ' ' THR 0.305 1.4 t -67.54 -45.77 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 CA-C-N 112.374 -1.913 . . . . 0.0 107.527 -179.944 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 72.9 92.3 0.08 Allowed 'General case' 0 C--N 1.353 0.72 0 CA-C-N 109.613 -3.449 . . . . 0.0 109.898 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.537 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.5 m-30 -71.55 82.82 0.83 Allowed 'General case' 0 C--N 1.356 0.879 0 O-C-N 128.085 3.366 . . . . 0.0 111.013 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 12.7 p30 -56.22 79.29 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 113.707 -1.588 . . . . 0.0 111.736 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 1.4 mt-10 56.38 89.71 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 123.182 1.468 . . . . 0.0 109.936 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.4 ' CD2' ' CE2' ' A' ' 71' ' ' PHE . 1.3 t60 -163.68 98.44 0.88 Allowed 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 111.69 -2.505 . . . . 0.0 115.107 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.42 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -127.81 -60.61 1.15 Allowed 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.33 -1.305 . . . . 0.0 111.139 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.437 ' HA ' ' HA2' ' A' ' 80' ' ' GLY . 0.1 OUTLIER 49.27 -178.86 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 128.428 3.966 . . . . 0.0 116.248 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.55 -84.7 0.27 Allowed Glycine 0 C--O 1.211 -1.326 0 CA-C-N 108.833 -3.803 . . . . 0.0 112.747 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.502 ' O ' HD12 ' A' ' 26' ' ' ILE . 5.4 tp -57.72 -60.98 2.87 Favored 'General case' 0 N--CA 1.451 -0.376 1 CA-C-N 107.481 -4.359 . . . . 0.0 114.285 179.874 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.662 ' HB2' HD13 ' A' ' 24' ' ' LEU . 8.1 t0 -115.09 -54.79 2.53 Favored 'General case' 0 CA--C 1.494 -1.187 0 O-C-N 126.928 2.642 . . . . 0.0 110.594 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 76' ' ' LYS . . . 68.64 89.25 0.07 OUTLIER Glycine 0 N--CA 1.473 1.129 0 CA-C-N 112.133 -2.303 . . . . 0.0 111.651 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.402 ' HD3' ' HA ' ' A' ' 81' ' ' ARG . 12.9 tpp85 -129.4 -131.65 0.21 Allowed 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 111.743 -2.228 . . . . 0.0 112.139 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.491 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 6.9 p-10 -164.09 81.05 0.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 117.997 -1.481 . . . . 0.0 107.729 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.466 HG12 ' C ' ' A' ' 99' ' ' LYS . 0.1 OUTLIER -126.31 133.41 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.505 0 N-CA-C 118.754 2.872 . . . . 0.0 118.754 -179.36 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.446 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -61.53 90.36 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.705 0 O-C-N 128.595 3.684 . . . . 0.0 107.421 179.13 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.537 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 94.6 m -86.73 58.14 4.89 Favored 'General case' 0 C--O 1.201 -1.49 0 CA-C-N 109.648 -3.433 . . . . 0.0 113.818 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.595 HD21 ' OG1' ' A' ' 88' ' ' THR . 8.4 tt -62.82 144.6 56.41 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 109.141 -3.663 . . . . 0.0 112.81 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.571 HG22 ' HA ' ' A' ' 67' ' ' VAL . 2.0 p -130.7 132.76 64.08 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 CA-C-N 110.812 -2.904 . . . . 0.0 109.466 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.595 ' OG1' HD21 ' A' ' 86' ' ' LEU 0.256 90.1 m -153.82 169.63 22.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 111.477 -2.601 . . . . 0.0 110.716 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.624 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 23.8 m95 -98.38 138.96 34.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 C-N-CA 128.55 2.74 . . . . 0.0 106.22 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.671 ' HB2' HG23 ' A' ' 95' ' ' VAL . 1.6 tt0 -95.96 -47.08 6.27 Favored 'General case' 0 CA--C 1.479 -1.773 1 CA-C-O 128.776 4.131 . . . . 0.0 116.292 -179.55 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -176.43 -51.65 0.06 OUTLIER Glycine 0 C--O 1.197 -2.196 0 CA-C-N 109.302 -3.59 . . . . 0.0 106.333 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.01 31.49 1.78 Allowed 'General case' 0 C--O 1.209 -1.036 1 O-C-N 131.945 5.144 . . . . 0.0 111.176 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.4 ' O ' ' N ' ' A' ' 90' ' ' GLU . 0.8 OUTLIER -167.83 165.46 13.97 Favored 'General case' 0 C--O 1.202 -1.425 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.683 HD22 ' CE1' ' A' ' 50' ' ' PHE . 2.1 tp -95.12 86.17 4.52 Favored 'General case' 0 C--O 1.204 -1.314 0 CA-C-N 111.138 -2.756 . . . . 0.0 117.477 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.671 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.344 2.5 t -82.25 125.82 39.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.737 0 CA-C-N 109.653 -3.43 . . . . 0.0 111.976 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.429 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 14.3 m -132.49 129.13 38.77 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 125.727 2.679 . . . . 0.0 105.24 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -114.19 77.57 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.58 0 CA-C-N 110.754 -2.93 . . . . 0.0 118.902 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.414 ' HB3' ' HB2' ' A' ' 105' ' ' ARG . 2.3 tt0 -60.62 111.44 1.61 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 119.682 -1.886 . . . . 0.0 108.088 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.466 ' C ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.27 143.5 35.96 Favored 'General case' 0 C--O 1.195 -1.813 0 C-N-CA 113.744 -3.182 . . . . 0.0 113.306 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 146.39 137.87 3.1 Favored Glycine 0 C--O 1.213 -1.159 0 C-N-CA 119.259 -1.448 . . . . 0.0 111.032 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 66.88 -59.92 0.36 Allowed 'General case' 0 C--N 1.353 0.753 0 CA-C-N 110.206 -2.997 . . . . 0.0 112.179 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.19 -31.81 0.05 Allowed 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.29 146.69 54.31 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 125.879 2.752 . . . . 0.0 117.311 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.404 ' O ' ' N ' ' A' ' 122' ' ' CYS . 11.6 m-20 -127.25 78.97 1.85 Allowed 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.224 -4.989 . . . . 0.0 101.683 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.414 ' HB2' ' HB3' ' A' ' 98' ' ' GLN . 6.9 mmm180 -98.42 3.11 48.39 Favored 'General case' 0 C--O 1.199 -1.602 1 O-C-N 131.078 5.237 . . . . 0.0 112.664 -179.634 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -33.56 85.66 0.01 OUTLIER Glycine 0 N--CA 1.428 -1.884 2 O-C-N 133.004 6.44 . . . . 0.0 114.929 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.915 ' CZ2' HD21 ' A' ' 63' ' ' LEU 0.273 0.0 OUTLIER -97.42 129.56 44.63 Favored 'General case' 0 C--O 1.197 -1.669 0 O-C-N 129.934 3.961 . . . . 0.0 109.807 179.308 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.03 156.67 36.33 Favored 'General case' 0 C--O 1.211 -0.942 0 O-C-N 129.011 3.944 . . . . 0.0 115.951 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.431 ' NE2' ' CD1' ' A' ' 107' ' ' TRP 0.299 39.2 mm-40 -114.05 165.97 12.09 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 111.201 -2.727 . . . . 0.0 110.927 -177.936 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -175.76 95.71 0.06 Allowed 'General case' 0 C--O 1.213 -0.858 1 O-C-N 129.986 4.553 . . . . 0.0 116.009 177.955 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.415 HG23 ' H ' ' A' ' 111' ' ' VAL . 48.3 t -38.85 98.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.91 0 CA-C-O 127.036 3.303 . . . . 0.0 112.277 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -104.2 56.19 0.72 Allowed 'General case' 0 CA--C 1.488 -1.408 0 CA-C-N 109.361 -3.563 . . . . 0.0 117.235 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 105.17 -111.61 3.79 Favored Glycine 0 C--O 1.205 -1.712 0 CA-C-N 113.593 -1.639 . . . . 0.0 113.09 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -112.74 19.36 17.49 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 117.413 2.375 . . . . 0.0 117.413 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 131' ' ' PHE . 4.5 pttt -158.91 163.43 36.56 Favored 'General case' 0 N--CA 1.476 0.825 2 O-C-N 131.189 5.306 . . . . 0.0 109.807 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.488 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 4.8 mt -105.39 173.13 6.44 Favored 'General case' 0 CA--C 1.494 -1.206 0 O-C-N 127.104 2.753 . . . . 0.0 112.503 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -133.9 93.73 3.15 Favored 'General case' 0 C--O 1.206 -1.206 0 O-C-N 127.95 3.281 . . . . 0.0 113.803 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.657 HD13 ' CZ ' ' A' ' 131' ' ' PHE . 2.3 mp -79.6 70.93 6.17 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 111.467 -2.606 . . . . 0.0 106.479 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -85.6 108.14 17.84 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 127.387 2.929 . . . . 0.0 109.075 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.505 HD21 ' HB3' ' A' ' 127' ' ' CYS . 0.6 OUTLIER -126.28 177.78 6.22 Favored 'General case' 0 N--CA 1.484 1.275 1 O-C-N 130.091 4.619 . . . . 0.0 113.013 179.83 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.1 m -125.76 170.55 11.46 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 110.593 -3.003 . . . . 0.0 105.364 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER -169.37 38.37 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 123.888 1.804 . . . . 0.0 111.592 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 117.18 -67.3 0.32 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 112.735 -2.03 . . . . 0.0 108.257 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -173.8 43.34 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.005 0 CA-C-N 109.661 -3.269 . . . . 0.0 109.932 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -120.86 4.89 10.49 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 111.669 -2.514 . . . . 0.0 110.006 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 126' ' ' VAL . 8.0 p 6.67 71.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 O-C-N 128.433 3.583 . . . . 0.0 114.925 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.505 ' HB3' HD21 ' A' ' 120' ' ' LEU . 0.5 OUTLIER -66.11 142.82 57.64 Favored 'General case' 0 C--O 1.219 -0.538 0 O-C-N 120.441 -1.412 . . . . 0.0 111.142 -179.532 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.61 147.54 48.68 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 128.432 3.583 . . . . 0.0 110.949 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -122.7 171.06 9.43 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 118.312 -1.355 . . . . 0.0 112.654 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.15 138.3 30.15 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.422 0 N-CA-C 103.543 -2.762 . . . . 0.0 103.543 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.657 ' CZ ' HD13 ' A' ' 118' ' ' LEU . 45.5 m-85 -126.31 179.97 5.03 Favored 'General case' 0 CA--C 1.488 -1.426 0 CA-C-O 128.149 3.833 . . . . 0.0 117.965 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER -161.89 113.35 1.68 Allowed 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 111.196 -2.729 . . . . 0.0 103.773 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.592 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 33.3 ttpt -58.07 89.77 0.01 OUTLIER 'General case' 0 C--O 1.194 -1.867 0 O-C-N 126.654 2.471 . . . . 0.0 115.299 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt . . . . . 0 C--O 1.26 1.616 0 O-C-N 127.866 3.229 . . . . 0.0 117.906 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 25.0 mttt . . . . . 0 CA--C 1.491 -1.326 0 CA-C-O 122.325 1.06 . . . . 0.0 113.096 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -72.02 -151.86 0.02 OUTLIER 'General case' 0 C--O 1.24 0.562 0 N-CA-C 104.531 -2.396 . . . . 0.0 104.531 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -171.14 135.89 1.03 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 103.28 -2.859 . . . . 0.0 103.28 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -51.43 124.76 12.71 Favored 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 131.456 5.472 . . . . 0.0 113.345 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.11 -173.95 43.97 Favored Glycine 0 C--O 1.206 -1.647 0 CA-C-O 116.426 -2.319 . . . . 0.0 113.895 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.702 HG23 HG23 ' A' ' 40' ' ' THR . 1.2 m -127.18 124.37 38.86 Favored 'General case' 0 C--O 1.209 -1.036 1 O-C-N 132.911 5.712 . . . . 0.0 104.937 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.509 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -118.0 90.35 3.31 Favored 'General case' 0 CA--C 1.493 -1.249 1 O-C-N 129.224 4.077 . . . . 0.0 114.467 179.882 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.57 100.19 0.05 OUTLIER 'General case' 0 C--O 1.218 -0.579 0 O-C-N 126.901 2.626 . . . . 0.0 108.039 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.408 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -33.37 -58.04 0.4 Allowed 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.04 3.337 . . . . 0.0 107.335 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 90.37 -28.21 0.04 OUTLIER 'General case' 0 C--O 1.199 -1.603 1 O-C-N 131.818 5.699 . . . . 0.0 111.006 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.256 3.3 p -175.7 177.25 1.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 124.513 2.102 . . . . 0.0 110.882 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -146.08 168.86 19.9 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 108.828 -3.805 . . . . 0.0 111.458 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -102.18 -107.09 0.25 Allowed 'General case' 0 CA--C 1.477 -1.841 2 O-C-N 133.237 6.586 . . . . 0.0 111.828 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -84.77 87.03 7.28 Favored 'General case' 0 C--O 1.21 -1.013 0 O-C-N 118.783 -2.448 . . . . 0.0 110.464 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.44 -52.23 65.45 Favored 'General case' 0 C--O 1.207 -1.176 0 CA-C-O 127.584 3.564 . . . . 0.0 112.62 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.469 ' CG ' ' HG3' ' A' ' 31' ' ' ARG . 1.1 mp0 -62.06 -51.79 66.54 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 112.297 -2.229 . . . . 0.0 116.379 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.483 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -53.07 -21.65 11.23 Favored Glycine 0 CA--C 1.484 -1.86 1 O-C-N 129.563 4.289 . . . . 0.0 113.651 -179.931 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.456 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -73.81 -45.7 49.81 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 126.237 2.922 . . . . 0.0 105.654 179.615 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.519 ' O ' HG22 ' A' ' 26' ' ' ILE . 24.6 mtm -71.73 -25.38 62.04 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 112.543 -2.117 . . . . 0.0 112.066 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.483 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 1.0 OUTLIER -79.73 -33.92 40.42 Favored 'General case' 0 C--O 1.215 -0.753 0 O-C-N 128.024 3.327 . . . . 0.0 114.989 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.97 78.0 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 109.462 -3.517 . . . . 0.0 113.675 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.661 HD12 ' O ' ' A' ' 24' ' ' LEU . 1.1 pp -84.19 -7.15 59.44 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 128.304 3.502 . . . . 0.0 108.093 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 46.35 93.67 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.59 0 CA-C-O 127.269 3.414 . . . . 0.0 111.105 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.519 HG22 ' O ' ' A' ' 21' ' ' MET . 19.7 tt -111.07 28.45 2.07 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 1 CA-C-O 129.093 4.282 . . . . 0.0 108.869 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.443 ' C ' ' CD1' ' A' ' 28' ' ' PHE . 30.5 m-20 77.03 53.35 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 CA-C-N 108.637 -3.892 . . . . 0.0 110.427 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.605 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER 12.15 69.97 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.104 1 O-C-N 130.319 4.762 . . . . 0.0 117.374 179.036 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.87 -175.01 2.91 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 112.591 -2.095 . . . . 0.0 106.677 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.474 HG21 HH21 ' A' ' 59' ' ' ARG . 3.2 m 93.57 -20.51 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 2 O-C-N 132.95 6.406 . . . . 0.0 114.707 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.511 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -77.53 -171.4 2.14 Favored 'General case' 0 N--CA 1.44 -0.936 1 O-C-N 130.83 5.081 . . . . 0.0 110.839 179.737 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.3 OUTLIER 75.75 21.26 1.69 Allowed 'General case' 0 CA--C 1.498 -1.034 0 O-C-N 128.749 3.78 . . . . 0.0 113.643 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.501 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -170.12 -40.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 O-C-N 128.917 3.886 . . . . 0.0 113.268 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.492 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -72.77 -12.91 61.19 Favored 'General case' 0 C--O 1.209 -1.048 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.56 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -15.03 -48.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 O-C-N 128.789 3.806 . . . . 0.0 114.659 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 14.7 tpt180 -177.79 144.56 0.37 Allowed 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 127.321 2.888 . . . . 0.0 115.219 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.788 ' C ' HD12 ' A' ' 37' ' ' LEU . 1.1 pp -175.52 147.96 0.88 Allowed 'General case' 0 CA--C 1.539 0.532 2 O-C-N 130.675 4.984 . . . . 0.0 109.005 178.73 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 m 1.97 58.42 0.0 OUTLIER 'General case' 0 CA--C 1.482 -1.653 1 O-C-N 133.467 6.729 . . . . 0.0 112.982 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -74.19 137.94 43.44 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -179.332 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.702 HG23 HG23 ' A' ' 8' ' ' THR . 2.9 m -150.6 124.28 9.13 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 109.524 -3.489 . . . . 0.0 114.782 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.68 ' NZ ' HD21 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -109.99 156.85 19.95 Favored 'General case' 0 N--CA 1.49 1.553 1 O-C-N 129.55 4.281 . . . . 0.0 101.938 179.044 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.53 HD12 ' HG2' ' A' ' 53' ' ' LYS . 66.3 mt -149.18 157.71 6.68 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 O-C-N 126.717 2.511 . . . . 0.0 112.198 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.503 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -142.02 135.79 29.24 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 109.014 -3.721 . . . . 0.0 105.981 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.1 t -119.35 -32.62 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.194 0 CA-C-N 112.032 -2.349 . . . . 0.0 116.449 -178.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 23.45 72.09 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -18.75 64.89 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 108.705 -3.861 . . . . 0.0 110.744 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.96 -95.92 0.16 Allowed Glycine 0 C--O 1.2 -2.016 0 CA-C-N 113.637 -1.619 . . . . 0.0 114.23 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -82.05 -27.44 32.99 Favored 'General case' 0 C--O 1.22 -0.497 0 O-C-N 125.874 1.573 . . . . 0.0 111.124 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.7 99.22 11.09 Favored 'General case' 0 CA--C 1.54 0.591 1 O-C-N 129.601 4.313 . . . . 0.0 108.462 179.32 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.554 ' CD2' HD13 ' A' ' 94' ' ' LEU . 90.5 t80 -100.38 104.16 15.58 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 128.447 3.592 . . . . 0.0 114.526 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 36.9 mttm -125.72 83.03 2.12 Favored 'General case' 0 CA--C 1.496 -1.115 1 O-C-N 129.181 4.051 . . . . 0.0 119.097 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.682 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.09 151.85 46.4 Favored 'General case' 0 C--N 1.362 1.146 1 O-C-N 129.281 4.113 . . . . 0.0 106.373 179.664 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.53 ' HG2' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -144.84 165.44 28.12 Favored 'General case' 0 CA--C 1.49 -1.342 0 C-N-CA 115.328 -2.549 . . . . 0.0 111.901 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -129.8 137.05 50.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 125.234 2.445 . . . . 0.0 108.171 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -119.7 51.15 1.19 Allowed 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 110.799 -2.91 . . . . 0.0 115.725 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.45 115.05 27.69 Favored 'General case' 0 N--CA 1.483 1.192 1 O-C-N 133.832 6.957 . . . . 0.0 105.178 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.3 p -45.11 -44.36 10.46 Favored 'General case' 0 CA--C 1.511 -0.541 1 O-C-N 129.361 4.163 . . . . 0.0 110.296 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.742 ' CE2' HD23 ' A' ' 37' ' ' LEU . 6.3 m-85 -48.75 -71.57 0.06 Allowed 'General case' 0 C--N 1.366 1.311 0 O-C-N 128.433 3.583 . . . . 0.0 110.499 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.474 HH21 HG21 ' A' ' 30' ' ' THR . 9.2 mmt180 -128.44 133.29 48.51 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-N 108.876 -3.784 . . . . 0.0 113.257 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -136.39 83.53 2.01 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 126.821 2.576 . . . . 0.0 107.32 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -99.37 -37.37 9.26 Favored 'General case' 0 C--N 1.32 -0.677 0 O-C-N 127.952 3.283 . . . . 0.0 108.672 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.63 152.01 0.06 Allowed 'General case' 0 C--O 1.199 -1.556 0 O-C-N 128.527 3.642 . . . . 0.0 116.684 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.682 ' HB2' HG22 ' A' ' 52' ' ' THR . 7.3 tp -99.33 73.88 1.9 Allowed 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 112.577 -2.101 . . . . 0.0 110.908 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.86 100.26 9.49 Favored 'General case' 0 CA--C 1.487 -1.449 0 O-C-N 126.998 2.686 . . . . 0.0 113.148 -179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.53 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 21.0 m-85 -127.01 -175.23 3.36 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 126.093 2.854 . . . . 0.0 106.994 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -134.75 115.24 13.51 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.351 -3.203 . . . . 0.0 102.351 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.54 HG21 ' CD1' ' A' ' 89' ' ' TRP . 2.4 p -46.72 123.84 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.483 -1.616 0 O-C-N 126.954 2.659 . . . . 0.0 116.083 -179.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 60.8 53.8 42.24 Favored Glycine 0 CA--C 1.487 -1.683 0 O-C-N 127.324 2.89 . . . . 0.0 117.923 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 69' ' ' VAL 0.277 1.8 p -122.26 10.25 5.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.354 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 52.44 72.9 0.37 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.377 5.423 . . . . 0.0 108.308 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.531 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 7.7 t80 -63.71 82.16 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.066 0 CA-C-N 108.582 -3.917 . . . . 0.0 118.325 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -65.13 84.94 0.05 Allowed 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 123.436 1.588 . . . . 0.0 109.417 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.534 ' HG2' HG23 ' A' ' 75' ' ' THR . 32.3 tt0 -71.14 148.91 46.92 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-O 124.819 2.247 . . . . 0.0 108.168 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 82' ' ' ASN . 2.9 m80 -140.6 59.39 1.55 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-N 110.257 -3.156 . . . . 0.0 109.852 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.534 HG23 ' HG2' ' A' ' 73' ' ' GLU . 27.9 p -35.22 146.65 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 110.391 -3.095 . . . . 0.0 114.73 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.81 144.04 0.07 Allowed 'General case' 0 C--O 1.212 -0.911 0 O-C-N 128.994 3.934 . . . . 0.0 111.396 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.91 2.48 64.66 Favored Glycine 0 C--O 1.205 -1.675 0 CA-C-N 111.55 -2.568 . . . . 0.0 107.43 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 tp -147.99 -57.86 0.24 Allowed 'General case' 0 CA--C 1.506 -0.72 1 O-C-N 131.185 4.697 . . . . 0.0 117.266 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -111.13 -62.59 1.52 Allowed 'General case' 0 CA--C 1.502 -0.875 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.06 64.79 1.29 Allowed Glycine 0 N--CA 1.476 1.365 0 CA-C-O 126.171 3.095 . . . . 0.0 109.808 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.42 ' N ' ' OG1' ' A' ' 75' ' ' THR . 5.4 tpt180 -145.75 -131.63 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 109.166 -3.517 . . . . 0.0 112.635 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.443 ' HA ' ' HA ' ' A' ' 74' ' ' HIS . 1.2 p-10 -164.15 -100.78 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 115.114 -2.374 . . . . 0.0 108.294 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.418 HG13 ' C ' ' A' ' 99' ' ' LYS . 21.2 t 91.82 146.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 O-C-N 128.544 3.653 . . . . 0.0 117.027 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.86 87.31 6.6 Favored 'General case' 0 C--O 1.219 -0.522 2 O-C-N 129.398 4.186 . . . . 0.0 107.289 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.531 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 61.7 m -96.41 86.15 4.1 Favored 'General case' 0 C--O 1.202 -1.404 0 O-C-N 128.229 3.456 . . . . 0.0 112.091 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 tp -87.24 94.69 9.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 108.595 -3.911 . . . . 0.0 116.259 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.2 t -74.4 141.74 15.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 O-C-N 119.586 -1.946 . . . . 0.0 108.763 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.587 HG23 ' HB ' ' A' ' 95' ' ' VAL . 9.3 t -164.04 172.73 13.44 Favored 'General case' 0 CA--C 1.488 -1.43 0 CA-C-O 126.87 3.224 . . . . 0.0 110.833 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.696 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 49.7 m95 -98.71 136.93 38.05 Favored 'General case' 0 N--CA 1.437 -1.101 0 O-C-N 117.916 -2.99 . . . . 0.0 109.377 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 1.034 ' HB2' HG23 ' A' ' 93' ' ' THR . 0.3 OUTLIER -93.1 -11.15 33.64 Favored 'General case' 0 CA--C 1.475 -1.94 1 CA-C-O 133.642 6.449 . . . . 0.0 113.966 179.569 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.34 -42.18 1.33 Allowed Glycine 0 C--O 1.198 -2.152 1 CA-C-N 107.588 -4.369 . . . . 0.0 104.594 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.406 ' C ' HG22 ' A' ' 93' ' ' THR . 0.2 OUTLIER -152.85 60.8 0.79 Allowed 'General case' 0 C--O 1.204 -1.312 1 O-C-N 131.594 4.938 . . . . 0.0 110.577 -179.768 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 93' ' ' THR . . . . . 1.034 HG23 ' HB2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.91 130.5 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.124 0 O-C-N 127.084 2.74 . . . . 0.0 118.048 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.554 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -74.13 92.32 2.18 Favored 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 130.323 4.765 . . . . 0.0 110.758 179.787 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.945 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.284 79.5 t -90.36 140.6 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 1 O-C-N 130.655 4.972 . . . . 0.0 115.248 -179.75 . . . . . . . . 4 3 . 1 . 004 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.45 ' HB3' ' CZ3' ' A' ' 107' ' ' TRP . 4.5 t -143.95 122.71 12.63 Favored 'General case' 0 C--O 1.195 -1.778 0 O-C-N 125.573 1.796 . . . . 0.0 106.328 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.4 t -101.34 105.2 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.862 0 CA-C-N 111.172 -2.74 . . . . 0.0 111.902 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.509 ' NE2' ' HB3' ' A' ' 105' ' ' ARG . 5.1 mt-30 -86.29 100.79 12.53 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 123.822 1.772 . . . . 0.0 109.88 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.418 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.4 OUTLIER -97.12 96.75 8.67 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 110.037 -3.256 . . . . 0.0 110.507 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -93.29 -97.67 1.48 Allowed Glycine 0 C--O 1.206 -1.646 0 CA-C-N 112.719 -2.037 . . . . 0.0 110.891 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.64 -53.17 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 108.974 -3.613 . . . . 0.0 109.244 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -94.02 -39.61 10.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 111.047 -2.797 . . . . 0.0 112.833 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -115.96 146.63 41.94 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 111.163 -2.744 . . . . 0.0 114.899 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -106.07 97.54 7.34 Favored 'General case' 0 N--CA 1.478 0.957 2 O-C-N 130.29 4.743 . . . . 0.0 102.9 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.509 ' HB3' ' NE2' ' A' ' 98' ' ' GLN . 0.1 OUTLIER -101.5 5.46 41.89 Favored 'General case' 0 C--O 1.214 -0.781 1 O-C-N 130.483 4.864 . . . . 0.0 110.065 -179.724 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.464 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -45.75 93.68 0.01 OUTLIER Glycine 0 N--CA 1.426 -2.012 2 O-C-N 132.393 6.058 . . . . 0.0 114.277 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.597 ' HZ2' HD21 ' A' ' 63' ' ' LEU 0.289 0.0 OUTLIER -108.24 136.32 48.09 Favored 'General case' 0 C--O 1.214 -0.802 1 O-C-N 132.262 5.331 . . . . 0.0 110.304 179.808 . . . . . . . . 5 4 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.39 159.33 43.52 Favored 'General case' 0 CA--C 1.506 -0.728 1 O-C-N 131.121 5.263 . . . . 0.0 113.391 -178.637 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.532 ' HG2' ' HG ' ' A' ' 118' ' ' LEU 0.279 1.8 mp0 -134.04 123.53 24.68 Favored 'General case' 0 C--N 1.368 1.371 0 C-N-CA 115.999 -2.28 . . . . 0.0 111.172 -178.393 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.516 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -117.46 171.32 8.07 Favored 'General case' 0 CA--C 1.498 -1.031 0 O-C-N 128.987 3.93 . . . . 0.0 112.163 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.1 t -109.57 98.81 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.905 0 CA-C-O 124.499 2.095 . . . . 0.0 112.443 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -108.14 85.68 2.16 Favored 'General case' 0 CA--C 1.479 -1.766 0 CA-C-O 125.816 2.722 . . . . 0.0 113.317 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 90.25 -109.28 3.63 Favored Glycine 0 C--O 1.2 -2.024 0 CA-C-N 113.027 -1.897 . . . . 0.0 115.439 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -105.93 -7.78 17.99 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 114.572 -2.632 . . . . 0.0 113.829 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -127.1 174.06 9.2 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 133.132 6.52 . . . . 0.0 110.227 179.954 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.68 HD21 ' NZ ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -136.43 128.26 29.21 Favored 'General case' 0 C--O 1.202 -1.429 0 O-C-N 124.787 1.305 . . . . 0.0 110.517 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.516 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.1 m-85 -78.57 167.17 21.66 Favored 'General case' 0 C--O 1.202 -1.44 0 O-C-N 128.618 3.699 . . . . 0.0 110.11 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.565 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -140.45 59.54 1.55 Allowed 'General case' 0 CA--C 1.509 -0.624 1 CA-C-N 107.291 -4.504 . . . . 0.0 108.079 -179.845 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.2 109.26 1.48 Allowed 'General case' 0 CA--C 1.506 -0.722 0 O-C-N 127.525 3.016 . . . . 0.0 110.525 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.13 148.98 39.75 Favored 'General case' 0 CA--C 1.487 -1.461 1 O-C-N 130.044 4.59 . . . . 0.0 109.902 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 45.5 m -118.47 162.03 19.02 Favored 'General case' 0 C--O 1.208 -1.113 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -161.25 33.52 0.14 Allowed 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 124.2 1.952 . . . . 0.0 113.941 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 104.04 -94.49 1.08 Allowed Glycine 0 CA--C 1.505 -0.531 0 CA-C-N 111.428 -2.624 . . . . 0.0 112.272 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.85 -31.58 45.69 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 112.171 -2.014 . . . . 0.0 111.625 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -103.33 176.87 5.01 Favored 'General case' 0 C--O 1.214 -0.785 1 O-C-N 129.104 4.003 . . . . 0.0 109.332 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.1 m -156.19 87.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 CA-C-N 108.842 -3.799 . . . . 0.0 111.672 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 t -66.49 113.71 4.93 Favored 'General case' 0 CA--C 1.489 -1.392 0 C-N-CA 125.58 1.552 . . . . 0.0 112.765 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.73 93.58 9.31 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 117.612 -1.635 . . . . 0.0 110.858 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.501 ' OE1' HD13 ' A' ' 118' ' ' LEU . 51.6 mt-30 -75.82 165.54 24.86 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 117.532 2.419 . . . . 0.0 117.532 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.508 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -132.46 150.11 32.97 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.428 0 CA-C-O 124.373 2.035 . . . . 0.0 109.058 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.565 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 88.7 m-85 -148.89 175.13 11.53 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 110.854 -2.884 . . . . 0.0 116.509 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.492 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -155.78 137.05 13.88 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 111.9 -2.409 . . . . 0.0 104.98 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.443 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 5.7 ttpt -77.74 94.91 4.54 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 118.185 2.661 . . . . 0.0 118.185 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt . . . . . 0 C--O 1.259 1.557 0 CA-C-O 114.895 -2.479 . . . . 0.0 116.852 179.857 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 mttt . . . . . 0 CA--C 1.492 -1.275 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -67.92 -53.36 27.0 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.24 169.67 0.3 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.956 2.66 . . . . 0.0 107.468 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 26.31 120.04 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.43 1 O-C-N 129.361 4.163 . . . . 0.0 117.876 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -169.51 -128.32 1.0 Allowed Glycine 0 CA--C 1.532 1.112 0 CA-C-N 112.267 -2.242 . . . . 0.0 114.2 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.538 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 3.7 t 168.63 147.74 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.948 1 O-C-N 133.323 5.954 . . . . 0.0 106.479 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.538 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -145.72 103.02 3.74 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.496 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' N ' ' A' ' 12' ' ' GLU 0.259 1.8 mt-10 -64.56 92.49 0.09 Allowed 'General case' 0 C--O 1.213 -0.861 0 O-C-N 126.72 2.513 . . . . 0.0 108.52 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.594 ' HG3' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -42.26 96.01 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 1 O-C-N 130.227 4.704 . . . . 0.0 103.81 -179.917 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' GLU . 27.8 tt0 -35.81 -37.45 0.1 Allowed 'General case' 0 C--O 1.21 -1.014 1 O-C-N 130.383 4.802 . . . . 0.0 107.403 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.263 4.6 p 173.55 141.08 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 110.723 -2.944 . . . . 0.0 110.327 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -96.69 130.37 43.93 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 111.746 -2.479 . . . . 0.0 110.913 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -116.77 140.64 49.2 Favored 'General case' 0 CA--C 1.499 -1.01 0 O-C-N 128.047 3.342 . . . . 0.0 110.563 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 49.53 69.7 0.57 Allowed 'General case' 0 C--O 1.205 -1.287 0 CA-C-O 126.146 2.879 . . . . 0.0 109.963 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -95.38 -40.44 9.51 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 111.41 -2.632 . . . . 0.0 107.974 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -74.93 -39.13 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 111.183 -2.735 . . . . 0.0 111.089 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.09 -26.72 73.95 Favored Glycine 0 CA--C 1.487 -1.708 0 O-C-N 127.187 2.805 . . . . 0.0 110.771 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -71.61 -31.69 67.18 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 124.961 2.315 . . . . 0.0 109.054 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 12.0 mtt -75.11 -27.04 59.68 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.874 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -79.91 -31.24 40.15 Favored 'General case' 0 C--N 1.317 -0.814 1 O-C-N 133.475 6.734 . . . . 0.0 114.92 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.82 91.38 Favored 'General case' 0 C--O 1.208 -1.086 2 O-C-N 130.835 5.084 . . . . 0.0 113.621 -179.636 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.718 HD11 ' HB ' ' A' ' 26' ' ' ILE . 1.5 pp -103.09 -8.26 20.67 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 110.623 -2.99 . . . . 0.0 109.543 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 49.17 99.18 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.155 1 CA-C-O 128.565 4.031 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.718 ' HB ' HD11 ' A' ' 24' ' ' LEU . 7.3 tt -124.53 42.67 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 109.556 -3.474 . . . . 0.0 109.537 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 76.45 137.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.441 0 CA-C-N 110.339 -3.118 . . . . 0.0 107.479 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -106.0 -172.64 2.13 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 116.42 2.008 . . . . 0.0 116.42 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 58.03 30.85 19.85 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 124.443 2.068 . . . . 0.0 106.343 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.429 ' O ' HD11 ' A' ' 33' ' ' ILE . 0.5 OUTLIER -101.84 -16.05 16.7 Favored 'General case' 0 C--O 1.209 -1.057 1 CA-C-N 107.783 -4.281 . . . . 0.0 115.115 -179.916 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -86.57 -172.43 4.02 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 128.893 3.87 . . . . 0.0 109.949 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.46 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER 82.71 7.84 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 O-C-N 129.05 3.968 . . . . 0.0 113.254 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.429 HD11 ' O ' ' A' ' 30' ' ' THR . 0.3 OUTLIER -147.21 -41.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 128.561 3.663 . . . . 0.0 111.0 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.407 ' H ' HD12 ' A' ' 33' ' ' ILE . . . -90.5 24.93 2.44 Favored 'General case' 0 C--O 1.209 -1.032 0 CA-C-O 123.637 1.684 . . . . 0.0 113.865 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.436 ' C ' ' HD3' ' A' ' 36' ' ' ARG . 66.7 t -55.36 -27.41 20.48 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.399 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.203 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.436 ' HD3' ' C ' ' A' ' 35' ' ' VAL . 1.6 mpt_? 140.01 134.1 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.862 2 O-C-N 130.621 4.95 . . . . 0.0 108.975 179.141 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.516 ' CD2' ' CG ' ' A' ' 58' ' ' PHE . 0.3 OUTLIER -102.54 15.36 29.46 Favored 'General case' 0 N--CA 1.439 -1.019 2 O-C-N 130.377 4.798 . . . . 0.0 111.184 -179.703 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 173.54 -53.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.316 1 O-C-N 132.125 5.891 . . . . 0.0 111.113 179.64 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 67.94 140.29 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 O-C-N 127.488 2.993 . . . . 0.0 115.439 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.0 m 162.42 109.39 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.82 1 O-C-N 131.189 5.305 . . . . 0.0 113.307 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.943 ' CE ' HD22 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -98.52 156.12 16.94 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 127.714 3.134 . . . . 0.0 106.764 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.488 HG22 ' N ' ' A' ' 43' ' ' ILE . 4.4 mp -135.99 162.94 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 O-C-N 128.58 3.675 . . . . 0.0 111.497 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.531 HD13 ' N ' ' A' ' 44' ' ' VAL 0.292 0.2 OUTLIER -134.5 133.25 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.566 1 CA-C-N 107.93 -4.214 . . . . 0.0 108.472 179.771 . . . . . . . . 5 4 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.603 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.5 t -107.95 -64.71 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.312 0 CA-C-N 112.226 -2.261 . . . . 0.0 108.985 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.603 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.0 OUTLIER 56.01 91.96 0.03 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.01 -40.52 11.05 Favored 'General case' 0 CA--C 1.49 -1.328 2 O-C-N 131.031 5.207 . . . . 0.0 113.255 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.56 -93.23 0.09 OUTLIER Glycine 0 C--O 1.2 -1.977 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.808 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.51 -19.14 24.15 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 127.516 2.539 . . . . 0.0 110.332 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.43 110.93 23.29 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 129.078 3.986 . . . . 0.0 109.917 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.622 ' HD2' HD13 ' A' ' 94' ' ' LEU . 1.7 t80 -115.84 110.25 18.77 Favored 'General case' 0 CA--C 1.497 -1.061 0 O-C-N 127.53 3.019 . . . . 0.0 111.64 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 79.47 1.44 Allowed 'General case' 0 C--O 1.202 -1.401 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.85 160.75 5.49 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 127.216 2.822 . . . . 0.0 107.507 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.423 ' NZ ' HD13 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -161.91 148.87 14.02 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 115.226 -2.59 . . . . 0.0 110.301 -179.254 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 t -103.83 136.73 42.95 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-O 124.135 1.922 . . . . 0.0 109.618 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -92.55 6.86 45.67 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 115.908 -1.996 . . . . 0.0 113.038 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.4 m -47.61 102.85 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 O-C-N 131.638 5.587 . . . . 0.0 104.872 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 p -33.13 -43.82 0.11 Allowed 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.479 5.487 . . . . 0.0 109.364 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.516 ' CG ' ' CD2' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -51.37 -68.19 0.19 Allowed 'General case' 0 C--N 1.35 0.62 0 O-C-N 128.755 3.784 . . . . 0.0 111.31 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.12 135.16 30.63 Favored 'General case' 0 CA--C 1.508 -0.641 1 O-C-N 129.283 4.114 . . . . 0.0 111.962 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.57 100.4 7.11 Favored 'General case' 0 C--O 1.2 -1.503 0 O-C-N 128.835 3.835 . . . . 0.0 112.275 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -177.39 113.61 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 1 O-C-N 129.337 4.148 . . . . 0.0 108.186 -179.856 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -77.66 0.46 Allowed 'General case' 0 CA--C 1.495 -1.171 0 O-C-N 126.812 2.57 . . . . 0.0 116.56 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.997 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 9.8 tp -112.07 39.91 2.3 Favored 'General case' 0 N--CA 1.435 -1.207 0 N-CA-C 119.554 3.168 . . . . 0.0 119.554 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.09 101.99 0.26 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 104.276 -2.491 . . . . 0.0 104.276 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 1.019 ' CD1' HG21 ' A' ' 87' ' ' VAL . 2.2 m-85 -147.18 -175.23 4.75 Favored 'General case' 0 CA--C 1.496 -1.12 1 CA-C-O 128.726 4.108 . . . . 0.0 112.304 -179.633 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.529 ' CG2' HG21 ' A' ' 69' ' ' VAL . 2.0 m -150.74 166.45 30.4 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.481 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.747 HG21 ' CD1' ' A' ' 89' ' ' TRP . 14.0 t -96.07 130.4 44.8 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.33 0 O-C-N 127.395 2.934 . . . . 0.0 115.544 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.75 34.81 59.16 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.224 -1.941 . . . . 0.0 116.439 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.529 HG21 ' CG2' ' A' ' 66' ' ' THR . 15.0 t -118.21 55.92 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 117.528 -1.225 . . . . 0.0 109.601 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -15.42 86.13 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.801 1 O-C-N 131.934 5.771 . . . . 0.0 115.612 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.496 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.3 m-85 -59.74 94.09 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 109.528 -3.487 . . . . 0.0 114.082 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 80.27 0.3 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 126.984 2.677 . . . . 0.0 108.654 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.447 ' CD ' ' HB3' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 67.57 150.92 0.07 Allowed 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 125.408 2.528 . . . . 0.0 112.929 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.97 62.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 108.88 -3.782 . . . . 0.0 116.166 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.404 ' C ' ' CG ' ' A' ' 76' ' ' LYS . 55.9 p -136.09 115.94 13.12 Favored 'General case' 0 C--O 1.211 -0.954 0 O-C-N 119.434 -2.041 . . . . 0.0 109.743 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.404 ' CG ' ' C ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -155.24 -64.1 0.12 Allowed 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 126.501 3.048 . . . . 0.0 111.561 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -47.96 -37.76 16.28 Favored Glycine 0 N--CA 1.468 0.831 0 CA-C-N 109.289 -3.596 . . . . 0.0 111.516 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . 0.281 1.5 tp -124.28 32.89 5.4 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.705 ' HB2' HD13 ' A' ' 24' ' ' LEU . 2.3 t0 174.46 -83.43 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 123.499 1.618 . . . . 0.0 112.983 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.93 76.91 0.99 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.674 2.083 . . . . 0.0 110.57 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -148.74 -133.19 0.06 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 111.275 -2.462 . . . . 0.0 114.09 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.447 ' HB3' ' CD ' ' A' ' 73' ' ' GLU . 2.0 p30 177.95 105.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 125.199 1.562 . . . . 0.0 109.835 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.66 HG13 ' N ' ' A' ' 100' ' ' GLY . 99.6 t -136.67 134.04 48.81 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.299 0 N-CA-C 117.665 2.469 . . . . 0.0 117.665 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -60.56 107.88 0.75 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 112.116 -2.311 . . . . 0.0 106.809 178.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.496 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 94.9 m -109.77 65.55 0.62 Allowed 'General case' 0 C--O 1.204 -1.33 0 CA-C-O 126.34 2.971 . . . . 0.0 118.372 -178.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.441 ' HB3' HG23 ' A' ' 97' ' ' VAL . 4.7 tt -65.78 142.3 58.02 Favored 'General case' 0 CA--C 1.514 -0.426 1 CA-C-N 108.04 -4.164 . . . . 0.0 112.602 179.633 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 1.019 HG21 ' CD1' ' A' ' 65' ' ' PHE . 30.8 t -125.35 144.62 34.78 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 CA-C-N 110.995 -2.82 . . . . 0.0 109.682 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.619 ' HA ' HG13 ' A' ' 67' ' ' VAL . 3.6 t -159.72 170.54 21.32 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-O 125.743 2.687 . . . . 0.0 110.117 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.747 ' CD1' HG21 ' A' ' 67' ' ' VAL . 32.4 m95 -94.22 145.26 24.84 Favored 'General case' 0 CA--C 1.507 -0.703 0 C-N-CA 128.015 2.526 . . . . 0.0 106.156 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.606 ' HB2' HG23 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -95.82 -36.28 11.19 Favored 'General case' 0 C--O 1.197 -1.681 1 CA-C-O 129.888 4.661 . . . . 0.0 113.109 179.708 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.46 -47.02 0.44 Allowed Glycine 0 N--CA 1.481 1.659 1 CA-C-N 107.361 -4.472 . . . . 0.0 106.078 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -122.84 2.17 9.4 Favored 'General case' 0 N--CA 1.429 -1.49 1 O-C-N 132.74 5.612 . . . . 0.0 113.207 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.489 ' CB ' ' HA ' ' A' ' 110' ' ' TRP . 1.3 t -160.65 175.68 12.39 Favored 'General case' 0 C--O 1.202 -1.43 0 N-CA-C 119.407 3.114 . . . . 0.0 119.407 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.743 HD11 ' CG1' ' A' ' 87' ' ' VAL 0.257 2.9 tp -92.34 106.59 18.56 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 109.872 -3.331 . . . . 0.0 114.805 179.633 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.606 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.327 41.1 t -108.15 126.09 64.78 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.136 0 CA-C-N 111.003 -2.817 . . . . 0.0 111.862 179.506 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.448 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -137.56 150.69 47.68 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 122.255 1.026 . . . . 0.0 108.999 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.441 HG23 ' HB3' ' A' ' 86' ' ' LEU . 6.0 m -130.79 108.08 14.88 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.545 0 CA-C-O 127.229 3.395 . . . . 0.0 118.046 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.563 ' HB3' HG11 ' A' ' 83' ' ' VAL . 2.9 mm-40 -85.09 112.19 20.43 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 112.243 -2.253 . . . . 0.0 108.007 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -51.68 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 128.419 3.574 . . . . 0.0 112.585 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.66 ' N ' HG13 ' A' ' 83' ' ' VAL . . . 79.75 155.09 9.75 Favored Glycine 0 C--O 1.219 -0.811 0 CA-C-O 124.276 2.042 . . . . 0.0 109.128 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.29 -16.27 14.62 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 110.704 -2.748 . . . . 0.0 111.276 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -50.06 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 127.131 2.172 . . . . 0.0 113.122 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -97.04 166.56 11.54 Favored 'General case' 0 C--O 1.198 -1.633 0 CA-C-O 123.295 1.522 . . . . 0.0 113.486 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.484 ' O ' HG23 ' A' ' 121' ' ' THR . 7.0 m-20 -124.48 97.33 5.26 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 108.752 -3.84 . . . . 0.0 103.398 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.456 ' HD3' ' HB3' ' A' ' 122' ' ' CYS . 0.1 OUTLIER -89.65 2.38 54.82 Favored 'General case' 0 C--O 1.203 -1.36 0 C-N-CA 125.071 1.348 . . . . 0.0 113.421 -179.76 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.446 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -46.06 115.48 1.75 Allowed Glycine 0 C--O 1.203 -1.84 2 CA-C-N 108.177 -4.101 . . . . 0.0 112.506 179.816 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.997 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.262 0.0 OUTLIER -114.02 144.93 42.29 Favored 'General case' 0 C--O 1.193 -1.888 0 O-C-N 129.974 3.985 . . . . 0.0 110.344 179.218 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.3 169.74 21.53 Favored 'General case' 0 C--O 1.207 -1.141 1 O-C-N 129.851 4.47 . . . . 0.0 116.6 -179.053 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.525 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -138.42 157.4 46.28 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 109.221 -3.627 . . . . 0.0 109.503 -179.99 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.489 ' HA ' ' CB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -146.08 12.29 1.23 Allowed 'General case' 0 CA--C 1.502 -0.878 1 O-C-N 129.835 4.46 . . . . 0.0 116.044 179.228 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.464 HG22 HD12 ' A' ' 116' ' ' LEU . 5.8 t 34.22 55.4 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-O 127.226 3.393 . . . . 0.0 116.303 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -60.63 104.53 0.35 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 110.154 -3.203 . . . . 0.0 114.536 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 58.17 -84.1 0.01 OUTLIER Glycine 0 C--O 1.204 -1.771 0 CA-C-N 114.03 -1.441 . . . . 0.0 115.991 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -134.35 49.27 2.26 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 116.428 2.011 . . . . 0.0 116.428 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.405 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.322 -0.604 0 O-C-N 127.406 2.941 . . . . 0.0 109.488 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.943 HD22 ' CE ' ' A' ' 41' ' ' LYS . 3.3 tt -116.0 82.23 1.74 Allowed 'General case' 0 CA--C 1.484 -1.558 0 O-C-N 128.434 3.584 . . . . 0.0 116.597 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -54.05 109.26 0.45 Allowed 'General case' 0 CA--C 1.502 -0.866 0 CA-C-N 109.984 -3.28 . . . . 0.0 114.878 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.489 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -92.02 56.77 2.96 Favored 'General case' 0 C--N 1.36 1.059 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.0 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.04 140.33 58.38 Favored 'General case' 0 CA--C 1.489 -1.366 0 C-N-CA 126.838 2.055 . . . . 0.0 107.945 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.65 162.6 41.06 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 118.32 -1.352 . . . . 0.0 109.062 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 104' ' ' ASN . 2.7 t -134.43 151.53 51.24 Favored 'General case' 0 C--O 1.199 -1.579 0 O-C-N 127.147 2.78 . . . . 0.0 104.421 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.456 ' HB3' ' HD3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -141.53 30.99 1.69 Allowed 'General case' 0 CA--C 1.496 -1.11 0 CA-C-O 123.768 1.747 . . . . 0.0 114.506 -179.237 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 119.38 -61.15 0.49 Allowed Glycine 0 C--O 1.223 -0.541 0 CA-C-N 109.732 -3.394 . . . . 0.0 113.587 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -162.75 69.87 0.26 Allowed 'General case' 0 C--O 1.205 -1.271 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.447 ' C ' HG12 ' A' ' 126' ' ' VAL . 7.2 tp60 -140.71 -49.95 0.44 Allowed 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 110.659 -2.973 . . . . 0.0 109.85 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 126' ' ' VAL . 2.4 p 49.1 87.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.131 1 O-C-N 131.55 5.531 . . . . 0.0 112.337 -179.676 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -72.34 126.9 30.97 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 112.528 -2.124 . . . . 0.0 109.728 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 6.2 mmt85 -106.69 80.39 1.45 Allowed 'General case' 0 CA--C 1.484 -1.578 0 O-C-N 125.762 1.913 . . . . 0.0 112.37 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.11 161.71 2.28 Favored 'General case' 0 C--N 1.35 0.617 0 O-C-N 127.396 2.935 . . . . 0.0 114.548 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -152.42 109.32 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.211 0 CA-C-O 126.449 3.023 . . . . 0.0 104.838 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.594 ' CZ ' ' HG3' ' A' ' 11' ' ' MET . 4.2 m-85 -109.69 174.28 5.94 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-N 108.859 -3.791 . . . . 0.0 116.743 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -154.47 125.38 7.17 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 110.821 -2.9 . . . . 0.0 104.508 179.637 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.531 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 18.8 ttpt -70.63 116.05 10.51 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 128.206 3.441 . . . . 0.0 109.72 178.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.461 ' HB3' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.486 -1.513 0 N-CA-C 118.038 2.607 . . . . 0.0 118.038 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.1 mttt . . . . . 0 N--CA 1.443 -0.792 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 57.97 89.44 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 124.428 2.061 . . . . 0.0 108.142 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -148.96 47.21 1.0 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 112.945 -1.934 . . . . 0.0 107.633 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.24 148.88 0.11 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 127.409 2.943 . . . . 0.0 113.082 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.3 174.96 40.04 Favored Glycine 0 C--O 1.223 -0.567 0 CA-C-N 110.969 -2.832 . . . . 0.0 112.77 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.434 HG22 ' HG3' ' A' ' 134' ' ' LYS . 0.4 OUTLIER -116.77 136.87 52.62 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 130.104 4.061 . . . . 0.0 103.877 179.759 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.531 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.274 0.0 OUTLIER -138.88 100.2 3.98 Favored 'General case' 0 CA--C 1.495 -1.143 0 O-C-N 128.564 3.665 . . . . 0.0 112.085 -179.595 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.21 -24.4 0.46 Allowed 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 115.685 -2.102 . . . . 0.0 114.972 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.464 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 3.5 ttm 83.32 -67.58 0.07 Allowed 'General case' 0 C--O 1.244 0.813 0 O-C-N 128.364 3.54 . . . . 0.0 106.072 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.402 ' CB ' ' O ' ' A' ' 11' ' ' MET . 36.0 tt0 108.08 -44.77 0.0 OUTLIER 'General case' 0 C--O 1.206 -1.222 1 O-C-N 130.364 4.79 . . . . 0.0 111.231 179.887 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 177.39 153.64 0.26 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 109.004 -3.725 . . . . 0.0 110.73 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -123.69 134.71 53.68 Favored 'General case' 0 CA--C 1.486 -1.502 0 CA-C-N 111.809 -2.451 . . . . 0.0 111.943 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -73.27 -176.56 2.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 128.936 3.898 . . . . 0.0 111.572 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -9.54 80.73 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.082 0 CA-C-O 124.648 2.166 . . . . 0.0 115.479 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.532 ' CD2' ' HA ' ' A' ' 35' ' ' VAL . 8.3 t80 -80.94 -31.92 34.77 Favored 'General case' 0 C--O 1.203 -1.379 0 CA-C-N 110.038 -3.255 . . . . 0.0 110.258 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -78.24 -49.4 13.82 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 110.725 -2.943 . . . . 0.0 112.905 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.428 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -60.95 -21.59 59.12 Favored Glycine 0 C--N 1.342 0.915 0 O-C-N 127.92 3.262 . . . . 0.0 111.723 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.434 ' CE1' HD11 ' A' ' 120' ' ' LEU . 0.3 OUTLIER -75.24 -39.34 59.98 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 127.399 2.47 . . . . 0.0 105.701 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . 0.251 31.9 mtt -79.74 -23.96 41.91 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 112.533 -2.121 . . . . 0.0 111.631 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.428 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 9.4 ttpt -76.99 -23.84 52.27 Favored 'General case' 0 C--N 1.313 -1.007 0 O-C-N 128.798 3.811 . . . . 0.0 113.102 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -72.05 -54.62 9.29 Favored 'General case' 0 C--O 1.201 -1.451 1 O-C-N 129.906 4.504 . . . . 0.0 109.453 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.856 HD11 ' HB ' ' A' ' 26' ' ' ILE . 0.4 OUTLIER -74.33 -18.93 60.63 Favored 'General case' 0 N--CA 1.488 1.457 1 O-C-N 129.809 4.443 . . . . 0.0 106.237 -179.984 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 45.34 84.33 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.363 0 CA-C-O 126.441 3.02 . . . . 0.0 106.705 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.856 ' HB ' HD11 ' A' ' 24' ' ' LEU . 9.9 tt -94.8 -30.26 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.531 1 CA-C-N 107.866 -4.243 . . . . 0.0 115.353 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -168.55 -175.74 2.58 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 118.345 -2.722 . . . . 0.0 109.997 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -127.52 115.5 18.94 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 63.81 41.46 6.82 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.871 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.11 -5.13 50.97 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 128.725 3.766 . . . . 0.0 110.648 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -75.94 -162.8 0.24 Allowed 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 128.647 2.779 . . . . 0.0 109.236 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HG2' HG13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER 77.46 4.75 3.1 Favored 'General case' 0 CA--C 1.485 -1.549 0 O-C-N 127.424 2.953 . . . . 0.0 114.133 179.553 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.473 ' O ' HD22 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -147.71 -73.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-N 113.416 -1.72 . . . . 0.0 113.43 179.418 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.695 ' HA ' HD21 ' A' ' 37' ' ' LEU . . . -48.98 -19.85 0.45 Allowed 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.532 ' HA ' ' CD2' ' A' ' 17' ' ' PHE . 53.7 t -26.48 -48.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.584 0 O-C-N 126.463 2.352 . . . . 0.0 109.841 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.658 ' C ' HD23 ' A' ' 37' ' ' LEU . 4.6 tpp180 164.54 125.58 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.376 2 O-C-N 131.145 5.278 . . . . 0.0 111.41 178.938 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.711 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -142.42 85.45 1.91 Allowed 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 110.006 -3.27 . . . . 0.0 104.994 -179.9 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m 87.85 120.81 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.896 1 O-C-N 135.346 7.904 . . . . 0.0 110.689 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.464 ' HG2' ' CB ' ' A' ' 11' ' ' MET . 46.4 tp60 -135.8 141.72 44.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 120.513 1.506 . . . . 0.0 110.821 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 40' ' ' THR . 99.3 m -168.99 80.74 0.13 Allowed 'General case' 0 C--O 1.212 -0.879 2 O-C-N 132.258 5.974 . . . . 0.0 112.364 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.93 144.85 54.06 Favored 'General case' 0 N--CA 1.485 1.321 1 O-C-N 129.674 4.359 . . . . 0.0 103.415 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.488 ' N ' ' O ' ' A' ' 53' ' ' LYS . 4.2 mt -138.54 103.6 2.27 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.438 0 CA-C-O 124.087 1.899 . . . . 0.0 115.387 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.589 ' CD1' ' CE1' ' A' ' 50' ' ' PHE 0.289 0.3 OUTLIER -88.17 141.04 14.86 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 1 CA-C-N 107.753 -4.294 . . . . 0.0 108.81 179.8 . . . . . . . . 5 4 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.7 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.1 t -124.8 -66.5 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.367 0 CA-C-N 111.898 -2.41 . . . . 0.0 114.445 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.7 ' N ' HG12 ' A' ' 44' ' ' VAL . 9.6 mt-30 64.39 123.38 0.02 OUTLIER 'General case' 0 CA--C 1.488 -1.424 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -152.01 37.97 0.57 Allowed 'General case' 0 CA--C 1.489 -1.384 0 C-N-CA 114.563 -2.855 . . . . 0.0 116.362 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.0 93.22 0.54 Allowed Glycine 0 C--O 1.201 -1.954 0 CA-C-N 118.985 0.811 . . . . 0.0 111.575 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 53.22 43.92 30.9 Favored 'General case' 0 CA--C 1.507 -0.698 0 O-C-N 128.066 2.862 . . . . 0.0 113.449 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 179.68 96.06 0.02 OUTLIER 'General case' 0 C--O 1.232 0.175 1 O-C-N 129.465 4.228 . . . . 0.0 109.942 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.61 ' CD2' HD22 ' A' ' 94' ' ' LEU . 2.0 t80 -118.75 109.95 16.68 Favored 'General case' 0 CA--C 1.483 -1.613 1 O-C-N 130.094 4.621 . . . . 0.0 112.813 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 20.7 mttt -112.86 80.48 1.35 Allowed 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 118.951 2.945 . . . . 0.0 118.951 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.469 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -63.01 150.36 42.65 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 127.742 3.151 . . . . 0.0 105.668 179.072 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -159.14 133.36 7.71 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 115.845 -2.342 . . . . 0.0 110.502 -179.14 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.29 148.11 22.77 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 126.128 2.142 . . . . 0.0 111.006 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 t30 -112.16 48.35 0.99 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 127.305 2.878 . . . . 0.0 115.081 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.517 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 1.5 p -73.04 158.18 35.91 Favored 'General case' 0 N--CA 1.475 0.814 1 O-C-N 133.091 6.494 . . . . 0.0 105.166 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 57' ' ' THR . 1.0 OUTLIER -103.92 24.03 11.95 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 129.026 3.954 . . . . 0.0 107.141 179.51 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.568 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 14.5 p90 -137.36 -50.71 0.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.82 2.156 . . . . 0.0 116.82 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 -79.78 0.56 Allowed 'General case' 0 CA--C 1.503 -0.859 0 C-N-CA 115.238 -2.585 . . . . 0.0 116.781 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 64.82 67.9 0.53 Allowed 'General case' 0 C--O 1.2 -1.539 0 O-C-N 126.264 2.228 . . . . 0.0 108.883 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 -46.04 41.14 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 110.834 -2.894 . . . . 0.0 109.776 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 47.7 t0 74.24 122.13 0.04 OUTLIER 'General case' 0 CA--C 1.503 -0.838 1 O-C-N 130.437 4.836 . . . . 0.0 110.288 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 1.078 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 13.8 tp -77.14 47.45 0.55 Allowed 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.297 2.248 . . . . 0.0 112.028 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.464 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 54.8 t0 -63.08 96.88 0.1 Allowed 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 106.476 -1.676 . . . . 0.0 106.476 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -134.48 169.17 17.66 Favored 'General case' 0 N--CA 1.475 0.783 1 CA-C-O 129.828 4.632 . . . . 0.0 107.908 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.56 HG22 HG23 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -156.54 126.66 6.47 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 109.715 -3.402 . . . . 0.0 105.041 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.915 ' HA ' HG22 ' A' ' 87' ' ' VAL . 7.2 p -48.27 132.91 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 0 O-C-N 126.277 2.236 . . . . 0.0 116.15 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.14 -0.44 73.56 Favored Glycine 0 C--N 1.359 1.848 0 O-C-N 127.34 2.9 . . . . 0.0 116.943 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.56 HG23 HG22 ' A' ' 66' ' ' THR . 0.9 OUTLIER -65.08 -40.47 89.04 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 C-N-CA 118.398 -1.321 . . . . 0.0 109.565 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 65.12 88.41 0.11 Allowed 'General case' 0 C--N 1.361 1.096 0 O-C-N 128.337 3.523 . . . . 0.0 110.628 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.467 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.4 OUTLIER -70.44 75.94 0.56 Allowed 'General case' 0 C--O 1.216 -0.707 0 O-C-N 127.643 3.089 . . . . 0.0 110.743 -179.645 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -48.36 81.02 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 25.4 mt-10 60.47 -176.47 0.11 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 123.249 1.5 . . . . 0.0 107.9 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 47.7 t60 92.15 97.38 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 109.825 -3.352 . . . . 0.0 116.477 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.28 166.51 24.85 Favored 'General case' 0 C--O 1.198 -1.642 0 CA-C-N 112.111 -2.313 . . . . 0.0 108.925 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 172.07 -31.12 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 O-C-N 126.134 2.146 . . . . 0.0 113.187 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.7 -33.03 48.13 Favored Glycine 0 C--O 1.208 -1.511 0 N-CA-C 107.057 -2.417 . . . . 0.0 107.057 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.3 tp -140.68 101.49 4.09 Favored 'General case' 0 N--CA 1.448 -0.527 1 CA-C-N 107.427 -4.387 . . . . 0.0 115.399 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.794 ' HB2' HD13 ' A' ' 24' ' ' LEU . 23.4 t0 92.06 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.776 0 O-C-N 128.954 3.909 . . . . 0.0 113.489 179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.88 82.41 1.4 Allowed Glycine 0 N--CA 1.469 0.862 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.418 ' HB3' HG23 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -137.35 -170.4 2.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 111.476 -2.362 . . . . 0.0 109.663 -179.413 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.524 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 1.7 m120 -135.59 87.79 2.35 Favored 'General case' 0 C--O 1.202 -1.431 0 O-C-N 127.552 3.032 . . . . 0.0 106.723 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.954 HG22 ' HA2' ' A' ' 100' ' ' GLY . 94.8 t -119.19 142.79 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.557 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -178.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.45 73.83 0.24 Allowed 'General case' 0 C--O 1.218 -0.604 0 O-C-N 127.22 2.825 . . . . 0.0 108.1 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.467 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 18.5 m -76.92 70.61 3.36 Favored 'General case' 0 C--O 1.195 -1.793 0 CA-C-N 109.76 -3.382 . . . . 0.0 112.096 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 165.98 7.82 Favored 'General case' 0 C--O 1.214 -0.788 1 CA-C-N 107.459 -4.428 . . . . 0.0 113.659 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.915 HG22 ' HA ' ' A' ' 67' ' ' VAL . 0.3 OUTLIER -157.52 116.5 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.364 0 CA-C-N 112.467 -2.151 . . . . 0.0 108.625 179.772 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.826 ' HA ' HG23 ' A' ' 67' ' ' VAL . 0.5 OUTLIER -150.0 173.98 13.23 Favored 'General case' 0 CA--C 1.474 -1.946 0 CA-C-N 110.574 -3.012 . . . . 0.0 111.023 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.701 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.0 m95 -96.71 151.67 19.41 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-O 114.832 -2.509 . . . . 0.0 107.982 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.631 ' HB2' HG23 ' A' ' 95' ' ' VAL . 7.0 tp10 -100.67 -40.55 7.31 Favored 'General case' 0 C--O 1.199 -1.597 1 CA-C-O 131.663 5.506 . . . . 0.0 112.143 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 176.35 -48.6 0.11 Allowed Glycine 0 C--O 1.207 -1.548 0 CA-C-N 108.723 -3.853 . . . . 0.0 105.708 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.09 41.73 0.75 Allowed 'General case' 0 N--CA 1.444 -0.748 1 O-C-N 130.586 4.345 . . . . 0.0 110.656 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.447 HG22 ' HB3' ' A' ' 90' ' ' GLU . 0.6 OUTLIER -172.37 153.86 3.07 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 112.091 -2.322 . . . . 0.0 115.367 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.61 HD22 ' CD2' ' A' ' 50' ' ' PHE . 3.1 tp -88.9 93.96 9.77 Favored 'General case' 0 CA--C 1.481 -1.684 0 O-C-N 128.32 3.513 . . . . 0.0 118.561 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.653 HG13 ' NZ ' ' A' ' 108' ' ' LYS 0.341 53.0 t -89.61 114.75 28.03 Favored 'Isoleucine or valine' 0 C--N 1.358 0.977 0 CA-C-N 113.014 -1.903 . . . . 0.0 112.72 178.943 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 75.4 m -119.41 110.35 16.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 103.333 -2.84 . . . . 0.0 103.333 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.56 74.36 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.482 -1.639 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.51 ' HB2' ' HA2' ' A' ' 106' ' ' GLY . 0.1 OUTLIER -53.49 100.19 0.03 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.694 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.4 OUTLIER -97.88 88.3 4.24 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-N 110.647 -2.979 . . . . 0.0 113.745 -178.925 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.954 ' HA2' HG22 ' A' ' 83' ' ' VAL . . . -62.66 -86.56 0.05 OUTLIER Glycine 0 CA--C 1.534 1.223 0 N-CA-C 106.631 -2.588 . . . . 0.0 106.631 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 177.25 -57.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 128.369 3.04 . . . . 0.0 111.312 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -37.07 18.79 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 110.653 -2.976 . . . . 0.0 115.62 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.431 ' HG3' ' CZ ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -120.35 175.97 5.71 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 110.297 -3.138 . . . . 0.0 111.988 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.466 ' HB2' ' CG2' ' A' ' 121' ' ' THR . 0.0 OUTLIER -124.69 115.83 21.39 Favored 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.637 -4.801 . . . . 0.0 102.212 179.267 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.431 ' CZ ' ' HG3' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -115.39 24.8 11.32 Favored 'General case' 0 C--O 1.209 -1.06 0 O-C-N 128.256 3.473 . . . . 0.0 108.217 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.51 ' HA2' ' HB2' ' A' ' 98' ' ' GLN . . . -81.65 129.29 8.95 Favored Glycine 0 N--CA 1.427 -1.953 2 O-C-N 133.492 6.745 . . . . 0.0 115.15 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 1.078 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.258 0.0 OUTLIER -115.57 136.22 53.29 Favored 'General case' 0 C--O 1.202 -1.409 0 O-C-N 129.554 3.737 . . . . 0.0 108.419 177.746 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.653 ' NZ ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -153.03 174.59 13.98 Favored 'General case' 0 C--O 1.206 -1.23 1 O-C-N 129.432 4.208 . . . . 0.0 114.484 -178.634 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.413 ' NE2' HD23 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -134.01 162.54 31.78 Favored 'General case' 0 C--N 1.361 1.102 0 CA-C-N 110.518 -3.037 . . . . 0.0 109.445 -179.502 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.523 ' CZ3' ' HD3' ' A' ' 108' ' ' LYS . 0.4 OUTLIER -170.0 66.47 0.05 Allowed 'General case' 0 C--N 1.31 -1.116 1 O-C-N 131.711 5.632 . . . . 0.0 115.799 -179.931 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.552 HG22 HD21 ' A' ' 116' ' ' LEU . 39.7 t -17.84 99.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.269 0 C-N-CA 128.213 2.605 . . . . 0.0 114.896 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.509 ' HB2' ' CE1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -94.08 38.54 1.08 Allowed 'General case' 0 CA--C 1.49 -1.361 0 CA-C-N 111.819 -2.446 . . . . 0.0 116.317 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.7 -100.82 1.02 Allowed Glycine 0 C--O 1.213 -1.191 0 O-C-N 126.448 2.343 . . . . 0.0 118.065 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -107.01 12.6 28.47 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.894 2.553 . . . . 0.0 117.894 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.402 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 6.6 pttt -157.08 150.03 23.68 Favored 'General case' 0 C--N 1.314 -0.936 1 O-C-N 129.437 4.211 . . . . 0.0 109.192 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.552 HD21 HG22 ' A' ' 111' ' ' VAL . 0.4 OUTLIER -84.34 174.16 10.35 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 126.203 2.189 . . . . 0.0 112.776 179.619 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.509 ' CE1' ' HB2' ' A' ' 112' ' ' GLU . 11.4 m-85 -146.9 89.61 1.83 Allowed 'General case' 0 C--O 1.213 -0.833 0 C-N-CA 115.129 -2.628 . . . . 0.0 112.513 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 118' ' ' LEU . 11.2 mt -83.01 58.86 4.61 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 110.08 -3.236 . . . . 0.0 108.423 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -76.32 91.96 3.29 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 129.713 3.205 . . . . 0.0 111.531 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.434 HD11 ' CE1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -90.73 -179.12 5.45 Favored 'General case' 0 N--CA 1.489 1.504 1 O-C-N 129.367 4.167 . . . . 0.0 110.365 179.628 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.466 ' CG2' ' HB2' ' A' ' 104' ' ' ASN . 18.3 m -129.38 159.08 37.32 Favored 'General case' 0 CA--C 1.492 -1.271 0 O-C-N 127.274 2.859 . . . . 0.0 105.792 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.55 73.27 0.37 Allowed 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 126.738 3.161 . . . . 0.0 113.268 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 63.76 33.29 86.83 Favored Glycine 0 C--O 1.217 -0.909 0 CA-C-N 110.218 -3.174 . . . . 0.0 112.151 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 79.24 51.72 0.03 OUTLIER 'General case' 0 CA--C 1.492 -1.26 0 O-C-N 128.854 3.326 . . . . 0.0 112.43 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.513 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 2.1 mm100 -129.8 24.24 5.36 Favored 'General case' 0 C--O 1.217 -0.614 0 O-C-N 127.572 3.045 . . . . 0.0 106.773 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 126' ' ' VAL . 7.7 p -10.91 79.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 CA-C-N 108.734 -3.848 . . . . 0.0 115.864 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 16.7 t -65.04 151.07 46.95 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.794 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 96.63 3.45 Favored 'General case' 0 CA--C 1.5 -0.967 0 O-C-N 125.101 1.5 . . . . 0.0 112.989 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -73.14 170.2 15.42 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 113.906 -3.118 . . . . 0.0 111.402 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 89.8 t -140.61 140.32 33.95 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.552 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.402 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 14.9 m-85 -123.2 -177.66 3.75 Favored 'General case' 0 CA--C 1.477 -1.857 0 CA-C-N 109.994 -3.275 . . . . 0.0 116.86 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.317 2.9 tptt -167.94 107.77 0.55 Allowed 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 103.218 -2.882 . . . . 0.0 103.218 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.459 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 23.0 ttpt -57.53 93.3 0.01 OUTLIER 'General case' 0 C--O 1.195 -1.796 0 O-C-N 127.094 2.746 . . . . 0.0 112.126 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.434 ' HG3' HG22 ' A' ' 8' ' ' THR . 0.8 OUTLIER . . . . . 0 C--O 1.265 1.876 0 O-C-N 126.85 2.593 . . . . 0.0 114.028 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.547 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 17.3 pttp . . . . . 0 CA--C 1.503 -0.863 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -81.27 87.41 6.12 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 125.778 1.924 . . . . 0.0 107.024 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -117.84 138.71 51.91 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -125.51 77.7 1.67 Allowed 'General case' 0 C--N 1.317 -0.845 0 O-C-N 128.348 3.53 . . . . 0.0 111.6 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -125.64 -144.96 6.34 Favored Glycine 0 C--O 1.204 -1.733 0 CA-C-N 111.199 -2.728 . . . . 0.0 114.32 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.44 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -160.41 152.28 20.04 Favored 'General case' 0 N--CA 1.478 0.968 1 O-C-N 133.395 5.997 . . . . 0.0 104.898 179.974 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.679 ' CZ2' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -150.21 122.55 8.42 Favored 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.922 2.639 . . . . 0.0 117.13 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.45 95.52 10.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 126.678 2.486 . . . . 0.0 106.096 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.513 ' HB3' ' CD ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -33.85 -37.78 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 O-C-N 128.516 3.635 . . . . 0.0 106.236 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 78.97 -70.73 0.1 Allowed 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 125.43 2.538 . . . . 0.0 112.206 179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -134.39 169.69 16.86 Favored 'General case' 0 N--CA 1.433 -1.296 1 CA-C-N 108.175 -4.102 . . . . 0.0 107.809 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.409 ' OD1' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -146.47 137.79 24.44 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 108.471 -3.968 . . . . 0.0 112.251 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -79.63 -74.35 0.3 Allowed 'General case' 0 CA--C 1.505 -0.775 0 O-C-N 126.181 2.176 . . . . 0.0 109.033 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -96.87 140.76 30.94 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.796 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -144.05 -52.32 0.32 Allowed 'General case' 0 CA--C 1.491 -1.291 0 CA-C-N 112.488 -2.142 . . . . 0.0 111.179 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.403 ' N ' ' CG ' ' A' ' 17' ' ' PHE . 1.8 tm-20 -70.25 -48.95 54.63 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 124.484 1.114 . . . . 0.0 111.991 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.471 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -60.26 -22.19 58.03 Favored Glycine 0 CA--C 1.492 -1.376 1 O-C-N 129.219 4.074 . . . . 0.0 111.822 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.566 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -79.8 -38.53 32.81 Favored 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.545 ' HG3' ' CG2' ' A' ' 26' ' ' ILE 0.318 0.4 OUTLIER -70.37 -24.79 63.02 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 110.373 -3.103 . . . . 0.0 110.227 -179.598 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.471 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.53 -33.2 42.15 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 129.175 4.047 . . . . 0.0 112.697 179.705 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.45 ' HB2' ' HG2' ' A' ' 125' ' ' GLN . . . -61.59 -37.43 83.86 Favored 'General case' 0 C--O 1.207 -1.163 2 O-C-N 132.316 6.01 . . . . 0.0 113.979 -179.595 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.02 HD12 ' HB2' ' A' ' 79' ' ' ASP 0.351 2.3 mm? -74.87 -45.14 45.04 Favored 'General case' 0 C--O 1.211 -0.954 2 CA-C-N 106.38 -4.918 . . . . 0.0 109.041 -178.241 . . . . . . . . 4 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.27 12.1 t70 91.83 46.35 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.512 3 O-C-N 133.302 6.626 . . . . 0.0 112.809 -179.892 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.545 ' CG2' ' HG3' ' A' ' 21' ' ' MET . 0.6 OUTLIER -105.28 21.33 3.57 Favored 'Isoleucine or valine' 0 C--N 1.361 1.104 1 CA-C-N 107.525 -4.398 . . . . 0.0 111.259 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -87.38 147.27 25.53 Favored 'General case' 0 C--N 1.359 0.988 0 CA-C-N 111.704 -2.498 . . . . 0.0 110.598 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -176.3 43.21 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.672 0 O-C-N 127.189 2.806 . . . . 0.0 113.242 179.867 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 69.22 48.48 0.66 Allowed 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 126.067 2.841 . . . . 0.0 109.392 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.491 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.3 OUTLIER -96.89 -45.78 6.49 Favored 'General case' 0 C--N 1.361 1.089 1 CA-C-N 107.231 -4.532 . . . . 0.0 114.386 -179.993 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.491 ' N ' HG22 ' A' ' 30' ' ' THR . 0.1 OUTLIER -62.89 -179.6 0.29 Allowed 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 114.504 -2.665 . . . . 0.0 111.392 -179.638 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.17 11.09 3.57 Favored 'General case' 0 CA--C 1.488 -1.406 1 O-C-N 130.881 5.113 . . . . 0.0 112.433 179.934 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.6 mt -147.9 -51.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.019 1 O-C-N 132.516 6.135 . . . . 0.0 111.043 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.438 ' HA ' ' CD2' ' A' ' 37' ' ' LEU . . . -77.62 1.72 18.81 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.523 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 t -51.74 -29.85 11.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 124.036 1.874 . . . . 0.0 109.971 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.685 ' HD2' ' HB3' ' A' ' 39' ' ' GLN . 0.0 OUTLIER 164.89 133.83 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 109.011 -3.722 . . . . 0.0 111.258 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.837 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.7 OUTLIER -157.94 96.85 1.5 Allowed 'General case' 0 C--O 1.215 -0.724 2 O-C-N 130.045 4.591 . . . . 0.0 108.081 179.152 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.1 m 62.77 52.65 2.7 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 128.677 3.736 . . . . 0.0 109.863 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.685 ' HB3' ' HD2' ' A' ' 36' ' ' ARG . 11.4 tt0 -74.3 154.38 38.95 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 113.047 -1.888 . . . . 0.0 112.104 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.459 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 82.7 m 177.59 125.3 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.209 1 O-C-N 132.754 6.284 . . . . 0.0 111.847 179.698 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.447 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 8.5 tmtt? -112.74 142.46 45.33 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 127.23 2.831 . . . . 0.0 107.668 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.527 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.5 mp -131.6 159.85 42.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 127.456 2.973 . . . . 0.0 111.044 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.527 ' N ' HG22 ' A' ' 42' ' ' ILE 0.262 0.0 OUTLIER -131.41 150.74 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.604 0 CA-C-N 110.912 -2.858 . . . . 0.0 107.968 179.98 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.634 HG12 ' N ' ' A' ' 45' ' ' GLN . 1.2 t -132.4 -54.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.029 0 C-N-CA 116.544 -2.062 . . . . 0.0 116.102 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.634 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.0 OUTLIER 44.48 88.52 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 -179.754 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.71 45.9 0.98 Allowed 'General case' 0 N--CA 1.481 1.095 1 O-C-N 129.322 4.139 . . . . 0.0 114.622 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.58 93.42 0.36 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-O 117.8 -1.556 . . . . 0.0 113.61 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 75.49 -30.9 0.2 Allowed 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 117.527 2.417 . . . . 0.0 117.527 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 66' ' ' THR . 18.3 m-20 -109.11 100.98 10.07 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.415 2.686 . . . . 0.0 108.191 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.42 ' CE1' HG12 ' A' ' 43' ' ' ILE . 25.8 t80 -99.67 102.06 13.43 Favored 'General case' 0 C--N 1.311 -1.109 1 O-C-N 130.353 4.783 . . . . 0.0 115.059 -178.769 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -115.21 67.62 0.7 Allowed 'General case' 0 CA--C 1.493 -1.215 1 O-C-N 129.623 4.327 . . . . 0.0 117.797 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -58.52 125.88 25.22 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 127.694 3.121 . . . . 0.0 105.838 179.247 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -129.56 154.17 47.32 Favored 'General case' 0 CA--C 1.485 -1.535 0 O-C-N 128.503 3.627 . . . . 0.0 112.284 -178.081 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.507 HG23 ' H ' ' A' ' 56' ' ' SER . 0.6 OUTLIER -106.56 167.46 9.84 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 126.039 2.087 . . . . 0.0 109.938 179.875 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.507 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -137.93 39.56 2.35 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.507 ' H ' HG23 ' A' ' 54' ' ' THR . 14.7 m -75.5 154.32 36.98 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 128.437 3.586 . . . . 0.0 105.245 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.813 ' OG1' HD12 ' A' ' 37' ' ' LEU . 40.6 p -85.65 -1.51 57.23 Favored 'General case' 0 N--CA 1.481 1.091 1 O-C-N 131.285 5.366 . . . . 0.0 109.125 -179.848 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.837 ' HB3' HD11 ' A' ' 37' ' ' LEU . 2.5 p90 -118.21 -40.87 2.91 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.66 128.02 18.86 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 112.695 -2.048 . . . . 0.0 115.052 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -113.09 -161.75 0.77 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 128.677 3.735 . . . . 0.0 107.256 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 60.9 83.62 0.14 Allowed 'General case' 0 CA--C 1.504 -0.808 0 O-C-N 126.408 2.317 . . . . 0.0 110.194 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.19 -65.99 0.93 Allowed 'General case' 0 C--O 1.208 -1.114 0 O-C-N 126.749 2.53 . . . . 0.0 113.894 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 1.126 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 5.2 tp -136.82 41.87 2.49 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 118.455 2.761 . . . . 0.0 118.455 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.56 98.07 0.24 Allowed 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.543 ' CD2' HG21 ' A' ' 87' ' ' VAL . 5.9 m-85 -140.63 -178.36 5.49 Favored 'General case' 0 CA--C 1.488 -1.408 1 CA-C-O 129.427 4.442 . . . . 0.0 110.01 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.59 HG22 HG23 ' A' ' 69' ' ' VAL . 1.6 m -150.61 121.91 7.83 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 109.648 -3.433 . . . . 0.0 104.143 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.795 HG21 ' NE1' ' A' ' 89' ' ' TRP . 5.2 t -61.25 144.1 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 O-C-N 128.134 3.396 . . . . 0.0 116.59 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.95 15.97 61.12 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-N 108.94 -3.754 . . . . 0.0 117.201 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.59 HG23 HG22 ' A' ' 66' ' ' THR 0.269 11.1 t -81.07 -25.43 10.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 C-N-CA 119.044 -1.062 . . . . 0.0 109.344 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 67.86 77.6 0.25 Allowed 'General case' 0 C--N 1.364 1.208 0 O-C-N 129.06 3.975 . . . . 0.0 108.909 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.528 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.3 m-85 -60.51 99.0 0.07 Allowed 'General case' 0 C--N 1.355 0.811 0 O-C-N 127.497 2.998 . . . . 0.0 115.836 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.444 ' C ' ' HG3' ' A' ' 73' ' ' GLU . 74.2 m-20 -68.55 73.11 0.23 Allowed 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 112.358 -2.201 . . . . 0.0 111.352 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.493 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 6.7 mt-10 53.11 -156.51 0.18 Allowed 'General case' 0 CA--C 1.507 -0.683 0 CA-C-O 121.499 0.666 . . . . 0.0 112.339 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.8 m80 71.5 87.97 0.11 Allowed 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 124.763 2.221 . . . . 0.0 112.631 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -125.93 122.56 36.33 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-N 110.214 -3.175 . . . . 0.0 113.04 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.24 168.96 18.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 127.657 3.098 . . . . 0.0 112.254 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.13 34.63 64.52 Favored Glycine 0 C--O 1.207 -1.536 0 CA-C-N 111.782 -2.463 . . . . 0.0 107.845 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.52 ' O ' HD12 ' A' ' 26' ' ' ILE . 4.5 tp -167.45 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.51 -0.57 1 O-C-N 130.417 4.245 . . . . 0.0 116.501 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 1.02 ' HB2' HD12 ' A' ' 24' ' ' LEU . 7.7 t70 -155.17 -57.4 0.1 Allowed 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 116.197 -2.201 . . . . 0.0 113.055 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.63 76.86 1.31 Allowed Glycine 0 C--O 1.213 -1.169 0 O-C-N 126.104 2.127 . . . . 0.0 111.619 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.524 ' HG3' HG23 ' A' ' 83' ' ' VAL . 9.3 ptt180 -137.05 -156.91 0.73 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 111.342 -2.429 . . . . 0.0 111.168 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.493 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.5 OUTLIER -160.14 105.08 1.51 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 128.167 3.417 . . . . 0.0 108.488 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.524 HG23 ' HG3' ' A' ' 81' ' ' ARG . 12.8 t -144.27 135.33 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.2 0 N-CA-C 117.48 2.4 . . . . 0.0 117.48 -178.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.521 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -49.58 145.07 5.26 Favored 'General case' 0 N--CA 1.467 0.39 1 O-C-N 129.708 4.38 . . . . 0.0 106.266 178.183 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.528 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 78.3 m -150.42 66.14 0.95 Allowed 'General case' 0 C--O 1.201 -1.459 0 O-C-N 127.537 3.023 . . . . 0.0 115.251 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 6.0 tt -62.04 140.58 58.36 Favored 'General case' 0 N--CA 1.432 -1.373 1 CA-C-N 108.12 -4.127 . . . . 0.0 110.811 -179.765 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.543 HG21 ' CD2' ' A' ' 65' ' ' PHE . 3.9 t -132.39 135.98 56.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 C-N-CA 126.1 1.76 . . . . 0.0 108.414 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.47 ' HA ' ' CG1' ' A' ' 67' ' ' VAL . 9.7 t -159.81 156.67 27.89 Favored 'General case' 0 CA--C 1.473 -1.982 0 CA-C-O 124.462 2.077 . . . . 0.0 109.28 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.795 ' NE1' HG21 ' A' ' 67' ' ' VAL . 38.5 m95 -90.34 145.31 25.06 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-O 114.602 -2.618 . . . . 0.0 106.761 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.826 ' HB3' HG22 ' A' ' 93' ' ' THR . 7.0 tp10 -97.38 -8.53 29.32 Favored 'General case' 0 CA--C 1.489 -1.367 1 CA-C-O 129.462 4.458 . . . . 0.0 112.055 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.95 -19.17 11.22 Favored Glycine 0 C--O 1.2 -2.023 0 CA-C-N 108.731 -3.85 . . . . 0.0 106.097 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.498 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.8 OUTLIER -158.96 44.88 0.27 Allowed 'General case' 0 N--CA 1.431 -1.391 1 O-C-N 131.826 5.074 . . . . 0.0 111.766 179.978 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.826 HG22 ' HB3' ' A' ' 90' ' ' GLU . 15.1 t 164.1 144.88 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.916 2.561 . . . . 0.0 117.916 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.756 ' CD2' HD21 ' A' ' 63' ' ' LEU . 1.2 tp -87.55 83.17 7.28 Favored 'General case' 0 CA--C 1.504 -0.798 0 O-C-N 127.397 2.936 . . . . 0.0 114.907 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.479 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.355 73.8 t -81.03 127.63 39.38 Favored 'Isoleucine or valine' 0 C--N 1.351 0.672 1 O-C-N 129.285 4.116 . . . . 0.0 111.394 179.663 . . . . . . . . 4 3 . 1 . 007 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -139.23 141.39 37.87 Favored 'General case' 0 C--O 1.196 -1.749 0 N-CA-C 103.953 -2.61 . . . . 0.0 103.953 -179.019 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.2 t -121.87 91.13 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.736 0 N-CA-C 119.719 3.229 . . . . 0.0 119.719 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.441 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 17.4 mm-40 -65.97 97.84 0.39 Allowed 'General case' 0 C--N 1.361 1.072 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.521 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 1.1 tmtm? -39.29 -49.24 1.93 Allowed 'General case' 0 N--CA 1.48 1.075 0 O-C-N 128.507 3.629 . . . . 0.0 112.417 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.467 ' H ' ' CG1' ' A' ' 83' ' ' VAL . . . 87.4 133.97 4.1 Favored Glycine 0 C--O 1.206 -1.652 1 CA-C-O 128.076 4.153 . . . . 0.0 113.879 179.382 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.412 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -100.78 -46.36 5.17 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 108.955 -3.622 . . . . 0.0 107.607 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.412 ' CG ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -146.24 16.44 1.34 Allowed 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 127.798 2.439 . . . . 0.0 115.965 179.773 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.65 -178.73 7.54 Favored 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 125.859 1.664 . . . . 0.0 114.349 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.638 ' O ' HG22 ' A' ' 121' ' ' THR . 7.9 m120 -125.39 88.22 2.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 127.699 3.124 . . . . 0.0 102.827 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.639 HH21 HD13 ' A' ' 24' ' ' LEU . 57.9 mmt-85 -92.92 2.79 56.6 Favored 'General case' 0 C--O 1.212 -0.894 0 O-C-N 126.9 2.625 . . . . 0.0 113.427 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.417 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -37.98 99.44 0.01 OUTLIER Glycine 0 C--O 1.209 -1.41 2 O-C-N 131.974 5.796 . . . . 0.0 113.093 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 1.126 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.299 0.0 OUTLIER -108.63 126.8 53.36 Favored 'General case' 0 C--O 1.209 -1.032 0 O-C-N 128.954 3.385 . . . . 0.0 110.025 179.546 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -153.52 155.08 35.54 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 128.299 3.904 . . . . 0.0 113.809 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.494 ' HG2' ' CD2' ' A' ' 118' ' ' LEU . 0.9 OUTLIER -114.93 -179.42 3.62 Favored 'General case' 0 C--N 1.366 1.283 1 CA-C-N 108.006 -4.179 . . . . 0.0 109.562 -179.186 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.455 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.6 OUTLIER 174.55 77.86 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.509 1 O-C-N 132.017 5.823 . . . . 0.0 117.743 179.113 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 63.6 t -27.55 101.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.817 1 CA-C-O 128.61 4.053 . . . . 0.0 117.435 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -111.06 -179.79 3.83 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 112.257 -2.247 . . . . 0.0 111.852 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -25.8 73.94 0.0 OUTLIER Glycine 0 C--O 1.204 -1.742 0 C-N-CA 127.284 2.373 . . . . 0.0 116.633 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 43.25 68.45 0.51 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 127.674 2.39 . . . . 0.0 116.823 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.473 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 9.3 pttt 160.33 164.83 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.161 1 O-C-N 133.128 6.517 . . . . 0.0 108.33 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.679 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -105.14 151.55 23.89 Favored 'General case' 0 CA--C 1.478 -1.789 0 O-C-N 127.088 2.743 . . . . 0.0 113.544 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.586 ' H ' HD23 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -113.14 98.34 7.08 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 113.425 -1.716 . . . . 0.0 115.609 -179.768 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.494 ' CD2' ' HG2' ' A' ' 109' ' ' GLN . 8.3 mt -85.98 77.61 9.63 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 128.178 3.424 . . . . 0.0 107.593 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.455 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.4 mt-10 -88.81 95.24 10.21 Favored 'General case' 0 CA--C 1.494 -1.19 0 O-C-N 126.666 2.479 . . . . 0.0 111.434 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.576 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -110.79 166.11 11.29 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 127.307 2.879 . . . . 0.0 108.466 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.638 HG22 ' O ' ' A' ' 104' ' ' ASN . 20.2 m -122.18 156.35 33.89 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 110.498 -3.046 . . . . 0.0 105.259 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.8 OUTLIER -162.35 59.9 0.23 Allowed 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 125.283 2.468 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.44 32.93 14.82 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 113.426 -1.715 . . . . 0.0 113.478 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 73.11 28.03 1.94 Allowed 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 111.576 -2.312 . . . . 0.0 111.485 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.45 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -87.15 -28.06 22.68 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 110.896 -2.866 . . . . 0.0 108.165 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.431 ' O ' HG22 ' A' ' 126' ' ' VAL . 0.3 OUTLIER 45.81 119.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 1 O-C-N 131.38 5.425 . . . . 0.0 113.477 -179.766 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.1 t -112.19 120.51 42.04 Favored 'General case' 0 CA--C 1.5 -0.954 0 O-C-N 117.991 -2.943 . . . . 0.0 111.452 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 99.0 8.09 Favored 'General case' 0 CA--C 1.51 -0.578 0 O-C-N 127.105 2.753 . . . . 0.0 112.038 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -79.68 172.2 14.1 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 12.2 t -140.42 148.66 22.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 103.788 -2.671 . . . . 0.0 103.788 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.473 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 18.8 m-85 -138.24 -177.18 4.72 Favored 'General case' 0 CA--C 1.485 -1.534 0 CA-C-O 127.454 3.502 . . . . 0.0 116.797 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.277 9.2 tppt? -162.7 105.18 1.07 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 110.975 -2.83 . . . . 0.0 103.418 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 6.2 ttpt -68.59 78.39 0.28 Allowed 'General case' 0 C--O 1.201 -1.455 0 CA-C-N 111.969 -2.378 . . . . 0.0 113.496 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt . . . . . 0 CA--C 1.481 -1.677 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -179.939 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.517 ' HG2' ' CZ2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.583 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -71.2 -169.74 0.41 Allowed 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.399 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -164.95 148.54 8.65 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 104.451 -2.425 . . . . 0.0 104.451 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -46.16 158.3 0.1 Allowed 'General case' 0 C--N 1.313 -0.982 1 O-C-N 132.83 6.331 . . . . 0.0 116.566 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.77 -167.53 33.68 Favored Glycine 0 C--O 1.203 -1.828 0 O-C-N 127.332 2.895 . . . . 0.0 112.314 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.01 147.01 33.29 Favored 'General case' 0 C--N 1.316 -0.852 1 O-C-N 132.64 5.553 . . . . 0.0 107.801 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.84 ' CE3' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -140.56 130.1 24.08 Favored 'General case' 0 C--N 1.323 -0.548 1 O-C-N 133.282 6.614 . . . . 0.0 111.137 -179.644 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -86.47 -6.25 58.96 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 126.753 2.533 . . . . 0.0 115.332 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.476 ' HG3' ' CE1' ' A' ' 131' ' ' PHE . 19.8 ttm 54.88 85.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.678 0 O-C-N 125.073 1.483 . . . . 0.0 107.257 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -25.43 -38.01 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 131.034 3.734 . . . . 0.0 110.741 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 173.47 169.17 0.17 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 126.753 3.168 . . . . 0.0 111.513 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -104.88 160.86 14.67 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 108.653 -3.885 . . . . 0.0 114.757 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -122.97 -64.41 1.18 Allowed 'General case' 0 CA--C 1.494 -1.183 1 O-C-N 130.275 4.734 . . . . 0.0 113.978 179.79 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -127.22 85.9 2.43 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.681 -1.145 . . . . 0.0 113.872 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -43.44 7.62 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.687 3.117 . . . . 0.0 112.378 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.262 32.9 tt0 -79.6 -35.34 39.73 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 111.096 -2.775 . . . . 0.0 114.282 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -76.91 -22.73 71.05 Favored Glycine 0 N--CA 1.478 1.481 0 C-N-CA 115.301 -3.333 . . . . 0.0 110.917 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.527 ' CE1' HD11 ' A' ' 120' ' ' LEU . 8.9 t80 -62.4 -33.38 74.65 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 124.608 2.147 . . . . 0.0 108.522 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.478 ' HB3' ' CG2' ' A' ' 26' ' ' ILE 0.282 51.4 mtp -75.64 -26.05 57.4 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-N 112.876 -1.965 . . . . 0.0 108.63 -179.752 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -80.02 -29.05 39.31 Favored 'General case' 0 C--N 1.312 -1.057 0 O-C-N 125.511 1.757 . . . . 0.0 112.841 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.61 -46.23 84.35 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 111.061 -2.79 . . . . 0.0 113.925 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.827 HD11 ' HB ' ' A' ' 26' ' ' ILE . 4.0 pp -83.82 -27.12 28.99 Favored 'General case' 0 N--CA 1.48 1.043 1 O-C-N 130.029 4.581 . . . . 0.0 103.005 179.11 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 80.99 93.4 0.05 OUTLIER 'General case' 0 CA--C 1.483 -1.633 1 CA-C-O 129.486 4.469 . . . . 0.0 114.312 179.252 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.827 ' HB ' HD11 ' A' ' 24' ' ' LEU . 1.0 OUTLIER -134.23 20.78 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-O 127.415 3.483 . . . . 0.0 107.669 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.54 99.45 0.03 OUTLIER 'General case' 0 C--N 1.366 1.309 0 CA-C-N 112.27 -2.241 . . . . 0.0 113.516 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -132.98 16.01 4.22 Favored 'General case' 0 CA--C 1.488 -1.423 0 O-C-N 128.81 3.819 . . . . 0.0 112.144 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 48.6 38.65 11.69 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-O 126.321 2.962 . . . . 0.0 109.987 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.19 -11.17 33.38 Favored 'General case' 0 C--N 1.349 0.556 1 CA-C-N 108.326 -4.034 . . . . 0.0 112.092 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -102.31 -172.37 2.12 Favored 'General case' 0 C--O 1.222 -0.373 1 O-C-N 130.791 5.057 . . . . 0.0 110.872 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 91.6 -9.27 0.24 Allowed 'General case' 0 C--O 1.202 -1.428 1 O-C-N 131.312 5.383 . . . . 0.0 112.99 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.655 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.6 OUTLIER -125.79 4.16 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 O-C-N 128.238 3.461 . . . . 0.0 111.682 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -120.8 31.75 6.28 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 123.182 1.468 . . . . 0.0 108.488 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -41.19 -42.24 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.303 0 CA-C-N 110.739 -2.937 . . . . 0.0 111.242 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.734 ' C ' HD23 ' A' ' 37' ' ' LEU . 7.0 tmm_? 150.26 125.02 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.149 2 CA-C-N 107.472 -4.422 . . . . 0.0 113.07 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.914 HD11 ' CZ ' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -145.14 110.69 5.34 Favored 'General case' 0 N--CA 1.435 -1.178 1 O-C-N 129.428 4.205 . . . . 0.0 107.343 -179.961 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.7 m 75.94 25.43 1.11 Allowed 'General case' 0 CA--C 1.502 -0.9 1 O-C-N 132.991 6.432 . . . . 0.0 112.653 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.494 ' CB ' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -70.12 110.67 5.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.026 2.704 . . . . 0.0 116.23 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.4 m -137.58 101.67 4.55 Favored 'General case' 0 C--O 1.206 -1.189 1 O-C-N 129.178 4.049 . . . . 0.0 113.203 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.589 ' HZ1' HD11 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -77.72 139.75 39.44 Favored 'General case' 0 C--O 1.222 -0.372 0 O-C-N 126.671 2.482 . . . . 0.0 108.795 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.443 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.3 mp -125.15 161.45 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 126.509 2.38 . . . . 0.0 109.698 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.742 HD11 ' HE2' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -137.12 126.14 35.76 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.528 0 O-C-N 127.504 3.003 . . . . 0.0 110.439 -179.813 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.655 ' N ' HD13 ' A' ' 43' ' ' ILE . 93.8 t -129.48 86.67 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 112.443 -2.162 . . . . 0.0 111.128 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.61 140.41 32.07 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 127.107 2.754 . . . . 0.0 112.199 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -151.7 31.95 0.57 Allowed 'General case' 0 CA--C 1.488 -1.408 1 CA-C-N 107.435 -4.438 . . . . 0.0 117.41 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.92 -70.07 1.35 Allowed Glycine 0 C--O 1.205 -1.682 0 O-C-N 119.941 -1.724 . . . . 0.0 111.29 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.61 98.28 3.65 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 129.159 3.505 . . . . 0.0 110.695 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.451 ' ND2' ' HE2' ' A' ' 51' ' ' LYS . 42.1 t30 116.66 79.68 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.604 1 O-C-N 129.577 4.298 . . . . 0.0 108.463 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.742 ' HE2' HD11 ' A' ' 43' ' ' ILE . 7.6 t80 -90.5 125.96 35.76 Favored 'General case' 0 C--N 1.313 -1.004 1 O-C-N 131.974 5.797 . . . . 0.0 110.08 179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.451 ' HE2' ' ND2' ' A' ' 49' ' ' ASN . 2.8 mttt -137.05 80.08 1.79 Allowed 'General case' 0 CA--C 1.492 -1.259 0 O-C-N 128.267 3.479 . . . . 0.0 119.027 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.517 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -60.3 157.64 13.23 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 128.397 3.561 . . . . 0.0 107.053 179.476 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 62' ' ' ASP . 0.3 OUTLIER -167.64 141.56 3.54 Favored 'General case' 0 CA--C 1.487 -1.454 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.571 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.53 161.32 14.41 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.617 1.198 . . . . 0.0 111.258 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -128.59 28.72 5.38 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 116.219 1.933 . . . . 0.0 116.219 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 91.0 p -64.3 145.83 55.39 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 128.65 3.719 . . . . 0.0 105.102 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.8 m -64.82 -27.35 68.82 Favored 'General case' 0 N--CA 1.469 0.496 1 O-C-N 132.101 5.876 . . . . 0.0 107.46 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.914 ' CZ ' HD11 ' A' ' 37' ' ' LEU . 4.3 m-30 -82.21 -79.02 0.19 Allowed 'General case' 0 C--O 1.239 0.543 0 O-C-N 128.799 3.812 . . . . 0.0 117.615 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -115.8 88.58 2.91 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 127.603 3.064 . . . . 0.0 115.269 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -92.47 63.3 4.1 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.221 4.076 . . . . 0.0 110.636 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -88.57 111.79 22.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 111.772 -2.467 . . . . 0.0 109.394 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 17.5 p30 -77.64 161.87 27.47 Favored 'General case' 0 C--O 1.204 -1.294 0 O-C-N 127.437 2.961 . . . . 0.0 115.717 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.517 ' HB2' HG22 ' A' ' 52' ' ' THR . 12.4 tp -106.8 45.41 0.98 Allowed 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 112.697 -2.047 . . . . 0.0 111.554 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -71.59 95.0 1.37 Allowed 'General case' 0 C--O 1.203 -1.382 1 O-C-N 129.285 4.116 . . . . 0.0 110.704 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.681 ' CE2' HG22 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -159.57 132.29 6.74 Favored 'General case' 0 CA--C 1.483 -1.606 1 CA-C-O 131.111 5.243 . . . . 0.0 112.912 179.93 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.481 HG23 ' N ' ' A' ' 67' ' ' VAL . 0.4 OUTLIER -85.83 172.04 11.07 Favored 'General case' 0 C--O 1.21 -1.012 0 O-C-N 116.835 -3.666 . . . . 0.0 110.32 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.935 HG21 ' CD1' ' A' ' 89' ' ' TRP . 10.3 t -82.12 136.02 23.8 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.909 0 O-C-N 127.86 3.225 . . . . 0.0 112.916 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.56 5.85 19.48 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.687 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.427 HG11 ' HD1' ' A' ' 71' ' ' PHE . 8.2 p -60.87 -20.93 22.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.192 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 58.14 72.58 0.51 Allowed 'General case' 0 C--N 1.353 0.718 1 O-C-N 130.344 4.777 . . . . 0.0 109.047 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.58 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.4 OUTLIER -66.88 141.42 57.66 Favored 'General case' 0 CA--C 1.493 -1.24 2 CA-C-N 106.648 -4.796 . . . . 0.0 118.254 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -120.91 63.47 0.87 Allowed 'General case' 0 CA--C 1.485 -1.533 0 CA-C-O 124.21 1.957 . . . . 0.0 113.541 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -55.18 143.13 28.57 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-O 125.081 2.372 . . . . 0.0 108.514 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -111.32 18.69 19.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 112.972 -1.922 . . . . 0.0 115.789 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 16.73 98.77 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.06 0 O-C-N 127.095 2.747 . . . . 0.0 115.956 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.84 146.07 27.79 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 128.116 3.385 . . . . 0.0 115.479 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.16 -32.1 7.98 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-N 110.04 -3.255 . . . . 0.0 110.666 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.565 ' O ' HD12 ' A' ' 26' ' ' ILE . 7.2 tp -117.86 -4.23 11.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 129.617 3.775 . . . . 0.0 116.655 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.433 ' HB3' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -159.75 -72.43 0.08 Allowed 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 118.296 -1.361 . . . . 0.0 114.361 -179.879 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.21 84.88 1.79 Allowed Glycine 0 N--CA 1.466 0.688 0 CA-C-O 122.188 0.882 . . . . 0.0 111.273 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.446 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.0 OUTLIER -148.87 -127.32 0.05 Allowed 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.861 -2.17 . . . . 0.0 114.716 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.446 ' ND2' ' O ' ' A' ' 81' ' ' ARG . 3.3 p30 164.43 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 124.533 1.145 . . . . 0.0 110.069 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.439 HG13 ' HA2' ' A' ' 100' ' ' GLY . 0.8 OUTLIER -146.59 165.92 7.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.798 0 N-CA-C 117.443 2.386 . . . . 0.0 117.443 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.482 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -74.82 167.7 21.33 Favored 'General case' 0 C--O 1.241 0.628 2 O-C-N 132.58 6.175 . . . . 0.0 107.715 179.458 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.58 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.2 m -173.4 86.69 0.06 Allowed 'General case' 0 C--O 1.194 -1.828 1 O-C-N 130.197 4.685 . . . . 0.0 111.1 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 110.18 21.56 Favored 'General case' 0 N--CA 1.43 -1.444 1 CA-C-N 106.862 -4.699 . . . . 0.0 116.874 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.681 HG22 ' CE2' ' A' ' 65' ' ' PHE . 17.6 t -80.77 150.59 4.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 CA-C-N 111.859 -2.428 . . . . 0.0 108.667 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.287 22.3 m -160.14 145.77 15.28 Favored 'General case' 0 CA--C 1.474 -1.962 0 CA-C-N 112.608 -2.087 . . . . 0.0 109.964 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.935 ' CD1' HG21 ' A' ' 67' ' ' VAL . 8.9 m95 -85.69 129.09 34.91 Favored 'General case' 0 C--N 1.357 0.899 0 CA-C-O 113.696 -3.05 . . . . 0.0 105.461 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.544 ' HB3' HG21 ' A' ' 93' ' ' THR . 0.5 OUTLIER -99.33 -9.53 23.43 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 127.224 3.392 . . . . 0.0 116.243 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 147.34 -78.2 0.24 Allowed Glycine 0 C--O 1.194 -2.363 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.486 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -134.75 100.5 4.63 Favored 'General case' 0 C--O 1.195 -1.788 1 O-C-N 131.502 4.884 . . . . 0.0 103.265 179.591 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.544 HG21 ' HB3' ' A' ' 90' ' ' GLU . 4.5 t 166.42 -131.87 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 127.478 2.986 . . . . 0.0 113.132 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.587 HD22 ' CE1' ' A' ' 50' ' ' PHE 0.292 1.2 tp 166.19 70.03 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 129.697 3.199 . . . . 0.0 113.925 179.465 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.36 45.5 t -74.66 132.72 32.9 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 N-CA-C 118.586 2.81 . . . . 0.0 118.586 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -137.72 129.67 28.78 Favored 'General case' 0 C--O 1.199 -1.56 0 N-CA-C 103.05 -2.944 . . . . 0.0 103.05 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.2 t -104.37 99.62 8.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 C-N-CA 127.254 2.222 . . . . 0.0 116.527 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.84 93.14 5.58 Favored 'General case' 0 C--N 1.36 1.022 0 CA-C-O 125.398 2.523 . . . . 0.0 110.682 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.482 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -75.55 87.35 2.66 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 111.89 -2.413 . . . . 0.0 111.089 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.439 ' HA2' HG13 ' A' ' 83' ' ' VAL . . . -118.66 165.65 12.94 Favored Glycine 0 C--O 1.209 -1.432 1 CA-C-O 128.566 4.425 . . . . 0.0 113.823 -179.671 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -129.89 109.48 10.94 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 109.98 -3.11 . . . . 0.0 110.798 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? 125.89 -36.25 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.291 0 O-C-N 127.708 3.13 . . . . 0.0 110.881 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.18 156.24 43.28 Favored 'General case' 0 C--O 1.199 -1.587 1 CA-C-N 107.83 -4.259 . . . . 0.0 113.393 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -115.29 118.53 33.53 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 109.868 -3.333 . . . . 0.0 103.537 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 122' ' ' CYS . 6.5 mmt85 -110.91 11.84 22.27 Favored 'General case' 0 C--O 1.213 -0.835 1 O-C-N 129.746 4.404 . . . . 0.0 109.523 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -51.81 92.85 0.01 OUTLIER Glycine 0 N--CA 1.429 -1.789 2 CA-C-N 106.814 -4.721 . . . . 0.0 111.929 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.44 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.262 0.0 OUTLIER -107.43 143.14 36.19 Favored 'General case' 0 C--O 1.206 -1.214 1 O-C-N 130.786 4.463 . . . . 0.0 109.904 179.662 . . . . . . . . 5 4 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.524 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 2.3 ptpt -158.14 172.22 18.8 Favored 'General case' 0 CA--C 1.507 -0.705 1 O-C-N 132.095 5.872 . . . . 0.0 114.43 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.682 ' NE2' HD22 ' A' ' 118' ' ' LEU . 0.0 OUTLIER -122.44 176.69 5.75 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 113.86 -2.971 . . . . 0.0 105.0 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.524 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 20.0 m95 -133.28 -55.64 0.91 Allowed 'General case' 0 C--N 1.311 -1.075 0 O-C-N 125.988 2.055 . . . . 0.0 112.001 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.535 HG23 ' HA ' ' A' ' 93' ' ' THR . 10.8 t 87.37 57.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.777 1 CA-C-O 130.222 4.82 . . . . 0.0 110.134 -176.598 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.95 67.55 1.27 Allowed 'General case' 0 CA--C 1.478 -1.812 1 CA-C-N 107.006 -4.634 . . . . 0.0 117.757 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 87.83 -88.39 1.56 Allowed Glycine 0 C--O 1.202 -1.887 0 N-CA-C 117.527 1.771 . . . . 0.0 117.527 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.474 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 74.5 m-20 -100.94 -23.9 14.45 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 118.962 2.949 . . . . 0.0 118.962 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.474 ' HE2' ' HB2' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -130.72 -168.45 1.99 Allowed 'General case' 0 CA--C 1.499 -0.981 1 O-C-N 130.205 4.691 . . . . 0.0 110.199 179.987 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.84 HD22 ' CE3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -146.31 94.66 2.49 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 128.123 3.821 . . . . 0.0 111.156 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.14 124.47 20.07 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 109.145 -3.662 . . . . 0.0 110.47 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.682 HD22 ' NE2' ' A' ' 109' ' ' GLN . 2.6 mt -95.2 72.2 3.32 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 127.539 3.024 . . . . 0.0 108.882 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -71.39 91.89 1.04 Allowed 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 128.964 3.915 . . . . 0.0 110.909 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.658 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -102.87 160.4 14.64 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 114.26 -1.336 . . . . 0.0 107.55 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.658 ' O ' HD12 ' A' ' 120' ' ' LEU . 4.7 m -124.17 168.73 12.53 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.365 1.666 . . . . 0.0 110.799 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.475 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 10.3 t -167.8 50.8 0.06 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 126.347 2.975 . . . . 0.0 110.38 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 103.29 6.91 44.22 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 112.244 -2.253 . . . . 0.0 112.284 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.9 t0 100.57 28.45 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.058 0 O-C-N 128.523 3.131 . . . . 0.0 112.299 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -85.36 -17.27 37.23 Favored 'General case' 0 C--O 1.206 -1.188 0 C-N-CA 114.207 -2.997 . . . . 0.0 105.468 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 33.3 85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 O-C-N 129.051 3.969 . . . . 0.0 113.284 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 77.0 m -59.44 152.48 21.46 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.18 70.95 1.46 Allowed 'General case' 0 CA--C 1.486 -1.501 0 CA-C-O 124.374 2.035 . . . . 0.0 112.604 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -57.49 170.51 0.53 Allowed 'General case' 0 C--N 1.358 0.936 0 C-N-CA 116.611 -2.035 . . . . 0.0 111.695 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 11.5 t -141.62 105.03 1.4 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.295 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.476 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 12.0 m-85 -99.28 162.37 13.09 Favored 'General case' 0 CA--C 1.494 -1.204 1 CA-C-N 108.111 -4.131 . . . . 0.0 117.628 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.452 ' C ' ' HD2' ' A' ' 132' ' ' LYS 0.384 0.0 OUTLIER -147.82 129.44 15.04 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 110.579 -3.01 . . . . 0.0 104.471 179.989 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.516 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 17.0 tttm -68.53 122.62 18.85 Favored 'General case' 0 C--O 1.198 -1.606 0 O-C-N 127.406 2.941 . . . . 0.0 110.997 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.245 0.861 0 CA-C-O 115.932 -1.985 . . . . 0.0 115.028 -179.906 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.491 -1.3 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.48 136.63 53.51 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.5 -2.778 . . . . 0.0 103.5 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.502 ' HA ' ' HB3' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -178.83 154.14 0.7 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 114.875 -2.488 . . . . 0.0 105.262 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 24.29 108.67 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.712 1 O-C-N 133.398 6.686 . . . . 0.0 116.934 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.511 ' N ' HG22 ' A' ' 43' ' ' ILE . . . -177.22 147.86 8.52 Favored Glycine 0 C--O 1.211 -1.296 0 CA-C-N 113.411 -1.722 . . . . 0.0 113.333 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.676 HG22 HG23 ' A' ' 42' ' ' ILE . 62.7 p -124.7 63.39 1.12 Allowed 'General case' 0 C--O 1.201 -1.451 0 O-C-N 127.228 2.369 . . . . 0.0 105.813 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.625 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -62.77 128.1 34.34 Favored 'General case' 0 N--CA 1.451 -0.421 1 O-C-N 130.838 5.086 . . . . 0.0 111.282 -179.672 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -77.41 -12.06 59.91 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.483 ' HB2' ' HE3' ' A' ' 11' ' ' MET . 37.6 ttm 54.53 74.97 0.32 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 105.439 -2.059 . . . . 0.0 105.439 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.538 ' HG3' ' HG2' ' A' ' 132' ' ' LYS . 91.3 mt-10 -47.77 -51.9 20.67 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 127.01 2.694 . . . . 0.0 109.883 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.96 154.54 42.03 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 111.511 -2.586 . . . . 0.0 111.356 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.528 HD22 ' HD1' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -134.58 141.12 46.55 Favored 'General case' 0 CA--C 1.483 -1.63 0 O-C-N 128.49 3.619 . . . . 0.0 111.403 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -77.21 -169.81 1.5 Allowed 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 112.661 -2.063 . . . . 0.0 114.085 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -30.1 100.42 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.386 0 C-N-CA 127.108 2.163 . . . . 0.0 114.326 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.528 ' HD1' HD22 ' A' ' 14' ' ' ASN . 1.0 OUTLIER -96.91 -24.8 15.68 Favored 'General case' 0 C--O 1.204 -1.299 0 O-C-N 125.791 1.932 . . . . 0.0 109.547 -179.492 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -76.67 -37.6 55.93 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 113.45 -1.704 . . . . 0.0 112.762 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.7 -24.62 60.03 Favored Glycine 0 N--CA 1.487 2.048 0 C-N-CA 115.951 -3.023 . . . . 0.0 106.547 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.529 ' O ' HD23 ' A' ' 24' ' ' LEU . 1.1 t80 -68.58 -27.77 66.35 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-O 127.236 3.398 . . . . 0.0 108.488 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.569 ' HG2' HG22 ' A' ' 26' ' ' ILE . 3.5 ttt -70.22 -33.57 71.83 Favored 'General case' 0 CA--C 1.488 -1.442 0 CA-C-N 112.704 -2.044 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.9 mtmt -77.0 -21.76 54.16 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 109.177 -3.647 . . . . 0.0 115.987 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.01 -46.49 74.34 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 127.637 3.085 . . . . 0.0 113.456 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.609 HD11 ' HB ' ' A' ' 26' ' ' ILE . 0.5 OUTLIER -96.77 -9.91 27.86 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 128.593 3.683 . . . . 0.0 108.176 -179.71 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t0 38.75 93.78 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.436 1 CA-C-O 129.296 4.379 . . . . 0.0 112.078 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.609 ' HB ' HD11 ' A' ' 24' ' ' LEU . 14.0 tt -105.3 39.38 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 108.684 -3.871 . . . . 0.0 108.525 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.4 t70 81.83 144.77 0.08 Allowed 'General case' 0 C--N 1.352 0.676 0 CA-C-O 116.485 -1.722 . . . . 0.0 108.658 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -96.71 155.57 16.72 Favored 'General case' 0 C--O 1.204 -1.301 1 O-C-N 129.389 4.181 . . . . 0.0 115.746 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.3 77.84 0.29 Allowed 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 111.951 -2.386 . . . . 0.0 105.268 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.6 m -137.62 -61.07 0.64 Allowed 'General case' 0 C--N 1.354 0.791 2 CA-C-N 105.502 -5.317 . . . . 0.0 116.135 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HD3' ' N ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -69.98 -155.05 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.986 0 O-C-N 128.419 3.574 . . . . 0.0 114.423 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.424 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.1 OUTLIER 89.33 -2.77 0.38 Allowed 'General case' 0 C--O 1.204 -1.34 1 O-C-N 130.502 4.876 . . . . 0.0 111.293 -179.722 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.409 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.8 OUTLIER -149.92 35.92 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.671 0 CA-C-N 110.436 -3.075 . . . . 0.0 109.033 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -141.6 35.32 1.63 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 126.025 2.822 . . . . 0.0 108.573 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -53.71 -34.27 24.31 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.457 0 CA-C-N 110.564 -3.017 . . . . 0.0 110.327 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.706 ' C ' HD23 ' A' ' 37' ' ' LEU . 16.1 ttp85 158.0 131.52 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.35 1 CA-C-N 107.488 -4.414 . . . . 0.0 111.584 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.06 HD21 ' CE2' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -130.44 83.9 2.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.543 -3.026 . . . . 0.0 105.65 -179.253 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 m 70.14 -21.07 0.18 Allowed 'General case' 0 C--N 1.317 -0.814 1 O-C-N 134.123 7.139 . . . . 0.0 117.436 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -13.74 92.18 0.01 OUTLIER 'General case' 0 CA--C 1.492 -1.251 0 O-C-N 127.773 3.171 . . . . 0.0 118.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -99.58 101.81 13.13 Favored 'General case' 0 C--O 1.203 -1.375 1 O-C-N 133.443 6.714 . . . . 0.0 109.182 179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.535 ' HE3' HD22 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -81.57 131.64 35.28 Favored 'General case' 0 N--CA 1.485 1.291 1 O-C-N 129.152 4.033 . . . . 0.0 109.6 -179.353 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.676 HG23 HG22 ' A' ' 8' ' ' THR . 8.1 mt -117.82 158.67 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 127.19 2.806 . . . . 0.0 109.814 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.511 HG22 ' N ' ' A' ' 7' ' ' GLY 0.28 0.0 OUTLIER -140.17 146.95 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.444 1 O-C-N 129.123 4.014 . . . . 0.0 109.117 -179.752 . . . . . . . . 5 4 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.454 ' N ' ' O ' ' A' ' 51' ' ' LYS . 79.6 t -153.14 85.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.1 0 CA-C-N 113.204 -1.816 . . . . 0.0 108.299 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.502 ' HB3' ' HA ' ' A' ' 5' ' ' GLN . 0.3 OUTLIER -103.18 117.37 34.38 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 126.605 2.441 . . . . 0.0 113.367 -179.282 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -151.48 106.69 3.31 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 111.249 -2.705 . . . . 0.0 116.848 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 33.97 100.79 0.01 OUTLIER Glycine 0 C--O 1.22 -0.768 0 O-C-N 126.951 2.657 . . . . 0.0 117.913 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.7 t0 78.94 -59.04 0.41 Allowed 'General case' 0 N--CA 1.441 -0.888 0 O-C-N 125.951 1.618 . . . . 0.0 115.087 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.08 116.83 29.27 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 125.067 1.347 . . . . 0.0 112.818 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.602 ' CE2' HD22 ' A' ' 94' ' ' LEU . 8.4 t80 -121.16 119.9 33.69 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 127.271 2.857 . . . . 0.0 117.096 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.472 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -134.32 152.61 51.91 Favored 'General case' 0 C--O 1.193 -1.914 0 O-C-N 128.412 3.57 . . . . 0.0 112.169 179.561 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.622 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -133.33 174.09 10.77 Favored 'General case' 0 CA--C 1.508 -0.635 2 O-C-N 129.914 4.509 . . . . 0.0 106.816 179.645 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.518 ' N ' HG23 ' A' ' 52' ' ' THR . 0.1 OUTLIER -177.22 142.61 0.36 Allowed 'General case' 0 CA--C 1.482 -1.636 0 O-C-N 128.442 3.589 . . . . 0.0 109.893 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.427 HG23 ' HA ' ' A' ' 60' ' ' ASN . 6.5 t -92.03 158.97 15.94 Favored 'General case' 0 CA--C 1.51 -0.565 0 O-C-N 127.917 3.26 . . . . 0.0 111.738 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -131.18 33.53 4.12 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 113.834 -1.53 . . . . 0.0 114.521 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.4 t -72.97 159.41 33.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 126.476 2.36 . . . . 0.0 108.2 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.5 m -70.8 -36.09 72.82 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 110.617 -2.992 . . . . 0.0 105.409 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 1.06 ' CE2' HD21 ' A' ' 37' ' ' LEU . 5.4 m-85 -66.8 -62.42 1.45 Allowed 'General case' 0 C--N 1.361 1.082 0 CA-C-N 112.698 -2.046 . . . . 0.0 111.321 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -139.37 174.99 9.95 Favored 'General case' 0 C--N 1.361 1.099 2 CA-C-N 107.049 -4.614 . . . . 0.0 114.625 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.427 ' HA ' HG23 ' A' ' 54' ' ' THR . 1.5 m120 -146.11 39.88 1.12 Allowed 'General case' 0 C--O 1.203 -1.381 2 O-C-N 130.596 4.935 . . . . 0.0 111.03 -179.573 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -64.02 176.95 0.86 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 126.664 2.477 . . . . 0.0 109.089 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -146.19 146.22 30.73 Favored 'General case' 0 C--O 1.199 -1.597 0 O-C-N 128.207 3.442 . . . . 0.0 116.769 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.622 ' HB2' HG22 ' A' ' 52' ' ' THR . 14.0 tp -92.24 47.44 1.33 Allowed 'General case' 0 C--N 1.361 1.073 0 CA-C-N 111.644 -2.526 . . . . 0.0 111.283 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 -60.92 93.37 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.478 ' CD2' HG21 ' A' ' 87' ' ' VAL . 1.6 m-30 -121.12 -178.09 3.67 Favored 'General case' 0 CA--C 1.491 -1.291 0 CA-C-O 126.962 3.268 . . . . 0.0 110.647 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -164.32 148.83 9.8 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 109.995 -3.275 . . . . 0.0 104.446 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.547 HG23 ' HA ' ' A' ' 88' ' ' THR . 12.0 p -68.81 133.16 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.202 0 O-C-N 127.276 2.86 . . . . 0.0 113.698 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.32 40.13 84.29 Favored Glycine 0 N--CA 1.483 1.8 0 CA-C-N 109.984 -3.28 . . . . 0.0 115.789 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -85.71 -14.97 10.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 C-N-CA 117.761 -1.575 . . . . 0.0 108.873 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 53.66 64.96 1.65 Allowed 'General case' 0 C--O 1.217 -0.612 1 O-C-N 131.981 5.8 . . . . 0.0 108.463 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.436 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 5.5 t80 -54.81 137.86 43.89 Favored 'General case' 0 CA--C 1.499 -1.018 1 O-C-N 129.879 4.487 . . . . 0.0 114.779 -178.889 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -102.4 71.0 1.19 Allowed 'General case' 0 C--O 1.202 -1.439 0 O-C-N 125.547 1.78 . . . . 0.0 108.032 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -53.64 130.59 36.83 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 125.161 2.41 . . . . 0.0 111.351 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -142.83 38.19 1.46 Allowed 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 110.675 -2.966 . . . . 0.0 112.028 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.442 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -38.61 160.68 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.733 0 CA-C-N 111.232 -2.713 . . . . 0.0 116.315 -179.96 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.442 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.6 135.83 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 126.796 3.189 . . . . 0.0 112.447 179.469 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.85 -12.61 14.92 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 111.252 -2.704 . . . . 0.0 106.84 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 tp -117.31 -61.36 1.72 Allowed 'General case' 0 C--N 1.352 0.677 0 CA-C-N 108.993 -3.603 . . . . 0.0 116.583 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -123.19 -53.89 1.81 Allowed 'General case' 0 C--O 1.214 -0.801 0 CA-C-O 123.226 1.489 . . . . 0.0 112.793 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.48 79.08 0.79 Allowed Glycine 0 C--O 1.207 -1.591 0 CA-C-O 125.191 2.551 . . . . 0.0 111.425 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.464 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 2.6 tpt180 -144.36 -101.34 0.11 Allowed 'General case' 0 N--CA 1.486 1.372 1 CA-C-N 107.513 -4.344 . . . . 0.0 113.875 -179.877 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.464 ' N ' ' HG3' ' A' ' 81' ' ' ARG . 0.5 OUTLIER 153.76 120.7 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 O-C-N 127.147 2.78 . . . . 0.0 108.368 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.556 HG12 ' H ' ' A' ' 84' ' ' LYS . 2.1 t -141.97 178.22 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 0 O-C-N 127.717 3.136 . . . . 0.0 113.266 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.556 ' H ' HG12 ' A' ' 83' ' ' VAL . 1.7 mtmt -119.87 95.6 4.83 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 127.038 2.711 . . . . 0.0 110.701 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 91.1 m -91.54 81.06 5.37 Favored 'General case' 0 C--O 1.195 -1.785 0 O-C-N 126.34 2.275 . . . . 0.0 115.244 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 0.6 OUTLIER -69.84 148.36 49.17 Favored 'General case' 0 N--CA 1.433 -1.319 2 CA-C-N 106.525 -4.852 . . . . 0.0 110.849 179.882 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.605 HG13 ' SG ' ' A' ' 96' ' ' CYS . 38.7 t -131.48 143.95 38.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 124.766 1.226 . . . . 0.0 110.731 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.547 ' HA ' HG23 ' A' ' 67' ' ' VAL . 0.7 OUTLIER -164.93 174.06 10.95 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.085 -1.871 . . . . 0.0 111.853 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.697 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 68.9 m95 -98.35 150.0 22.05 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 114.625 -2.607 . . . . 0.0 110.317 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.63 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.6 OUTLIER -96.43 -8.28 32.73 Favored 'General case' 0 C--O 1.206 -1.231 1 CA-C-O 131.808 5.575 . . . . 0.0 112.911 179.665 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.32 -18.15 8.89 Favored Glycine 0 C--O 1.211 -1.283 2 CA-C-N 107.7 -4.318 . . . . 0.0 102.846 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.426 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.3 OUTLIER -171.27 75.39 0.06 Allowed 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 128.919 2.888 . . . . 0.0 110.731 -179.865 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 90' ' ' GLU . 6.4 t 132.92 154.88 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.716 3.206 . . . . 0.0 118.365 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.602 HD22 ' CE2' ' A' ' 50' ' ' PHE . 1.1 tp -81.65 105.6 12.92 Favored 'General case' 0 CA--C 1.493 -1.23 0 O-C-N 127.315 2.885 . . . . 0.0 114.868 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.63 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.296 88.8 t -107.43 110.62 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 111.589 -2.55 . . . . 0.0 111.771 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.605 ' SG ' HG13 ' A' ' 87' ' ' VAL . 33.0 m -130.41 144.34 51.33 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.74 118.18 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.069 0 CA-C-N 112.333 -2.212 . . . . 0.0 116.765 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.464 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 5.3 mt-30 -84.78 93.1 8.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 125.651 2.643 . . . . 0.0 109.009 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -86.33 123.11 31.21 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-N 107.485 -4.416 . . . . 0.0 109.016 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -131.83 -85.6 0.32 Allowed Glycine 0 C--O 1.202 -1.885 0 CA-C-O 126.415 3.23 . . . . 0.0 108.271 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.438 ' HG2' ' N ' ' A' ' 102' ' ' LYS . 43.7 tt0 -149.97 -78.42 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 1 CA-C-N 107.752 -4.224 . . . . 0.0 112.951 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.5 ' HD2' ' HG3' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -94.71 -9.22 35.44 Favored 'General case' 0 C--O 1.206 -1.224 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.5 ' HG3' ' HD2' ' A' ' 102' ' ' LYS . 4.5 mt-10 -97.51 152.99 18.44 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -140.64 83.35 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 2 O-C-N 132.437 6.085 . . . . 0.0 101.906 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.464 ' HB2' ' CG ' ' A' ' 98' ' ' GLN . 16.7 mmm-85 -88.69 12.33 15.13 Favored 'General case' 0 C--O 1.22 -0.492 0 O-C-N 126.947 2.655 . . . . 0.0 115.284 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.53 109.37 1.74 Allowed Glycine 0 CA--C 1.541 1.702 1 O-C-N 130.533 4.895 . . . . 0.0 116.38 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.54 ' CH2' ' HB2' ' A' ' 96' ' ' CYS . 6.9 p90 -95.65 3.44 53.98 Favored 'General case' 0 N--CA 1.427 -1.623 2 O-C-N 134.858 6.858 . . . . 0.0 114.285 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -20.9 141.21 0.0 OUTLIER 'General case' 0 C--N 1.363 1.154 1 O-C-N 130.483 4.865 . . . . 0.0 115.886 -178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -107.46 167.96 9.57 Favored 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.566 -2.561 . . . . 0.0 110.531 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -173.94 61.9 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.02 1 O-C-N 130.736 5.022 . . . . 0.0 116.889 179.04 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.403 HG23 ' H ' ' A' ' 111' ' ' VAL . 99.9 t -22.53 94.1 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.634 0 O-C-N 126.672 2.483 . . . . 0.0 114.335 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.459 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -90.19 16.25 8.88 Favored 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 124.71 2.195 . . . . 0.0 115.341 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.74 122.6 4.02 Favored Glycine 0 C--O 1.197 -2.175 0 CA-C-N 113.908 -1.496 . . . . 0.0 114.378 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 63.23 6.09 2.23 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 119.216 3.043 . . . . 0.0 119.216 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.457 ' HE2' ' CE1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -167.97 -153.95 0.14 Allowed 'General case' 0 CA--C 1.496 -1.106 1 O-C-N 129.539 4.274 . . . . 0.0 110.977 179.931 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.535 HD22 ' HE3' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -162.78 110.48 1.28 Allowed 'General case' 0 CA--C 1.478 -1.805 0 C-N-CA 113.556 -3.258 . . . . 0.0 112.886 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.459 ' CD1' ' HB2' ' A' ' 112' ' ' GLU . 83.0 m-85 -66.48 80.52 0.1 Allowed 'General case' 0 C--N 1.351 0.66 1 CA-C-N 108.023 -4.171 . . . . 0.0 117.227 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 116' ' ' LEU . 1.3 tt -67.04 105.58 1.7 Allowed 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 111.716 -2.493 . . . . 0.0 104.82 178.304 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -109.92 115.72 30.32 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 116.416 -1.754 . . . . 0.0 109.15 -178.006 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -121.89 138.77 54.27 Favored 'General case' 0 CA--C 1.504 -0.816 1 O-C-N 130.386 4.804 . . . . 0.0 113.912 -179.98 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.62 ' O ' HD12 ' A' ' 120' ' ' LEU . 80.5 m -110.63 162.53 14.64 Favored 'General case' 0 C--O 1.2 -1.55 0 CA-C-N 108.642 -3.89 . . . . 0.0 105.651 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.92 54.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 127.051 3.31 . . . . 0.0 112.394 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 94.88 -43.56 2.27 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 109.813 -3.358 . . . . 0.0 114.156 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -141.28 -52.7 0.45 Allowed 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 113.412 -1.394 . . . . 0.0 110.279 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -67.01 148.19 52.26 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 126.919 2.637 . . . . 0.0 107.136 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.1 m -132.7 77.05 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.875 1 O-C-N 129.321 4.138 . . . . 0.0 111.973 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.76 142.81 58.27 Favored 'General case' 0 CA--C 1.497 -1.074 0 CA-C-N 114.59 -1.187 . . . . 0.0 112.133 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -125.47 115.14 19.78 Favored 'General case' 0 CA--C 1.506 -0.724 0 O-C-N 125.515 1.759 . . . . 0.0 115.107 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -99.46 167.42 10.63 Favored 'General case' 0 N--CA 1.487 1.379 1 O-C-N 129.118 4.012 . . . . 0.0 110.416 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.3 -46.14 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 119.595 1.089 . . . . 0.0 111.776 -178.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.422 ' C ' ' HB2' ' A' ' 115' ' ' LYS . 7.3 m-85 66.3 174.68 0.24 Allowed 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 128.955 2.902 . . . . 0.0 116.549 -179.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.538 ' HG2' ' HG3' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -157.11 118.34 3.68 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.625 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 21.2 ttpt -61.6 125.82 25.18 Favored 'General case' 0 C--O 1.207 -1.16 0 CA-C-O 116.231 -1.843 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.528 ' HG2' ' HG2' ' A' ' 133' ' ' LYS . 14.8 ptmt . . . . . 0 C--O 1.265 1.901 0 O-C-N 128.931 3.894 . . . . 0.0 118.864 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.535 ' HB3' ' CH2' ' A' ' 89' ' ' TRP . 5.7 mttt . . . . . 0 CA--C 1.497 -1.082 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.55 120.96 32.08 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -134.8 30.49 3.4 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 113.506 -3.14 . . . . 0.0 108.742 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.5 115.81 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 129.024 3.952 . . . . 0.0 112.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -153.38 -123.5 0.95 Allowed Glycine 0 C--O 1.203 -1.807 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.885 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.491 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER 179.53 148.95 0.28 Allowed 'General case' 0 N--CA 1.475 0.806 1 O-C-N 132.616 5.539 . . . . 0.0 107.686 -179.907 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.556 ' CZ3' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -156.93 106.2 2.22 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 128.932 3.895 . . . . 0.0 116.463 -179.726 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -38.74 -39.14 0.47 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 85.53 34.64 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 113.946 -2.93 . . . . 0.0 107.099 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 20.4 -75.94 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.973 1 O-C-N 130.845 5.091 . . . . 0.0 110.552 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -149.74 160.77 43.27 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 111.649 -2.523 . . . . 0.0 110.662 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -116.47 114.02 23.64 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 110.844 -2.889 . . . . 0.0 117.051 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -47.0 83.87 Favored 'General case' 0 CA--C 1.504 -0.806 1 O-C-N 130.085 4.616 . . . . 0.0 113.269 -179.766 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -128.76 95.93 4.24 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 112.362 -2.199 . . . . 0.0 114.739 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.675 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 2.2 t80 -100.31 -57.1 2.19 Favored 'General case' 0 CA--C 1.489 -1.383 0 CA-C-O 127.12 3.343 . . . . 0.0 108.395 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.475 ' N ' ' CD2' ' A' ' 17' ' ' PHE . 0.2 OUTLIER -65.05 -52.9 53.17 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 118.966 -2.333 . . . . 0.0 114.717 179.814 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.422 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -62.33 -25.14 66.36 Favored Glycine 0 N--CA 1.48 1.607 1 O-C-N 130.09 4.619 . . . . 0.0 111.63 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.538 ' OH ' HD21 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -66.98 -43.74 82.27 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-O 125.148 2.404 . . . . 0.0 108.221 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 mtp -72.05 -23.85 61.44 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-N 113.673 -1.603 . . . . 0.0 112.877 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.422 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 2.2 ttpt -76.21 -27.61 56.91 Favored 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 109.568 -3.469 . . . . 0.0 111.819 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.35 66.73 Favored 'General case' 0 C--N 1.318 -0.804 1 O-C-N 130.099 4.624 . . . . 0.0 112.089 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.79 -11.07 49.07 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 127.421 2.951 . . . . 0.0 104.372 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.3 t0 45.71 80.63 0.04 OUTLIER 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.137 3.827 . . . . 0.0 109.128 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.666 HD12 ' O ' ' A' ' 78' ' ' LEU . 14.1 tt -82.7 -15.8 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 1 CA-C-N 108.065 -4.152 . . . . 0.0 109.772 -179.656 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.405 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 1.3 t0 -173.38 -179.26 1.86 Allowed 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 117.523 -1.671 . . . . 0.0 112.289 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -119.25 86.5 2.56 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 62.5 49.88 3.85 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 126.959 2.662 . . . . 0.0 109.297 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' A' ' 27' ' ' ASP . 1.7 t -88.67 -26.59 21.76 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 108.571 -3.922 . . . . 0.0 113.186 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.403 ' O ' HD13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -68.84 -138.24 0.01 OUTLIER 'General case' 0 C--O 1.242 0.697 1 O-C-N 130.127 4.642 . . . . 0.0 108.435 179.953 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 0.1 OUTLIER 84.35 4.38 0.71 Allowed 'General case' 0 CA--C 1.497 -1.077 0 O-C-N 128.82 3.825 . . . . 0.0 113.291 179.422 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.403 HD13 ' O ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -137.43 -21.92 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.928 0 CA-C-N 110.111 -3.222 . . . . 0.0 114.426 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.721 ' HB1' ' CE2' ' A' ' 58' ' ' PHE . . . -90.49 11.34 22.04 Favored 'General case' 0 C--O 1.206 -1.217 0 CA-C-O 123.386 1.565 . . . . 0.0 112.365 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.5 t -44.73 -40.04 1.93 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-O 123.758 1.742 . . . . 0.0 109.931 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 169.34 117.78 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 109.337 -3.574 . . . . 0.0 115.399 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.864 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.4 OUTLIER -147.86 53.76 1.04 Allowed 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 110.704 -2.953 . . . . 0.0 104.972 179.53 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.1 m 68.87 139.94 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.243 1 O-C-N 135.106 7.754 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -125.78 -65.89 0.97 Allowed 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 117.296 2.332 . . . . 0.0 117.296 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.9 m 56.48 108.49 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.622 1 O-C-N 131.971 5.795 . . . . 0.0 111.628 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.7 149.05 23.23 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 127.988 3.305 . . . . 0.0 103.373 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.462 HG22 ' N ' ' A' ' 43' ' ' ILE . 5.1 mt -137.43 156.24 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 1 O-C-N 129.189 4.056 . . . . 0.0 110.29 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.5 ' HA ' ' HA ' ' A' ' 52' ' ' THR 0.32 6.6 tt -130.36 131.51 65.35 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 O-C-N 126.905 2.628 . . . . 0.0 108.257 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.271 72.4 t -137.58 125.98 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 113.412 -1.722 . . . . 0.0 110.312 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -132.67 88.66 2.55 Favored 'General case' 0 CA--C 1.489 -1.371 0 N-CA-C 118.979 2.955 . . . . 0.0 118.979 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -68.0 -54.78 15.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 C-N-CA 114.266 -2.973 . . . . 0.0 115.018 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.54 105.47 0.2 Allowed Glycine 0 C--O 1.205 -1.719 0 O-C-N 121.169 -0.957 . . . . 0.0 112.489 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 63.41 19.27 11.59 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 119.011 -1.075 . . . . 0.0 110.52 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -130.48 154.3 47.9 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 128.144 3.403 . . . . 0.0 108.399 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.719 ' CD1' HD13 ' A' ' 94' ' ' LEU . 51.1 t80 -155.02 99.92 2.15 Favored 'General case' 0 CA--C 1.484 -1.593 1 O-C-N 129.983 4.552 . . . . 0.0 112.932 -179.718 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -120.12 75.72 1.12 Allowed 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 126.508 2.38 . . . . 0.0 112.546 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 43' ' ' ILE . 0.7 OUTLIER -57.68 145.65 33.55 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 128.857 3.848 . . . . 0.0 106.04 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.479 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 4.2 ptmm? -145.26 152.57 40.17 Favored 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 115.396 -2.522 . . . . 0.0 111.397 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.499 HG23 ' HA ' ' A' ' 60' ' ' ASN . 4.1 t -106.43 155.16 19.85 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 124.934 2.302 . . . . 0.0 112.153 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -130.15 52.21 2.03 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 111.543 -2.571 . . . . 0.0 110.302 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 10.5 p -69.12 -99.69 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.078 1 O-C-N 129.332 4.145 . . . . 0.0 112.33 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.465 ' OG1' HD12 ' A' ' 37' ' ' LEU . 0.6 OUTLIER 153.81 -34.05 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 O-C-N 127.281 2.863 . . . . 0.0 104.27 -179.046 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.864 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -82.39 -60.88 2.05 Favored 'General case' 0 C--N 1.368 1.37 0 O-C-N 128.579 3.674 . . . . 0.0 112.111 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.3 98.41 3.43 Favored 'General case' 0 C--O 1.216 -0.704 2 CA-C-N 107.479 -4.418 . . . . 0.0 113.869 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.499 ' HA ' HG23 ' A' ' 54' ' ' THR . 54.3 m-20 -82.99 65.95 8.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 109.556 -3.475 . . . . 0.0 110.507 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -96.72 80.68 3.09 Favored 'General case' 0 CA--C 1.503 -0.862 0 O-C-N 127.058 2.724 . . . . 0.0 109.052 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.479 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 5.7 p-10 -79.72 132.63 36.24 Favored 'General case' 0 C--O 1.2 -1.507 1 O-C-N 129.685 4.366 . . . . 0.0 116.423 -179.605 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.52 HD23 ' CE1' ' A' ' 50' ' ' PHE . 3.2 tp -52.86 118.05 3.4 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 128.537 3.648 . . . . 0.0 109.563 177.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -135.46 84.69 2.11 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 116.766 -1.974 . . . . 0.0 111.639 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.759 ' CD1' HG21 ' A' ' 87' ' ' VAL . 6.5 p90 -171.62 145.07 1.96 Allowed 'General case' 0 N--CA 1.474 0.749 1 CA-C-O 128.939 4.209 . . . . 0.0 111.228 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.86 163.34 26.86 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 110.867 -2.879 . . . . 0.0 106.468 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.646 HG21 ' CD1' ' A' ' 89' ' ' TRP . 9.3 p -77.75 142.28 14.39 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.787 0 O-C-N 128.652 3.72 . . . . 0.0 112.127 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 59.17 14.58 26.11 Favored Glycine 0 N--CA 1.484 1.894 0 C-N-CA 116.217 -2.897 . . . . 0.0 117.323 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -83.63 -18.62 10.04 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.351 0 C-N-CA 118.062 -1.455 . . . . 0.0 107.819 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.492 ' HG3' HD12 ' A' ' 86' ' ' LEU . 1.4 mt-10 74.33 130.72 0.04 OUTLIER 'General case' 0 C--N 1.349 0.584 1 O-C-N 131.488 5.493 . . . . 0.0 109.536 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.685 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.5 t80 -107.74 29.12 7.52 Favored 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.647 3.092 . . . . 0.0 110.62 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -14.23 84.41 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.976 0 O-C-N 127.34 2.9 . . . . 0.0 115.585 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.421 ' HG2' ' HB3' ' A' ' 82' ' ' ASN . 3.0 mp0 59.62 173.23 0.08 Allowed 'General case' 0 C--O 1.209 -1.04 1 CA-C-O 129.128 4.299 . . . . 0.0 111.965 -179.345 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.509 ' N ' ' ND1' ' A' ' 74' ' ' HIS . 1.6 m-70 69.98 78.18 0.2 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-N 110.035 -3.257 . . . . 0.0 114.284 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 76.3 p -85.1 -82.32 0.18 Allowed 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 112.868 -1.969 . . . . 0.0 112.015 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.0 mtmt 60.96 168.98 0.09 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 126.215 2.912 . . . . 0.0 115.542 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.18 19.72 77.55 Favored Glycine 0 C--O 1.207 -1.565 0 CA-C-N 111.239 -2.709 . . . . 0.0 109.921 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.666 ' O ' HD12 ' A' ' 26' ' ' ILE . 3.1 tp -172.1 -44.39 0.02 OUTLIER 'General case' 0 CA--C 1.505 -0.756 1 O-C-N 130.74 4.435 . . . . 0.0 113.399 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.18 -70.21 0.57 Allowed 'General case' 0 CA--C 1.5 -0.948 0 CA-C-O 124.119 1.914 . . . . 0.0 113.011 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.76 87.88 1.21 Allowed Glycine 0 N--CA 1.476 1.332 0 CA-C-N 113.722 -1.581 . . . . 0.0 111.114 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.4 mmt-85 -144.44 178.96 7.57 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 127.084 2.284 . . . . 0.0 109.5 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.421 ' HB3' ' HG2' ' A' ' 73' ' ' GLU . 63.6 m-20 -120.47 75.07 1.09 Allowed 'General case' 0 CA--C 1.501 -0.934 0 O-C-N 124.901 1.376 . . . . 0.0 110.714 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.455 HG13 ' N ' ' A' ' 99' ' ' LYS . 17.5 t -113.47 139.15 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 O-C-N 128.815 3.822 . . . . 0.0 111.421 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.464 ' CA ' ' HE2' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -32.35 -69.34 0.08 Allowed 'General case' 0 CA--C 1.504 -0.794 1 O-C-N 131.864 5.727 . . . . 0.0 112.87 -179.856 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.685 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 62.4 m 62.65 68.47 0.65 Allowed 'General case' 0 C--O 1.199 -1.573 0 C-N-CA 127.432 2.293 . . . . 0.0 110.585 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.551 ' HB3' HG23 ' A' ' 97' ' ' VAL . 4.0 tt -91.3 112.82 24.89 Favored 'General case' 0 N--CA 1.429 -1.514 2 O-C-N 131.502 5.501 . . . . 0.0 116.425 -179.429 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.759 HG21 ' CD1' ' A' ' 65' ' ' PHE . 38.4 t -92.88 151.25 3.65 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 CA-C-O 122.764 1.268 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.477 ' HA ' ' CG2' ' A' ' 67' ' ' VAL . 4.0 t -164.3 159.08 19.49 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 112.203 -2.271 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.683 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.252 18.1 m95 -86.49 149.56 24.89 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 114.083 -2.865 . . . . 0.0 105.171 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.532 ' CB ' HG22 ' A' ' 93' ' ' THR . 2.8 tm-20 -96.82 -47.06 6.01 Favored 'General case' 0 C--O 1.195 -1.786 1 CA-C-O 128.949 4.214 . . . . 0.0 111.974 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -179.76 -49.72 0.08 OUTLIER Glycine 0 C--O 1.197 -2.179 1 CA-C-N 107.669 -4.332 . . . . 0.0 103.899 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -141.54 29.03 1.78 Allowed 'General case' 0 N--CA 1.447 -0.613 1 O-C-N 133.118 5.834 . . . . 0.0 111.344 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.532 HG22 ' CB ' ' A' ' 90' ' ' GLU . 1.5 t -162.42 160.91 26.94 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.719 HD13 ' CD1' ' A' ' 50' ' ' PHE . 3.4 tt -93.51 112.48 24.38 Favored 'General case' 0 CA--C 1.487 -1.479 0 O-C-N 127.951 3.282 . . . . 0.0 114.679 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.352 52.9 t -116.83 134.91 58.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 111.726 -2.488 . . . . 0.0 114.552 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 34.4 t -137.18 140.92 42.1 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.551 HG23 ' HB3' ' A' ' 86' ' ' LEU . 6.1 m -128.93 101.34 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 1 CA-C-O 128.635 4.064 . . . . 0.0 118.949 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.437 ' NE2' HG11 ' A' ' 83' ' ' VAL 0.302 4.0 mm100 -71.9 111.01 6.8 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-N 110.185 -3.189 . . . . 0.0 107.464 179.443 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.455 ' N ' HG13 ' A' ' 83' ' ' VAL . 3.3 ttmt -37.3 -46.03 0.72 Allowed 'General case' 0 C--O 1.195 -1.81 1 O-C-N 129.579 4.299 . . . . 0.0 111.014 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.403 ' H ' HG13 ' A' ' 83' ' ' VAL . . . 114.89 -86.63 0.42 Allowed Glycine 0 C--O 1.203 -1.833 0 CA-C-O 125.925 2.958 . . . . 0.0 113.37 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.78 16.18 7.88 Favored 'General case' 0 CA--C 1.497 -1.095 1 CA-C-N 106.421 -4.889 . . . . 0.0 109.423 -179.633 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.402 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 155.53 -33.83 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 125.852 2.739 . . . . 0.0 113.516 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.402 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 2.7 mt-10 -104.99 178.73 4.48 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 110.037 -3.256 . . . . 0.0 117.301 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . 0.251 7.7 m-20 -144.94 79.9 1.61 Allowed 'General case' 0 N--CA 1.489 1.49 2 CA-C-N 106.535 -4.848 . . . . 0.0 101.732 179.447 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.402 ' C ' ' HG3' ' A' ' 98' ' ' GLN . 2.5 tpt180 -101.21 -3.3 29.3 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 126.376 2.989 . . . . 0.0 114.172 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -52.15 103.53 0.12 Allowed Glycine 0 N--CA 1.426 -1.968 1 CA-C-N 107.271 -4.513 . . . . 0.0 118.724 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.45 ' C ' ' HD2' ' A' ' 108' ' ' LYS . 0.1 OUTLIER -97.16 146.46 25.04 Favored 'General case' 0 C--O 1.214 -0.778 0 O-C-N 129.299 3.588 . . . . 0.0 110.283 178.772 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.604 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -163.08 177.19 9.35 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 128.747 3.779 . . . . 0.0 113.097 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.916 ' HG2' HD13 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -143.12 173.37 11.63 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 116.26 -2.176 . . . . 0.0 108.324 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.604 ' CH2' ' HG3' ' A' ' 108' ' ' LYS 0.29 0.0 OUTLIER -159.23 24.77 0.2 Allowed 'General case' 0 CA--C 1.501 -0.912 1 O-C-N 129.623 4.327 . . . . 0.0 117.542 179.551 . . . . . . . . 5 4 . 1 . 010 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 32.0 t 23.68 78.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 CA-C-O 127.973 3.749 . . . . 0.0 117.432 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -90.13 57.73 3.86 Favored 'General case' 0 CA--C 1.484 -1.562 0 O-C-N 118.753 -2.467 . . . . 0.0 112.441 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.09 -126.23 7.37 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 111.685 -2.507 . . . . 0.0 111.424 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -106.69 39.49 1.83 Allowed 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 113.875 -1.162 . . . . 0.0 113.139 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.9 pttt -170.48 142.3 2.08 Favored 'General case' 0 C--N 1.316 -0.867 1 O-C-N 130.104 4.627 . . . . 0.0 105.836 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.916 HD13 ' HG2' ' A' ' 109' ' ' GLN . 3.7 pp -115.49 133.89 55.6 Favored 'General case' 0 C--O 1.194 -1.855 0 O-C-N 128.093 3.371 . . . . 0.0 111.202 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.428 ' O ' ' N ' ' A' ' 119' ' ' GLU . 2.9 m-85 -77.7 92.81 4.18 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 109.441 -3.527 . . . . 0.0 114.364 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -74.73 76.88 2.07 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 109.096 -3.684 . . . . 0.0 106.197 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 117' ' ' TYR . 40.8 mt-10 -85.29 101.86 12.89 Favored 'General case' 0 CA--C 1.485 -1.539 0 O-C-N 129.094 3.996 . . . . 0.0 110.682 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.44 154.67 33.35 Favored 'General case' 0 CA--C 1.487 -1.472 1 O-C-N 129.311 4.132 . . . . 0.0 111.686 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.0 m -111.89 160.01 17.81 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 110.458 -3.065 . . . . 0.0 105.738 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 3.3 m -151.85 33.85 0.54 Allowed 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.541 1.064 . . . . 0.0 111.647 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.71 -41.26 2.25 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 22.6 t70 172.12 91.45 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.295 0 C-N-CA 125.941 1.697 . . . . 0.0 108.609 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -167.78 -53.47 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 111.067 -2.788 . . . . 0.0 105.435 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.424 ' O ' HG12 ' A' ' 126' ' ' VAL . 4.1 t 58.26 54.22 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.686 1 O-C-N 130.14 4.65 . . . . 0.0 113.716 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 49.6 t -42.11 124.69 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 124.663 1.227 . . . . 0.0 110.193 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.48 92.89 4.31 Favored 'General case' 0 CA--C 1.486 -1.506 0 CA-C-N 113.732 -1.576 . . . . 0.0 114.043 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -74.17 157.21 36.35 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 114.919 -2.712 . . . . 0.0 113.658 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.441 ' O ' HG12 ' A' ' 130' ' ' VAL . 52.0 t -142.51 86.97 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 CA-C-O 125.066 2.365 . . . . 0.0 108.068 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.532 ' CE2' ' HB2' ' A' ' 9' ' ' TRP 0.266 6.2 m-85 -72.2 -179.33 2.8 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 109.583 -3.462 . . . . 0.0 116.335 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.67 120.95 0.93 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 109.118 -3.673 . . . . 0.0 103.607 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.556 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 3.2 ttpm? -70.72 90.37 0.77 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 112.111 -2.313 . . . . 0.0 115.048 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.405 ' HD3' HG22 ' A' ' 8' ' ' THR . 3.9 ttpt . . . . . 0 CA--C 1.482 -1.664 0 CA-C-O 114.149 -2.834 . . . . 0.0 118.186 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 116.196 1.924 . . . . 0.0 116.196 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -106.82 97.94 7.66 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -92.76 -124.42 0.09 Allowed 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 115.354 -2.26 . . . . 0.0 107.261 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 71.52 100.02 0.07 Allowed 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 130.329 3.452 . . . . 0.0 112.542 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.27 -130.44 1.18 Allowed Glycine 0 CA--C 1.534 1.242 0 CA-C-O 114.789 -3.228 . . . . 0.0 113.759 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.534 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -169.6 147.35 3.5 Favored 'General case' 0 C--O 1.214 -0.811 1 O-C-N 133.59 6.112 . . . . 0.0 104.519 -179.892 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.534 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -148.24 109.42 4.32 Favored 'General case' 0 CA--C 1.494 -1.176 1 O-C-N 130.941 5.151 . . . . 0.0 114.78 -179.894 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -78.41 119.99 22.51 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 127.4 2.937 . . . . 0.0 111.576 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.531 ' HB3' ' HG2' ' A' ' 39' ' ' GLN . 3.4 ttp -57.54 96.05 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 O-C-N 126.243 2.215 . . . . 0.0 106.53 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.59 -14.23 40.3 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 130.207 3.403 . . . . 0.0 111.688 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.415 ' HB3' HG23 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -173.8 158.29 3.22 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.609 -1.632 . . . . 0.0 113.262 -179.865 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.422 ' HB3' ' CE ' ' A' ' 11' ' ' MET . 14.1 p-10 -133.86 129.47 36.48 Favored 'General case' 0 CA--C 1.493 -1.228 0 O-C-N 127.947 3.28 . . . . 0.0 111.337 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -101.25 -71.31 0.71 Allowed 'General case' 0 CA--C 1.477 -1.833 1 O-C-N 129.779 4.425 . . . . 0.0 115.247 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.98 -71.07 0.51 Allowed 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 118.845 -2.409 . . . . 0.0 115.697 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 71.73 -72.58 0.11 Allowed 'General case' 0 C--O 1.198 -1.609 0 O-C-N 126.546 2.403 . . . . 0.0 112.156 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.49 ' CB ' ' HB3' ' A' ' 31' ' ' ARG . 0.1 OUTLIER -76.49 -30.44 57.25 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.987 -179.672 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.47 -22.97 77.89 Favored Glycine 0 N--CA 1.484 1.843 1 O-C-N 130.345 4.778 . . . . 0.0 108.404 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.58 -46.65 53.3 Favored 'General case' 0 C--O 1.194 -1.837 0 CA-C-O 126.006 2.813 . . . . 0.0 108.933 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.7 mtt -59.93 -29.5 68.43 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 110.451 -3.068 . . . . 0.0 112.928 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -79.72 -23.93 42.01 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 127.757 3.16 . . . . 0.0 112.008 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.37 -29.09 64.55 Favored 'General case' 0 C--O 1.205 -1.243 1 O-C-N 132.211 5.944 . . . . 0.0 114.419 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.484 HD11 ' O ' ' A' ' 78' ' ' LEU . 0.9 OUTLIER -111.06 20.06 17.82 Favored 'General case' 0 CA--C 1.539 0.538 1 O-C-N 129.807 4.442 . . . . 0.0 108.529 179.975 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 20.45 86.75 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.571 1 O-C-N 130.053 4.596 . . . . 0.0 110.279 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.419 ' CG2' ' N ' ' A' ' 27' ' ' ASP . 6.4 tp -98.77 -39.78 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 CA-C-O 127.045 3.307 . . . . 0.0 112.017 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.419 ' N ' ' CG2' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -171.61 -158.61 0.13 Allowed 'General case' 0 C--N 1.359 0.994 0 O-C-N 119.241 -2.162 . . . . 0.0 109.183 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -143.84 49.14 1.39 Allowed 'General case' 0 C--O 1.207 -1.152 0 O-C-N 121.441 -0.787 . . . . 0.0 112.335 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 152.19 78.98 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.792 0 O-C-N 127.942 3.277 . . . . 0.0 107.699 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.5 m -139.17 22.42 2.59 Favored 'General case' 0 CA--C 1.504 -0.798 2 CA-C-N 106.282 -4.963 . . . . 0.0 113.357 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.49 ' HB3' ' CB ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.44 24.05 10.89 Favored 'General case' 0 CA--C 1.509 -0.603 0 O-C-N 128.186 3.429 . . . . 0.0 113.945 179.744 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.501 ' O ' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -114.45 15.19 17.93 Favored 'General case' 0 CA--C 1.488 -1.441 0 O-C-N 127.284 2.865 . . . . 0.0 112.464 -179.44 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.506 ' N ' HD12 ' A' ' 33' ' ' ILE . 0.4 OUTLIER -170.04 74.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.362 1.132 1 CA-C-N 107.931 -4.213 . . . . 0.0 109.493 -179.791 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 33' ' ' ILE . . . 172.32 -38.25 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.182 0 O-C-N 120.367 -1.458 . . . . 0.0 109.079 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 51.1 t -17.95 -47.85 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 O-C-N 128.935 3.897 . . . . 0.0 112.717 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.654 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 159.42 114.68 0.0 OUTLIER 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 108.955 -3.748 . . . . 0.0 113.333 179.515 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.944 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -145.53 85.94 1.73 Allowed 'General case' 0 C--O 1.212 -0.905 1 CA-C-N 108.249 -4.069 . . . . 0.0 107.138 179.722 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.5 m 72.91 47.35 0.21 Allowed 'General case' 0 N--CA 1.485 1.318 1 O-C-N 133.973 7.046 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 11' ' ' MET . 4.0 tt0 -79.52 135.36 36.61 Favored 'General case' 0 CA--C 1.492 -1.257 0 C-N-CA 118.393 -1.323 . . . . 0.0 113.277 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.4 m -152.52 120.47 6.17 Favored 'General case' 0 C--O 1.212 -0.905 0 C-N-CA 130.26 3.424 . . . . 0.0 111.5 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.782 ' HE2' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -103.62 152.97 21.13 Favored 'General case' 0 N--CA 1.48 1.048 1 O-C-N 129.169 4.043 . . . . 0.0 103.486 179.853 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.502 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.2 mp -140.0 156.64 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 O-C-N 126.886 2.616 . . . . 0.0 109.71 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.502 ' N ' HG22 ' A' ' 42' ' ' ILE 0.295 1.4 tt -127.38 138.08 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.495 0 O-C-N 128.217 3.448 . . . . 0.0 109.45 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.8 t -137.14 87.69 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.274 0 CA-C-N 112.038 -2.346 . . . . 0.0 109.704 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -99.61 102.99 14.66 Favored 'General case' 0 C--O 1.21 -0.982 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.86 -14.27 23.32 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 128.012 3.32 . . . . 0.0 112.477 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.69 -96.23 0.18 Allowed Glycine 0 C--O 1.203 -1.795 0 CA-C-O 122.955 1.308 . . . . 0.0 111.208 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.628 ' O ' HG23 ' A' ' 66' ' ' THR . 96.1 m-20 -86.36 -13.6 45.98 Favored 'General case' 0 C--O 1.21 -1.002 0 CA-C-N 110.872 -2.664 . . . . 0.0 110.661 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -109.69 93.34 4.45 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 128.438 3.586 . . . . 0.0 109.57 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.877 ' CD2' HD13 ' A' ' 94' ' ' LEU . 91.3 t80 -108.15 101.04 10.3 Favored 'General case' 0 CA--C 1.501 -0.926 1 O-C-N 129.66 4.35 . . . . 0.0 115.446 -179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 30.4 mttt -112.35 85.98 2.26 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 119.022 2.971 . . . . 0.0 119.022 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.428 ' O ' HG22 ' A' ' 52' ' ' THR . 0.9 OUTLIER -65.25 120.47 12.8 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 128.255 3.472 . . . . 0.0 106.222 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -125.43 150.82 46.94 Favored 'General case' 0 CA--C 1.493 -1.232 0 O-C-N 126.513 2.383 . . . . 0.0 112.31 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -98.14 175.3 6.14 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 125.407 1.692 . . . . 0.0 110.457 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.486 ' HB2' HD11 ' A' ' 42' ' ' ILE . 2.4 t-20 -148.65 35.75 0.78 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.827 -1.988 . . . . 0.0 115.483 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.542 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 9.6 p -73.04 167.86 20.25 Favored 'General case' 0 C--N 1.323 -0.549 1 O-C-N 130.66 4.975 . . . . 0.0 111.927 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 57' ' ' THR . 10.3 m -101.56 -1.84 31.98 Favored 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 128.738 3.774 . . . . 0.0 110.746 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.944 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -108.93 -58.95 1.95 Allowed 'General case' 0 C--O 1.218 -0.597 0 O-C-N 123.962 0.789 . . . . 0.0 110.864 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.7 mtt85 -137.8 122.59 18.78 Favored 'General case' 0 C--N 1.357 0.899 1 O-C-N 130.183 4.677 . . . . 0.0 116.186 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.4 99.38 5.81 Favored 'General case' 0 N--CA 1.439 -0.988 1 O-C-N 129.168 4.042 . . . . 0.0 111.209 -179.894 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.58 -67.78 0.92 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 110.177 -3.192 . . . . 0.0 107.653 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.441 ' HB2' ' CB ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER 98.02 176.81 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.364 5.415 . . . . 0.0 110.692 179.963 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 65' ' ' PHE . 8.6 tp -113.92 49.91 0.96 Allowed 'General case' 0 N--CA 1.436 -1.155 0 O-C-N 127.183 2.802 . . . . 0.0 112.643 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.509 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 14.9 t70 -59.59 89.37 0.01 OUTLIER 'General case' 0 C--O 1.211 -0.958 0 O-C-N 128.742 3.776 . . . . 0.0 105.923 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.548 ' CD2' HG11 ' A' ' 87' ' ' VAL . 0.8 OUTLIER -125.81 -174.1 3.0 Favored 'General case' 0 CA--C 1.495 -1.165 1 CA-C-O 128.994 4.235 . . . . 0.0 110.141 -179.763 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.628 HG23 ' O ' ' A' ' 48' ' ' ASP . 1.0 OUTLIER -167.12 122.15 1.07 Allowed 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 109.856 -3.338 . . . . 0.0 106.374 179.529 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.851 HG13 ' HA ' ' A' ' 88' ' ' THR . 3.7 t -36.92 119.9 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.202 -1.412 1 O-C-N 129.638 4.336 . . . . 0.0 115.769 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.32 23.8 70.03 Favored Glycine 0 N--CA 1.487 2.05 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.3 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.575 HG23 ' HB ' ' A' ' 66' ' ' THR . 1.2 t -69.09 -32.39 53.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.508 0 CA-C-N 112.162 -2.019 . . . . 0.0 109.939 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 57.03 73.99 0.43 Allowed 'General case' 0 C--N 1.356 0.867 1 O-C-N 130.555 4.909 . . . . 0.0 108.697 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -84.29 122.97 29.65 Favored 'General case' 0 CA--C 1.498 -1.042 1 O-C-N 129.352 4.157 . . . . 0.0 119.225 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -91.49 54.71 2.58 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.091 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HG2' HG23 ' A' ' 75' ' ' THR . 5.5 tt0 -21.94 109.01 0.02 OUTLIER 'General case' 0 CA--C 1.483 -1.617 0 CA-C-O 126.051 2.834 . . . . 0.0 113.257 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.82 54.73 0.86 Allowed 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 110.3 -3.137 . . . . 0.0 112.044 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.475 HG23 ' HG2' ' A' ' 73' ' ' GLU . 0.8 OUTLIER -53.16 169.95 0.1 Allowed 'General case' 0 C--O 1.201 -1.471 0 CA-C-N 110.809 -2.905 . . . . 0.0 112.316 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.441 ' HA ' ' CA ' ' A' ' 80' ' ' GLY . 0.1 OUTLIER 158.89 -32.19 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.807 1 O-C-N 130.036 4.585 . . . . 0.0 115.807 -179.917 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.59 -21.49 57.89 Favored Glycine 0 C--O 1.218 -0.868 0 CA-C-N 108.441 -3.981 . . . . 0.0 112.843 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.484 ' O ' HD11 ' A' ' 24' ' ' LEU 0.311 5.6 tp -171.32 36.47 0.02 OUTLIER 'General case' 0 CA--C 1.503 -0.849 1 O-C-N 132.977 5.751 . . . . 0.0 113.477 -179.844 . . . . . . . . 4 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.475 ' HB3' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -170.65 -58.47 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.66 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLY . . . . . 0.441 ' CA ' ' HA ' ' A' ' 76' ' ' LYS . . . 67.36 58.33 8.06 Favored Glycine 0 C--O 1.204 -1.734 0 C-N-CA 125.976 1.75 . . . . 0.0 111.463 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.28 -170.24 1.6 Allowed 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 129.707 3.828 . . . . 0.0 115.255 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -163.43 81.62 0.46 Allowed 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 113.445 -1.707 . . . . 0.0 109.411 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.519 HG11 ' HG2' ' A' ' 98' ' ' GLN . 3.6 t -125.02 155.37 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 0 O-C-N 127.528 3.017 . . . . 0.0 117.511 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -87.25 86.08 7.24 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 109.686 -3.416 . . . . 0.0 111.22 -179.79 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.4 m -90.52 85.64 6.19 Favored 'General case' 0 C--O 1.206 -1.201 0 O-C-N 127.202 2.814 . . . . 0.0 111.2 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.7 tt -79.85 146.97 31.93 Favored 'General case' 0 CA--C 1.511 -0.534 2 CA-C-N 106.521 -4.854 . . . . 0.0 112.019 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.548 HG11 ' CD2' ' A' ' 65' ' ' PHE . 1.4 p -134.9 143.4 37.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 125.792 1.637 . . . . 0.0 112.126 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.851 ' HA ' HG13 ' A' ' 67' ' ' VAL . 5.8 t -166.98 169.48 12.95 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-O 126.75 3.166 . . . . 0.0 112.209 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.705 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.8 m95 -91.83 145.01 24.9 Favored 'General case' 0 CA--C 1.509 -0.628 0 O-C-N 117.579 -3.201 . . . . 0.0 105.732 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.565 ' HB3' HG22 ' A' ' 93' ' ' THR . 1.1 tm-20 -85.9 -59.54 2.27 Favored 'General case' 0 C--O 1.203 -1.374 0 CA-C-O 127.813 3.673 . . . . 0.0 111.077 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.71 59.52 0.01 OUTLIER Glycine 0 C--O 1.195 -2.33 2 N-CA-C 100.818 -4.913 . . . . 0.0 100.818 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.491 ' O ' ' HB ' ' A' ' 93' ' ' THR . 12.3 t-20 99.2 93.06 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 2 O-C-N 131.929 5.135 . . . . 0.0 104.142 -178.52 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.565 HG22 ' HB3' ' A' ' 90' ' ' GLU . 1.2 t 127.04 152.47 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.389 0 C-N-CA 130.291 3.436 . . . . 0.0 118.352 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.877 HD13 ' CD2' ' A' ' 50' ' ' PHE 0.268 0.6 OUTLIER -93.64 97.69 10.64 Favored 'General case' 0 CA--C 1.486 -1.495 0 CA-C-N 110.209 -3.178 . . . . 0.0 117.585 -179.407 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.529 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.418 42.3 t -92.65 151.1 3.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 CA-C-N 112.803 -1.999 . . . . 0.0 113.883 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.652 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 0.8 OUTLIER -165.84 157.23 13.9 Favored 'General case' 0 C--O 1.204 -1.328 0 O-C-N 126.977 2.673 . . . . 0.0 105.041 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.422 HG22 ' C ' ' A' ' 96' ' ' CYS 0.286 0.0 OUTLIER -150.93 115.33 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.741 2 O-C-N 129.746 4.404 . . . . 0.0 115.259 -179.869 . . . . . . . . 5 4 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.519 ' HG2' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -78.25 98.14 5.79 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 126.329 2.966 . . . . 0.0 109.444 -179.873 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -85.27 84.62 7.61 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 109.595 -3.457 . . . . 0.0 110.898 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.469 ' CA ' HG13 ' A' ' 83' ' ' VAL . . . -94.4 -155.95 31.96 Favored Glycine 0 C--O 1.2 -2.016 0 CA-C-O 125.53 2.739 . . . . 0.0 108.058 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -93.02 -47.42 7.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 110.528 -2.836 . . . . 0.0 113.066 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.458 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -111.29 -61.32 1.71 Allowed 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -75.31 167.19 22.38 Favored 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 111.391 -2.641 . . . . 0.0 117.385 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.43 ' O ' ' HB ' ' A' ' 121' ' ' THR . 44.9 m-80 -121.6 86.71 2.62 Favored 'General case' 0 CA--C 1.537 0.471 1 CA-C-N 107.353 -4.476 . . . . 0.0 103.592 179.508 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.502 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 28.4 mmm-85 -87.8 175.03 8.02 Favored 'General case' 0 N--CA 1.48 1.066 1 O-C-N 129.672 4.357 . . . . 0.0 107.374 179.549 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.23 -167.39 33.9 Favored Glycine 0 C--O 1.207 -1.554 1 O-C-N 130.705 5.003 . . . . 0.0 115.693 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.652 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 1.6 p90 -175.52 16.44 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.76 1 O-C-N 131.977 5.163 . . . . 0.0 121.15 178.964 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.54 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -45.24 133.33 7.03 Favored 'General case' 0 C--O 1.208 -1.126 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 -176.83 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.401 ' O ' ' CE3' ' A' ' 110' ' ' TRP . 24.5 mm-40 -93.06 168.09 11.36 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 113.975 -2.916 . . . . 0.0 109.525 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.54 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 10.8 m95 -125.07 -38.58 2.31 Favored 'General case' 0 C--O 1.211 -0.956 1 O-C-N 130.226 4.704 . . . . 0.0 114.231 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.5 t 67.3 51.99 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.81 1 CA-C-O 129.721 4.581 . . . . 0.0 109.048 -175.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -98.97 122.72 42.59 Favored 'General case' 0 CA--C 1.475 -1.916 1 CA-C-N 107.043 -4.617 . . . . 0.0 119.009 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 35.35 74.2 0.09 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 118.147 2.019 . . . . 0.0 118.147 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 73.57 -30.85 0.21 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 129.398 3.079 . . . . 0.0 119.257 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.462 ' HG3' ' CE1' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -106.12 174.65 5.79 Favored 'General case' 0 CA--C 1.498 -1.034 1 O-C-N 130.272 4.733 . . . . 0.0 109.756 -179.784 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.782 HD22 ' HE2' ' A' ' 41' ' ' LYS . 4.4 tt -121.04 94.97 4.51 Favored 'General case' 0 C--O 1.197 -1.708 1 O-C-N 129.951 4.532 . . . . 0.0 112.269 179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.462 ' CE1' ' HG3' ' A' ' 115' ' ' LYS . 5.9 m-30 -66.39 131.26 45.68 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 109.938 -3.301 . . . . 0.0 111.123 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.592 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -109.21 102.98 11.88 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 111.171 -2.74 . . . . 0.0 107.947 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -107.44 139.08 42.49 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.705 HD12 ' O ' ' A' ' 121' ' ' THR . 0.1 OUTLIER -137.29 149.91 47.42 Favored 'General case' 0 CA--C 1.485 -1.546 1 O-C-N 129.941 4.525 . . . . 0.0 108.487 -179.568 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.705 ' O ' HD12 ' A' ' 120' ' ' LEU . 4.0 m -111.23 156.48 21.4 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.21 -2.144 . . . . 0.0 105.21 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.24 88.66 0.67 Allowed 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 119.13 -1.028 . . . . 0.0 110.959 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 46.24 39.93 10.05 Favored Glycine 0 CA--C 1.508 -0.399 0 CA-C-O 122.725 1.18 . . . . 0.0 114.776 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 t70 71.21 92.31 0.09 Allowed 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 126.275 1.83 . . . . 0.0 110.432 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.22 -53.1 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.374 1 O-C-N 130.275 4.734 . . . . 0.0 105.467 179.813 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.623 HG22 HG23 ' A' ' 121' ' ' THR . 15.8 t 61.78 78.02 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 CA-C-N 108.834 -3.803 . . . . 0.0 117.953 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.429 ' HB3' HD23 ' A' ' 120' ' ' LEU . 4.5 t -58.89 125.99 25.82 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 113.436 -1.711 . . . . 0.0 108.671 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -110.72 100.41 9.18 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 125.606 1.816 . . . . 0.0 110.615 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -93.6 163.93 13.36 Favored 'General case' 0 CA--C 1.489 -1.398 0 O-C-N 124.691 1.244 . . . . 0.0 112.258 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.415 HG23 ' HB3' ' A' ' 13' ' ' SER . 0.7 OUTLIER -136.46 137.34 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-O 126.288 2.947 . . . . 0.0 106.996 -179.882 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.592 ' CE1' ' HB2' ' A' ' 118' ' ' LEU 0.273 64.1 m-85 -124.56 177.41 5.95 Favored 'General case' 0 CA--C 1.497 -1.09 1 CA-C-N 108.055 -4.157 . . . . 0.0 116.612 179.855 . . . . . . . . 4 3 . 1 . 011 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.77 139.31 19.61 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 110.622 -2.99 . . . . 0.0 103.774 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.506 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 4.9 ttmm -79.17 119.62 22.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-O 116.654 -1.641 . . . . 0.0 111.939 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.404 ' HB3' HG22 ' A' ' 8' ' ' THR . 13.7 ptpt . . . . . 0 CA--C 1.49 -1.348 0 O-C-N 128.885 3.865 . . . . 0.0 118.863 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.415 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 1.2 ptmm? . . . . . 0 N--CA 1.435 -1.176 0 N-CA-C 117.988 2.588 . . . . 0.0 117.988 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -148.63 71.98 1.17 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -133.2 160.28 37.71 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -147.25 165.66 29.41 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.632 3.708 . . . . 0.0 112.614 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.3 -149.53 9.89 Favored Glycine 0 C--O 1.203 -1.802 0 CA-C-O 116.619 -2.212 . . . . 0.0 112.693 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.7 t -163.65 41.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 129.236 3.551 . . . . 0.0 105.155 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.731 ' CZ2' HD23 ' A' ' 116' ' ' LEU 0.307 0.1 OUTLIER -36.69 103.43 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.816 1 O-C-N 131.45 5.469 . . . . 0.0 112.179 -179.208 . . . . . . . . 5 4 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.41 -51.17 60.49 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.689 2.493 . . . . 0.0 114.884 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.2 ttt 93.41 86.85 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.669 1 O-C-N 129.904 4.503 . . . . 0.0 103.591 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -43.9 -47.54 8.37 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 129.059 3.974 . . . . 0.0 110.802 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -158.33 -179.77 8.41 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 111.214 -2.721 . . . . 0.0 112.111 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -156.22 151.8 27.01 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 17' ' ' PHE . 3.1 mm-40 -93.82 -164.07 1.13 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 108.628 -3.896 . . . . 0.0 110.769 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.412 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 11.3 p30 -30.21 83.69 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 C-N-CA 127.401 2.28 . . . . 0.0 111.85 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.4 ' N ' ' O ' ' A' ' 15' ' ' GLU . 13.3 t80 -69.7 -31.12 68.96 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.342 3.925 . . . . 0.0 107.898 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.533 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -73.69 -49.17 27.11 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 110.649 -2.978 . . . . 0.0 111.48 179.659 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.433 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -53.57 -22.44 16.98 Favored Glycine 0 CA--C 1.487 -1.7 1 O-C-N 130.425 4.828 . . . . 0.0 113.506 179.784 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.54 ' OH ' HD21 ' A' ' 78' ' ' LEU . 6.5 t80 -79.72 -38.02 34.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.576 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -77.25 -20.59 54.94 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 113.046 -1.888 . . . . 0.0 112.055 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.433 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 2.3 ttmt -73.48 -39.99 64.47 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 110.468 -3.06 . . . . 0.0 111.659 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.53 -40.18 85.05 Favored 'General case' 0 C--O 1.211 -0.933 1 O-C-N 130.429 4.831 . . . . 0.0 111.383 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.673 HD13 HD13 ' A' ' 26' ' ' ILE 0.322 15.1 mt -70.53 -29.74 66.3 Favored 'General case' 0 C--O 1.208 -1.107 2 O-C-N 130.002 4.564 . . . . 0.0 104.861 -179.885 . . . . . . . . 4 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t0 56.55 43.97 24.83 Favored 'General case' 0 C--O 1.202 -1.425 3 O-C-N 131.696 5.622 . . . . 0.0 103.806 -177.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.673 HD13 HD13 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -70.9 -9.91 13.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 1 CA-C-N 105.665 -5.243 . . . . 0.0 112.592 -178.403 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 50.2 -157.45 0.09 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 109.015 -3.721 . . . . 0.0 114.133 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 1.9 m-30 79.98 -20.38 0.39 Allowed 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 127.956 3.285 . . . . 0.0 115.741 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.49 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . . . 58.25 60.62 2.58 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 103.721 -2.696 . . . . 0.0 103.721 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.476 ' O ' HG22 ' A' ' 30' ' ' THR . 34.2 m -127.87 42.76 3.26 Favored 'General case' 0 N--CA 1.475 0.786 2 CA-C-N 105.369 -5.378 . . . . 0.0 115.294 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.533 ' HB2' ' HA ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.06 -34.69 3.81 Favored 'General case' 0 CA--C 1.499 -1.017 1 O-C-N 129.457 4.223 . . . . 0.0 113.536 -179.629 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.472 ' N ' ' HG2' ' A' ' 31' ' ' ARG 0.258 19.7 tttm -99.11 55.6 1.01 Allowed 'General case' 0 C--N 1.309 -1.158 0 O-C-N 125.762 1.914 . . . . 0.0 107.7 179.809 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.73 -49.77 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.293 2 O-C-N 132.67 6.231 . . . . 0.0 109.732 -179.703 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.554 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -89.57 11.71 18.81 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.511 179.544 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.2 t -37.15 -46.22 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 O-C-N 125.897 1.998 . . . . 0.0 111.167 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.585 ' HD2' ' HB3' ' A' ' 39' ' ' GLN . 0.8 OUTLIER 169.13 100.6 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.63 1 O-C-N 130.103 4.627 . . . . 0.0 115.351 -179.991 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.711 HD23 ' CD2' ' A' ' 58' ' ' PHE . 1.4 pp -96.71 -8.72 30.69 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 128.329 3.518 . . . . 0.0 107.314 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.648 ' N ' HD12 ' A' ' 37' ' ' LEU . 1.8 m 143.94 112.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.128 1 O-C-N 133.109 6.506 . . . . 0.0 110.282 -179.894 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.585 ' HB3' ' HD2' ' A' ' 36' ' ' ARG . 61.8 tt0 -127.47 148.2 50.3 Favored 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.619 3.074 . . . . 0.0 115.301 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.417 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 41.7 m -144.46 119.37 9.95 Favored 'General case' 0 C--N 1.318 -0.769 1 O-C-N 131.469 5.481 . . . . 0.0 111.147 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -103.7 107.91 18.97 Favored 'General case' 0 C--N 1.351 0.631 0 O-C-N 127.471 2.982 . . . . 0.0 103.761 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.534 HD11 ' HB2' ' A' ' 55' ' ' ASN . 3.9 mp -98.02 158.26 3.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 O-C-N 127.252 2.845 . . . . 0.0 110.699 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.519 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -134.77 144.83 33.65 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 110.188 -3.187 . . . . 0.0 109.005 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.441 HG21 ' NZ ' ' A' ' 53' ' ' LYS . 56.9 t -149.1 78.85 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.33 0 CA-C-N 111.82 -2.446 . . . . 0.0 111.951 -179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' A' ' 3' ' ' LYS . 0.8 OUTLIER -77.75 150.48 34.39 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -166.64 91.18 0.42 Allowed 'General case' 0 CA--C 1.498 -1.036 1 O-C-N 129.42 4.2 . . . . 0.0 111.747 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 54.55 -89.48 0.01 OUTLIER Glycine 0 C--N 1.345 1.066 0 CA-C-O 119.833 -0.426 . . . . 0.0 112.523 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -99.55 -39.71 8.19 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 126.796 2.115 . . . . 0.0 116.458 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -85.84 112.98 21.62 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 126.086 2.116 . . . . 0.0 111.975 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.495 ' CE2' HD22 ' A' ' 94' ' ' LEU . 76.8 t80 -112.8 97.98 6.91 Favored 'General case' 0 C--N 1.316 -0.89 1 O-C-N 129.707 4.379 . . . . 0.0 112.315 -179.915 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -117.21 89.36 3.1 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 119.282 3.068 . . . . 0.0 119.282 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.537 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -76.86 158.42 30.8 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 127.443 2.964 . . . . 0.0 106.691 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.441 ' NZ ' HG21 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -155.31 148.94 25.25 Favored 'General case' 0 CA--C 1.486 -1.482 0 O-C-N 127.654 3.096 . . . . 0.0 109.575 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.2 t -105.4 116.87 32.67 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.652 2.781 . . . . 0.0 107.196 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.534 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -82.31 15.75 2.32 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 117.037 2.236 . . . . 0.0 117.037 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.81 155.81 7.35 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 127.356 2.91 . . . . 0.0 109.248 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.419 ' H ' HD11 ' A' ' 37' ' ' LEU . 7.0 p -89.77 -34.2 16.26 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 128.977 3.923 . . . . 0.0 104.01 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.711 ' CD2' HD23 ' A' ' 37' ' ' LEU . 1.3 m-85 -57.97 -65.15 0.69 Allowed 'General case' 0 C--O 1.24 0.562 0 O-C-N 126.922 2.639 . . . . 0.0 111.223 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -151.56 110.2 3.82 Favored 'General case' 0 C--N 1.362 1.151 1 CA-C-N 108.24 -4.073 . . . . 0.0 116.726 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -111.64 87.75 2.63 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 127.316 2.885 . . . . 0.0 108.934 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.57 -56.46 4.0 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 128.708 3.755 . . . . 0.0 107.377 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER 89.6 154.35 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.646 1 O-C-N 132.924 6.39 . . . . 0.0 115.697 -179.944 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.603 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 11.6 tp -99.34 47.25 0.96 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 111.536 -2.574 . . . . 0.0 112.376 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.83 94.75 1.44 Allowed 'General case' 0 C--O 1.206 -1.205 0 O-C-N 123.903 0.752 . . . . 0.0 109.054 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.526 ' CD2' HG21 ' A' ' 87' ' ' VAL . 0.5 OUTLIER -127.15 178.54 5.96 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-O 127.116 3.341 . . . . 0.0 108.558 -179.681 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -151.53 143.47 23.84 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 112.583 -2.099 . . . . 0.0 105.44 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.836 HG21 ' NE1' ' A' ' 89' ' ' TRP . 1.6 t -70.07 152.12 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 0 O-C-N 127.223 2.827 . . . . 0.0 114.194 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 47.37 37.49 12.07 Favored Glycine 0 N--CA 1.469 0.883 0 CA-C-N 111.238 -2.71 . . . . 0.0 114.373 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.262 9.9 p -98.16 -14.37 7.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.042 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.478 ' HA ' HD12 ' A' ' 86' ' ' LEU . 1.3 tt0 55.68 74.14 0.39 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 128.665 3.728 . . . . 0.0 110.884 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.579 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 6.4 t80 -64.35 70.63 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.903 1 O-C-N 129.745 4.403 . . . . 0.0 113.67 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -51.83 87.59 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.32 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.505 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 40.11 -160.72 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 O-C-N 126.934 2.646 . . . . 0.0 112.924 179.54 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 91.62 90.98 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.341 -2.209 . . . . 0.0 116.436 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.466 ' C ' ' HG2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -148.01 153.66 39.27 Favored 'General case' 0 C--O 1.201 -1.492 0 CA-C-N 111.251 -2.704 . . . . 0.0 112.0 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.466 ' HG2' ' C ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 178.99 136.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.795 1 O-C-N 129.111 4.007 . . . . 0.0 111.271 -179.887 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.47 7.41 42.74 Favored Glycine 0 C--O 1.204 -1.725 0 CA-C-N 111.232 -2.713 . . . . 0.0 109.993 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.608 ' HA ' HD11 ' A' ' 26' ' ' ILE . 4.0 tp -165.6 36.38 0.06 Allowed 'General case' 0 C--N 1.351 0.648 0 O-C-N 128.439 3.082 . . . . 0.0 116.36 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.465 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 7.6 t0 159.3 -66.54 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.044 2.715 . . . . 0.0 113.189 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.67 78.61 0.82 Allowed Glycine 0 C--O 1.204 -1.719 0 O-C-N 126.097 2.123 . . . . 0.0 110.144 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.27 -146.53 0.15 Allowed 'General case' 0 CA--C 1.494 -1.182 0 O-C-N 129.44 3.671 . . . . 0.0 113.193 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.505 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 15.2 m-20 -163.38 112.91 1.31 Allowed 'General case' 0 C--O 1.202 -1.431 0 CA-C-O 117.471 -1.252 . . . . 0.0 108.934 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.7 HG22 ' HA2' ' A' ' 100' ' ' GLY . 71.1 t -146.95 131.83 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 N-CA-C 117.833 2.531 . . . . 0.0 117.833 -178.047 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -60.48 115.56 3.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 110.657 -2.974 . . . . 0.0 107.701 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.579 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 40.8 m -122.4 74.31 1.17 Allowed 'General case' 0 C--O 1.198 -1.656 0 O-C-N 127.915 3.26 . . . . 0.0 115.633 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.491 ' HB3' ' CG2' ' A' ' 97' ' ' VAL . 5.3 tp -67.33 143.44 56.38 Favored 'General case' 0 N--CA 1.437 -1.079 2 CA-C-N 106.037 -5.074 . . . . 0.0 108.908 -179.684 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.526 HG21 ' CD2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -123.34 131.09 73.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 O-C-N 126.402 2.314 . . . . 0.0 107.415 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 89' ' ' TRP 0.333 1.7 m -151.3 159.42 44.33 Favored 'General case' 0 CA--C 1.479 -1.782 0 CA-C-N 113.027 -1.897 . . . . 0.0 109.585 -179.562 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.836 ' NE1' HG21 ' A' ' 67' ' ' VAL . 58.8 m95 -87.07 143.66 27.22 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 114.509 -2.662 . . . . 0.0 106.503 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.841 ' HB3' HG22 ' A' ' 93' ' ' THR . 11.0 tp10 -90.28 -35.45 15.27 Favored 'General case' 0 CA--C 1.479 -1.752 1 CA-C-O 133.074 6.178 . . . . 0.0 112.469 179.798 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.18 -41.75 0.27 Allowed Glycine 0 C--O 1.206 -1.602 1 CA-C-N 107.009 -4.632 . . . . 0.0 103.2 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.533 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -155.65 67.64 0.63 Allowed 'General case' 0 C--O 1.197 -1.69 1 O-C-N 131.267 4.745 . . . . 0.0 107.897 -179.787 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.841 HG22 ' HB3' ' A' ' 90' ' ' GLU . 14.6 t 159.18 147.19 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 118.051 2.611 . . . . 0.0 118.051 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.531 HD23 ' OE1' ' A' ' 109' ' ' GLN . 0.7 OUTLIER -85.97 82.66 8.04 Favored 'General case' 0 CA--C 1.495 -1.165 1 O-C-N 132.679 6.237 . . . . 0.0 116.816 179.491 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.538 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.343 54.5 t -84.12 135.71 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 CA-C-O 115.558 -2.163 . . . . 0.0 112.663 179.492 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.11 137.77 29.38 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.491 ' CG2' ' HB3' ' A' ' 86' ' ' LEU . 16.4 m -113.14 118.49 58.19 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.996 1 O-C-N 130.098 4.624 . . . . 0.0 117.15 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.402 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 3.7 mm-40 -94.95 99.02 11.12 Favored 'General case' 0 C--O 1.221 -0.416 0 O-C-N 119.373 -2.079 . . . . 0.0 108.766 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.2 OUTLIER -93.74 77.6 4.26 Favored 'General case' 0 C--O 1.201 -1.47 0 CA-C-N 111.059 -2.791 . . . . 0.0 108.324 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.7 ' HA2' HG22 ' A' ' 83' ' ' VAL . . . -81.65 -117.98 0.46 Allowed Glycine 0 C--O 1.207 -1.573 0 CA-C-N 112.286 -2.234 . . . . 0.0 112.082 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 174.03 94.62 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.984 -2.108 . . . . 0.0 111.731 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? 128.19 -28.62 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 129.159 2.984 . . . . 0.0 111.772 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.35 174.33 10.73 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 110.091 -3.231 . . . . 0.0 116.552 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -125.38 97.36 5.17 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 113.579 -3.105 . . . . 0.0 105.888 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.473 ' HD3' ' HA ' ' A' ' 122' ' ' CYS 0.285 17.9 mmt180 -91.47 6.76 44.28 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 128.844 3.84 . . . . 0.0 113.809 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.402 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -49.0 97.14 0.01 OUTLIER Glycine 0 CA--C 1.533 1.194 2 O-C-N 133.166 6.541 . . . . 0.0 111.48 179.992 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.603 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.263 0.0 OUTLIER -104.16 137.92 41.4 Favored 'General case' 0 C--N 1.317 -0.815 1 O-C-N 130.97 4.571 . . . . 0.0 108.55 178.541 . . . . . . . . 5 4 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.65 -179.46 7.63 Favored 'General case' 0 C--O 1.204 -1.302 1 O-C-N 131.853 5.721 . . . . 0.0 115.101 -178.047 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.579 ' HB2' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -139.77 177.37 8.0 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 109.147 -3.661 . . . . 0.0 107.747 -179.835 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.466 ' CD1' ' HB3' ' A' ' 117' ' ' TYR 0.27 0.5 OUTLIER 177.93 100.45 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.642 1 O-C-N 132.694 6.246 . . . . 0.0 115.713 178.637 . . . . . . . . 5 4 . 1 . 012 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.4 t -46.62 96.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.486 -1.491 0 CA-C-O 126.416 3.008 . . . . 0.0 115.63 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.91 96.7 6.41 Favored 'General case' 0 CA--C 1.484 -1.595 0 CA-C-O 125.221 2.439 . . . . 0.0 115.945 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.76 72.78 0.47 Allowed Glycine 0 N--CA 1.439 -1.141 0 CA-C-N 112.049 -2.341 . . . . 0.0 117.101 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 49.48 63.08 2.3 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 126.587 1.992 . . . . 0.0 116.057 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 160.63 148.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.667 1 O-C-N 130.003 4.564 . . . . 0.0 109.419 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.731 HD23 ' CZ2' ' A' ' 9' ' ' TRP . 1.2 mm? -83.19 -174.82 5.51 Favored 'General case' 0 CA--C 1.495 -1.149 0 O-C-N 127.156 2.785 . . . . 0.0 111.679 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.466 ' HB3' ' CD1' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -155.81 69.53 0.67 Allowed 'General case' 0 C--O 1.203 -1.355 0 O-C-N 128.053 3.346 . . . . 0.0 110.751 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.83 87.24 0.06 Allowed 'General case' 0 CA--C 1.505 -0.767 1 CA-C-N 107.512 -4.404 . . . . 0.0 109.022 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -105.78 97.64 7.44 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 125.644 1.84 . . . . 0.0 111.081 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.574 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -102.74 162.66 12.74 Favored 'General case' 0 C--N 1.365 1.24 0 O-C-N 126.645 2.466 . . . . 0.0 108.406 179.568 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.469 ' O ' HD12 ' A' ' 120' ' ' LEU . 0.6 OUTLIER -139.53 160.84 38.91 Favored 'General case' 0 C--O 1.2 -1.518 0 O-C-N 128.372 3.545 . . . . 0.0 105.541 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.473 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -159.11 59.66 0.41 Allowed 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 126.795 3.188 . . . . 0.0 110.185 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.97 -69.97 0.5 Allowed Glycine 0 N--CA 1.435 -1.397 0 CA-C-N 110.282 -3.145 . . . . 0.0 111.075 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -162.45 64.13 0.22 Allowed 'General case' 0 C--O 1.206 -1.228 0 CA-C-N 110.646 -2.777 . . . . 0.0 109.197 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -158.09 36.96 0.25 Allowed 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 111.336 -2.665 . . . . 0.0 105.562 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.519 HG13 ' O ' ' A' ' 126' ' ' VAL . 7.9 p -35.06 111.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 O-C-N 128.847 3.842 . . . . 0.0 113.792 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.6 t -89.71 119.44 30.12 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 119.352 -2.092 . . . . 0.0 107.577 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -106.55 111.46 24.02 Favored 'General case' 0 N--CA 1.477 0.913 1 O-C-N 129.3 4.125 . . . . 0.0 110.678 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -108.76 164.89 11.98 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 126.175 2.172 . . . . 0.0 112.763 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -127.1 157.19 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 N-CA-C 103.24 -2.874 . . . . 0.0 103.24 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -136.22 173.51 11.63 Favored 'General case' 0 CA--C 1.477 -1.863 0 CA-C-N 108.712 -3.858 . . . . 0.0 117.84 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.321 0.5 OUTLIER -162.17 97.02 1.01 Allowed 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 110.575 -3.011 . . . . 0.0 103.827 -179.621 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.52 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 12.2 pttt -33.39 -44.42 0.14 Allowed 'General case' 0 C--O 1.198 -1.607 1 O-C-N 131.168 5.293 . . . . 0.0 117.521 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.447 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 30.0 ttmt . . . . . 0 CA--C 1.481 -1.698 0 CA-C-O 114.745 -2.55 . . . . 0.0 111.817 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.536 ' HB2' ' CH2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.508 -0.669 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -63.07 104.35 0.56 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 103.443 -2.799 . . . . 0.0 103.443 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -138.4 -177.59 4.92 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 111.684 -2.507 . . . . 0.0 104.96 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -178.54 145.72 0.33 Allowed 'General case' 0 C--O 1.22 -0.482 1 O-C-N 129.499 4.249 . . . . 0.0 111.554 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -176.23 -151.56 8.92 Favored Glycine 0 C--O 1.201 -1.923 0 CA-C-O 115.652 -2.749 . . . . 0.0 115.066 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 ' HD2' ' A' ' 134' ' ' LYS . 5.5 t -167.05 42.73 0.05 OUTLIER 'General case' 0 C--O 1.204 -1.32 1 O-C-N 134.444 6.614 . . . . 0.0 107.791 179.727 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.539 ' CZ2' HD12 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -34.42 136.74 0.13 Allowed 'General case' 0 C--O 1.242 0.673 1 O-C-N 132.073 5.858 . . . . 0.0 112.024 179.926 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.494 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.4 mt-10 -103.84 53.36 0.75 Allowed 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 117.715 -1.594 . . . . 0.0 110.934 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.421 ' O ' ' N ' ' A' ' 13' ' ' SER . 15.8 ttp -4.92 67.28 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 O-C-N 128.978 3.924 . . . . 0.0 108.957 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.494 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.6 tt0 -12.82 -45.09 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.803 1 O-C-N 133.182 6.551 . . . . 0.0 112.427 -178.518 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 11' ' ' MET . 1.2 t -173.7 161.69 3.95 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 109.524 -3.489 . . . . 0.0 109.886 -179.734 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -116.08 156.61 26.09 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 109.686 -3.416 . . . . 0.0 112.735 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -117.77 -56.66 2.18 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 127.067 2.729 . . . . 0.0 110.609 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -116.68 113.41 22.6 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 119.8 -1.812 . . . . 0.0 107.822 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . 0.296 25.0 t80 -115.29 -47.41 2.85 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 127.659 3.6 . . . . 0.0 112.524 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -76.38 -48.75 18.78 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 110.969 -2.832 . . . . 0.0 114.274 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -53.4 -21.84 14.09 Favored Glycine 0 CA--C 1.484 -1.869 0 O-C-N 124.982 1.426 . . . . 0.0 113.465 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.512 ' N ' HE21 ' A' ' 125' ' ' GLN . 0.1 OUTLIER -69.14 -48.0 63.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.206 -1.775 . . . . 0.0 106.206 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.462 ' O ' HG22 ' A' ' 26' ' ' ILE . 1.7 mtm -70.42 -32.28 69.82 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 111.807 -2.451 . . . . 0.0 112.472 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.68 -23.39 56.21 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 128.569 2.748 . . . . 0.0 114.998 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.0 -32.13 50.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 110.226 -3.17 . . . . 0.0 108.804 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.49 HD13 ' HB2' ' A' ' 79' ' ' ASP 0.291 3.3 mt -74.03 -23.99 59.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 111.229 -2.714 . . . . 0.0 104.464 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 t70 63.24 58.86 1.35 Allowed 'General case' 0 C--O 1.216 -0.705 1 CA-C-O 128.514 4.006 . . . . 0.0 106.416 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.608 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 1.3 tt -71.72 -47.44 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.983 1 CA-C-N 106.73 -4.759 . . . . 0.0 110.594 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 178.59 123.25 0.05 OUTLIER 'General case' 0 C--N 1.361 1.102 0 CA-C-N 113.981 -1.463 . . . . 0.0 109.231 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.449 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 93.1 m-85 -72.65 121.71 20.23 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 117.093 -1.843 . . . . 0.0 114.512 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 78.93 51.65 0.03 OUTLIER 'General case' 0 C--O 1.209 -1.054 0 C-N-CA 126.995 2.118 . . . . 0.0 110.527 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.423 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.4 OUTLIER -87.67 -52.64 5.21 Favored 'General case' 0 C--N 1.355 0.848 2 O-C-N 130.018 4.574 . . . . 0.0 112.001 -179.921 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.535 ' HD3' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.25 -138.42 0.01 OUTLIER 'General case' 0 C--O 1.244 0.777 0 CA-C-O 112.437 -3.649 . . . . 0.0 111.92 -179.734 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.535 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER 98.18 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 O-C-N 128.633 3.708 . . . . 0.0 111.071 -179.864 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.694 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -117.44 8.42 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 1 O-C-N 131.057 5.223 . . . . 0.0 110.383 -179.787 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -116.28 22.04 13.17 Favored 'General case' 0 C--N 1.346 0.429 0 O-C-N 124.735 1.272 . . . . 0.0 107.779 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.4 t -49.77 -36.37 11.15 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.344 0 CA-C-O 123.881 1.801 . . . . 0.0 111.483 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.58 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.5 OUTLIER 171.36 128.7 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.828 1 CA-C-N 108.22 -4.082 . . . . 0.0 110.858 179.837 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 37' ' ' LEU . 1.4 mt -97.74 -50.24 4.53 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 129.038 3.961 . . . . 0.0 104.049 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.3 m -170.23 142.96 2.31 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.727 5.642 . . . . 0.0 112.008 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.533 ' HG2' ' N ' ' A' ' 40' ' ' THR . 0.1 OUTLIER -125.03 150.43 46.76 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 126.074 2.109 . . . . 0.0 114.853 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.533 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 66.2 m 178.23 109.11 0.03 OUTLIER 'General case' 0 N--CA 1.433 -1.287 1 O-C-N 129.478 4.237 . . . . 0.0 111.904 178.815 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.89 152.56 19.63 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 127.928 3.267 . . . . 0.0 105.272 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 43' ' ' ILE . 5.1 mp -137.48 157.81 34.3 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.369 0 C-N-CA 117.635 -1.626 . . . . 0.0 110.467 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.552 HG12 ' CE1' ' A' ' 50' ' ' PHE 0.251 3.4 tt -136.43 125.71 38.14 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 2 O-C-N 131.646 5.591 . . . . 0.0 109.07 -179.685 . . . . . . . . 4 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 59.7 t -124.94 102.97 11.61 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 CA-C-N 111.837 -2.438 . . . . 0.0 111.988 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.593 ' HG3' ' CD1' ' A' ' 50' ' ' PHE . 9.6 mt-30 -121.83 89.47 3.13 Favored 'General case' 0 CA--C 1.488 -1.429 0 CA-C-O 125.137 2.399 . . . . 0.0 114.743 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -78.64 -8.41 58.63 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-N 108.788 -3.824 . . . . 0.0 113.006 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.51 -106.8 0.25 Allowed Glycine 0 C--O 1.203 -1.841 0 CA-C-O 123.504 1.613 . . . . 0.0 113.741 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.559 ' O ' HG23 ' A' ' 67' ' ' VAL . 2.0 m-20 -98.62 -1.19 41.47 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 112.728 -1.736 . . . . 0.0 113.059 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.88 90.25 3.3 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 127.793 3.183 . . . . 0.0 108.907 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.593 ' CD1' ' HG3' ' A' ' 45' ' ' GLN . 6.4 t80 -96.44 103.66 15.58 Favored 'General case' 0 CA--C 1.496 -1.108 0 O-C-N 128.278 3.486 . . . . 0.0 113.305 -179.358 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.0 73.25 1.01 Allowed 'General case' 0 CA--C 1.496 -1.124 0 O-C-N 128.169 3.418 . . . . 0.0 118.202 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.633 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -52.28 165.55 0.23 Allowed 'General case' 0 C--N 1.358 0.95 0 CA-C-N 112.221 -2.263 . . . . 0.0 108.87 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.511 ' N ' HG23 ' A' ' 52' ' ' THR . 0.0 OUTLIER -170.91 153.31 3.84 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 114.843 -2.743 . . . . 0.0 106.653 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.406 HG22 ' HA ' ' A' ' 60' ' ' ASN . 0.7 OUTLIER -108.11 152.34 24.66 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 127.382 2.927 . . . . 0.0 107.847 178.902 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -104.84 10.44 34.44 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 125.562 1.789 . . . . 0.0 115.258 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.533 ' HB3' ' CD1' ' A' ' 58' ' ' PHE . 54.4 m -44.35 152.2 0.21 Allowed 'General case' 0 N--CA 1.477 0.924 1 O-C-N 129.199 4.062 . . . . 0.0 105.513 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.552 HG23 HD12 ' A' ' 37' ' ' LEU 0.266 7.3 t -83.51 -35.24 25.0 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-N 111.752 -2.476 . . . . 0.0 110.719 -179.049 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.651 ' CE2' HD21 ' A' ' 37' ' ' LEU 0.251 0.0 OUTLIER -60.2 -38.34 83.02 Favored 'General case' 0 C--N 1.366 1.301 0 O-C-N 126.811 2.57 . . . . 0.0 111.524 -179.475 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 168.57 162.43 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.516 1 O-C-N 130.723 5.014 . . . . 0.0 112.05 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.406 ' HA ' HG22 ' A' ' 54' ' ' THR . 1.6 m-20 -113.38 127.65 56.2 Favored 'General case' 0 C--O 1.209 -1.074 1 O-C-N 130.366 4.791 . . . . 0.0 107.903 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -106.38 28.42 7.79 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 126.331 2.269 . . . . 0.0 108.39 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -13.62 112.52 0.02 OUTLIER 'General case' 0 C--O 1.205 -1.257 1 O-C-N 130.287 4.742 . . . . 0.0 117.502 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.832 HD21 ' CZ ' ' A' ' 65' ' ' PHE . 9.9 tt -68.16 121.82 16.99 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 127.503 3.002 . . . . 0.0 108.796 177.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -141.02 83.08 1.87 Allowed 'General case' 0 CA--C 1.485 -1.549 0 C-N-CA 113.956 -3.098 . . . . 0.0 112.237 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.947 ' CD1' HG21 ' A' ' 87' ' ' VAL . 5.3 p90 -142.49 167.42 22.14 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 126.076 2.846 . . . . 0.0 110.926 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -119.88 157.3 29.02 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 112.647 -2.069 . . . . 0.0 108.115 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 48' ' ' ASP . 1.9 t -51.67 141.74 4.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.119 0 O-C-N 127.027 2.705 . . . . 0.0 115.085 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 23.37 47.55 0.01 OUTLIER Glycine 0 CA--C 1.5 -0.875 1 O-C-N 131.501 5.5 . . . . 0.0 117.857 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -97.84 0.12 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 59.03 73.59 0.48 Allowed 'General case' 0 C--N 1.357 0.892 0 O-C-N 128.947 3.904 . . . . 0.0 109.254 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.46 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 5.3 t80 -67.59 138.14 56.21 Favored 'General case' 0 N--CA 1.451 -0.405 2 O-C-N 129.602 4.314 . . . . 0.0 116.652 -179.801 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -112.79 93.63 4.52 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 113.171 -1.832 . . . . 0.0 110.62 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -72.39 154.21 41.02 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-O 126.517 3.056 . . . . 0.0 109.796 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -131.78 74.15 1.57 Allowed 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 108.984 -3.735 . . . . 0.0 109.764 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 70.3 p -49.85 -79.49 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 114.265 -2.779 . . . . 0.0 116.19 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 13.0 97.32 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.816 1 O-C-N 129.656 4.347 . . . . 0.0 115.782 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 142.01 -29.14 2.22 Favored Glycine 0 C--O 1.213 -1.212 0 CA-C-N 110.345 -3.116 . . . . 0.0 107.666 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.608 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 12.6 tp -141.13 50.01 1.63 Allowed 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 108.481 -3.86 . . . . 0.0 115.395 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.498 ' N ' HD12 ' A' ' 26' ' ' ILE . 5.6 t70 151.73 -67.78 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.893 1.996 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.03 65.28 1.18 Allowed Glycine 0 C--O 1.229 -0.217 0 O-C-N 126.235 2.21 . . . . 0.0 112.818 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.46 ' CG ' ' N ' ' A' ' 82' ' ' ASN 0.267 3.3 tpt180 -139.97 -122.05 0.12 Allowed 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 113.836 -2.983 . . . . 0.0 112.936 -179.721 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.46 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER 156.15 101.81 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 O-C-N 128.299 3.499 . . . . 0.0 108.665 -179.275 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.771 HG13 ' HA2' ' A' ' 100' ' ' GLY . 1.9 t -134.33 165.18 32.29 Favored 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 127.043 2.714 . . . . 0.0 117.684 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.48 ' N ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -75.24 163.88 27.05 Favored 'General case' 0 C--O 1.218 -0.56 2 O-C-N 133.426 6.704 . . . . 0.0 107.503 179.19 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.46 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.1 m -168.76 98.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.983 1 O-C-N 130.799 5.062 . . . . 0.0 110.152 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.06 93.55 7.44 Favored 'General case' 0 C--O 1.209 -1.043 2 O-C-N 130.911 5.132 . . . . 0.0 116.626 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.947 HG21 ' CD1' ' A' ' 65' ' ' PHE . 26.1 t -68.4 131.66 33.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.197 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -157.95 160.77 37.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 124.188 1.947 . . . . 0.0 111.711 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.741 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 70.3 m95 -88.8 142.5 27.61 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 114.649 -2.596 . . . . 0.0 106.708 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.871 ' HB2' HG23 ' A' ' 93' ' ' THR . 0.0 OUTLIER -92.76 -60.37 1.83 Allowed 'General case' 0 CA--C 1.48 -1.718 1 CA-C-O 132.477 5.894 . . . . 0.0 113.456 179.552 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.02 61.72 0.03 OUTLIER Glycine 0 CA--C 1.542 1.778 1 CA-C-N 107.84 -4.255 . . . . 0.0 104.428 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 92.39 66.08 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.038 1 O-C-N 132.388 5.405 . . . . 0.0 105.701 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.871 HG23 ' HB2' ' A' ' 90' ' ' GLU . 1.9 t 166.21 141.95 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 50' ' ' PHE . 4.8 tp -86.05 106.5 17.25 Favored 'General case' 0 CA--C 1.487 -1.458 1 O-C-N 131.239 5.337 . . . . 0.0 114.161 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.735 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.376 40.8 t -109.87 148.68 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.014 0 CA-C-N 109.385 -3.552 . . . . 0.0 114.418 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.22 133.07 17.0 Favored 'General case' 0 C--O 1.219 -0.532 0 O-C-N 125.739 1.899 . . . . 0.0 106.544 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.8 t -103.11 73.46 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.598 0 CA-C-N 110.133 -3.212 . . . . 0.0 115.256 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.575 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 1.8 mm-40 -53.36 101.4 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 122.383 1.087 . . . . 0.0 109.084 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -95.98 98.23 10.22 Favored 'General case' 0 C--O 1.205 -1.254 0 CA-C-N 109.315 -3.584 . . . . 0.0 112.358 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.771 ' HA2' HG13 ' A' ' 83' ' ' VAL . . . -94.19 -136.72 8.32 Favored Glycine 0 C--O 1.212 -1.239 0 O-C-N 127.94 3.275 . . . . 0.0 111.063 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -154.66 -47.39 0.09 Allowed 'General case' 0 CA--C 1.502 -0.891 1 CA-C-N 107.695 -4.252 . . . . 0.0 109.631 179.675 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.433 ' HD3' ' C ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -101.86 3.6 39.4 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 123.408 1.575 . . . . 0.0 115.033 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.78 174.62 13.64 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 110.222 -3.172 . . . . 0.0 117.307 -179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.2 96.59 5.15 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 108.838 -3.801 . . . . 0.0 101.637 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.525 ' HB3' ' NE2' ' A' ' 98' ' ' GLN . 12.2 mmm-85 -87.68 -2.41 58.59 Favored 'General case' 0 C--O 1.208 -1.122 1 O-C-N 129.506 4.254 . . . . 0.0 111.593 -179.693 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.575 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.66 95.52 0.01 OUTLIER Glycine 0 C--O 1.208 -1.501 2 O-C-N 133.719 6.887 . . . . 0.0 115.551 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.517 ' CD1' ' C ' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -110.46 137.69 47.83 Favored 'General case' 0 C--N 1.319 -0.754 1 O-C-N 130.997 4.586 . . . . 0.0 108.242 178.04 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -163.19 177.84 8.72 Favored 'General case' 0 CA--C 1.506 -0.717 1 O-C-N 130.454 4.846 . . . . 0.0 111.403 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.532 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -139.71 -174.33 3.87 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 113.849 -2.977 . . . . 0.0 108.133 -179.529 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.431 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.2 OUTLIER 179.4 89.17 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.235 1 O-C-N 130.377 4.798 . . . . 0.0 117.683 178.961 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . 0.25 70.3 t -34.71 104.57 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-O 125.051 2.358 . . . . 0.0 112.187 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.526 ' HG2' ' CD2' ' A' ' 117' ' ' TYR . 0.7 OUTLIER -107.29 28.87 7.66 Favored 'General case' 0 CA--C 1.478 -1.811 0 CA-C-N 111.534 -2.575 . . . . 0.0 117.81 -179.633 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.42 95.36 0.84 Allowed Glycine 0 C--O 1.21 -1.392 0 O-C-N 119.576 -1.952 . . . . 0.0 117.944 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 61.83 35.03 16.77 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 165.19 154.91 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.153 1 O-C-N 130.729 5.018 . . . . 0.0 110.015 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.539 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 1.1 mt -91.69 -172.75 3.32 Favored 'General case' 0 CA--C 1.484 -1.575 0 O-C-N 127.378 2.924 . . . . 0.0 112.399 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.526 ' CD2' ' HG2' ' A' ' 112' ' ' GLU . 0.0 OUTLIER -150.46 83.86 1.36 Allowed 'General case' 0 C--N 1.362 1.142 0 CA-C-N 111.659 -2.519 . . . . 0.0 113.182 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.479 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -73.33 88.14 1.54 Allowed 'General case' 0 N--CA 1.475 0.778 2 CA-C-N 107.989 -4.187 . . . . 0.0 109.562 -179.894 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -100.47 102.34 13.5 Favored 'General case' 0 CA--C 1.499 -0.985 0 O-C-N 128.863 3.852 . . . . 0.0 109.803 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.516 HD11 ' SG ' ' A' ' 122' ' ' CYS . 0.2 OUTLIER -121.52 155.27 35.33 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 128.136 3.397 . . . . 0.0 109.347 -179.847 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.1 t -133.59 154.76 50.63 Favored 'General case' 0 C--N 1.311 -1.103 1 O-C-N 129.56 4.288 . . . . 0.0 104.759 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.516 ' SG ' HD11 ' A' ' 120' ' ' LEU 0.273 2.8 m -139.43 39.78 2.06 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.887 1.327 . . . . 0.0 110.962 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 132.93 -57.51 0.71 Allowed Glycine 0 CA--C 1.526 0.781 0 CA-C-N 111.696 -2.502 . . . . 0.0 108.526 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -172.77 49.64 0.02 OUTLIER 'General case' 0 CA--C 1.491 -1.294 0 CA-C-N 109.845 -3.177 . . . . 0.0 106.955 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.512 HE21 ' N ' ' A' ' 20' ' ' TYR . 1.4 tm0? -103.38 -22.93 13.6 Favored 'General case' 0 C--O 1.208 -1.122 0 C-N-CA 116.666 -2.014 . . . . 0.0 110.369 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 126' ' ' VAL . 11.8 p 27.1 63.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 CA-C-O 125.297 2.475 . . . . 0.0 117.11 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.412 ' N ' ' O ' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -57.71 149.29 22.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 118.923 -2.361 . . . . 0.0 108.191 -179.691 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -135.09 87.71 2.36 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 128.181 3.426 . . . . 0.0 111.002 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -83.02 164.52 20.3 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.42 139.45 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 123.963 1.839 . . . . 0.0 106.078 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.479 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 39.6 m-85 -123.02 179.66 4.59 Favored 'General case' 0 CA--C 1.492 -1.263 0 CA-C-O 126.716 3.15 . . . . 0.0 117.42 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.415 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.297 0.0 OUTLIER -165.76 122.41 1.39 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 109.903 -3.317 . . . . 0.0 104.473 -179.936 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.492 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 19.7 ttpt -71.6 57.35 0.28 Allowed 'General case' 0 C--O 1.202 -1.445 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.518 ' HD2' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.796 0 N-CA-C 117.976 2.584 . . . . 0.0 117.976 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.462 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 17.0 mttt . . . . . 0 N--CA 1.446 -0.664 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.71 104.53 5.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 104.006 -2.59 . . . . 0.0 104.006 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . 0.262 7.7 mt-30 -139.39 145.75 39.33 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 103.616 -2.735 . . . . 0.0 103.616 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 156.7 126.16 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.919 1 O-C-N 131.571 5.545 . . . . 0.0 112.108 179.944 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 150.48 -169.91 30.39 Favored Glycine 0 C--O 1.2 -1.97 0 O-C-N 127.054 2.721 . . . . 0.0 110.224 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.553 HG23 HG23 ' A' ' 40' ' ' THR . 0.9 OUTLIER -129.57 145.08 51.51 Favored 'General case' 0 C--N 1.318 -0.8 1 O-C-N 131.963 5.155 . . . . 0.0 107.664 -179.962 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.573 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -138.04 109.2 6.82 Favored 'General case' 0 CA--C 1.498 -1.028 1 O-C-N 131.199 5.312 . . . . 0.0 112.177 -179.773 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -56.02 -15.25 3.28 Favored 'General case' 0 C--N 1.316 -0.863 0 O-C-N 126.828 2.58 . . . . 0.0 115.415 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.9 ttp 59.02 81.49 0.16 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -35.27 -43.95 0.25 Allowed 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 128.879 3.862 . . . . 0.0 110.993 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.268 4.8 p -157.97 162.76 38.23 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 112.046 -2.343 . . . . 0.0 111.535 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -132.3 124.8 29.56 Favored 'General case' 0 CA--C 1.482 -1.664 1 CA-C-N 107.898 -4.228 . . . . 0.0 112.223 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.33 -149.42 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 128.173 3.42 . . . . 0.0 107.65 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -44.61 139.47 2.86 Favored 'General case' 0 C--O 1.2 -1.514 0 CA-C-N 119.551 1.069 . . . . 0.0 112.815 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -126.75 -44.27 1.67 Allowed 'General case' 0 C--O 1.197 -1.669 0 CA-C-O 125.695 2.664 . . . . 0.0 111.648 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.66 -22.17 47.2 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-N 111.348 -2.66 . . . . 0.0 115.542 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.81 -31.03 62.84 Favored Glycine 0 N--CA 1.474 1.21 0 O-C-N 128.129 3.393 . . . . 0.0 108.29 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.424 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -70.12 -34.32 72.95 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-O 124.7 2.191 . . . . 0.0 108.958 -179.906 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.596 ' O ' HG22 ' A' ' 26' ' ' ILE . 2.1 mtm -73.16 -24.09 60.52 Favored 'General case' 0 CA--C 1.484 -1.568 0 C-N-CA 114.749 -2.78 . . . . 0.0 113.765 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -78.33 -24.33 46.61 Favored 'General case' 0 CA--C 1.538 0.512 1 O-C-N 132.184 5.928 . . . . 0.0 110.585 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.38 -32.18 73.69 Favored 'General case' 0 C--O 1.202 -1.406 1 O-C-N 130.664 4.978 . . . . 0.0 112.857 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.424 HD23 ' O ' ' A' ' 20' ' ' TYR . 0.7 OUTLIER -118.56 19.93 13.13 Favored 'General case' 0 N--CA 1.472 0.634 1 O-C-N 129.411 4.194 . . . . 0.0 107.42 179.648 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.35 -64.03 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 128.37 3.544 . . . . 0.0 112.675 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.596 HG22 ' O ' ' A' ' 21' ' ' MET . 8.3 tt 36.65 34.42 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.828 1 CA-C-O 129.095 4.283 . . . . 0.0 113.768 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.88 175.08 0.13 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 109.415 -3.539 . . . . 0.0 111.786 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.439 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.9 m-85 -112.65 168.78 9.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 113.703 -1.589 . . . . 0.0 113.476 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 83.71 103.37 0.05 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.442 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.8 OUTLIER 176.81 -45.63 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.394 2.934 . . . . 0.0 112.625 -179.753 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 30' ' ' THR . 0.0 OUTLIER -53.25 -9.37 0.16 Allowed 'General case' 0 CA--C 1.497 -1.074 0 C-N-CA 129.698 3.199 . . . . 0.0 114.458 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -31.47 27.36 Favored 'General case' 0 CA--C 1.482 -1.668 0 C-N-CA 117.212 -1.795 . . . . 0.0 114.365 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.714 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -135.11 15.26 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.913 1 O-C-N 129.45 4.219 . . . . 0.0 114.877 -179.925 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -114.94 12.47 16.82 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 118.919 -1.113 . . . . 0.0 112.469 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.4 t -52.7 -39.18 29.58 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.527 0 CA-C-O 122.888 1.328 . . . . 0.0 111.983 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.723 ' C ' HD23 ' A' ' 37' ' ' LEU . 1.0 OUTLIER 173.93 131.74 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 108.493 -3.958 . . . . 0.0 111.178 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.819 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -101.68 -60.56 1.51 Allowed 'General case' 0 N--CA 1.435 -1.194 1 O-C-N 129.676 4.36 . . . . 0.0 105.798 -179.523 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.52 HG22 ' O ' ' A' ' 38' ' ' THR . 22.1 m -153.23 36.63 0.47 Allowed 'General case' 0 CA--C 1.489 -1.399 1 O-C-N 131.102 5.251 . . . . 0.0 112.032 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.442 ' HB3' ' HD3' ' A' ' 36' ' ' ARG . 6.7 tt0 -63.59 118.22 7.9 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 116.355 1.983 . . . . 0.0 116.355 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.553 HG23 HG23 ' A' ' 8' ' ' THR . 1.4 m -121.99 132.61 54.62 Favored 'General case' 0 C--O 1.204 -1.306 1 O-C-N 129.246 4.091 . . . . 0.0 110.183 179.312 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -107.87 141.4 39.52 Favored 'General case' 0 N--CA 1.475 0.811 1 O-C-N 129.372 4.17 . . . . 0.0 107.497 -179.84 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.659 HD13 ' CD ' ' A' ' 53' ' ' LYS . 2.9 mp -132.46 155.44 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 O-C-N 126.788 2.555 . . . . 0.0 110.776 179.246 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.515 ' N ' HG22 ' A' ' 42' ' ' ILE . 13.4 tt -132.94 129.02 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.543 0 CA-C-O 126.139 2.876 . . . . 0.0 109.46 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.427 ' O ' HG12 ' A' ' 44' ' ' VAL . 3.0 t -124.56 48.46 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.372 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -55.97 108.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.563 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -123.64 14.29 9.42 Favored 'General case' 0 CA--C 1.476 -1.877 1 O-C-N 129.532 4.27 . . . . 0.0 117.751 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.32 103.28 2.71 Favored Glycine 0 C--O 1.214 -1.156 0 C-N-CA 119.282 -1.437 . . . . 0.0 112.153 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 73.09 -65.47 0.35 Allowed 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 127.821 2.719 . . . . 0.0 112.072 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -96.81 86.72 4.11 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 129.054 3.971 . . . . 0.0 109.818 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.526 ' CD2' HD13 ' A' ' 94' ' ' LEU . 1.7 t80 -98.1 109.91 22.59 Favored 'General case' 0 N--CA 1.475 0.8 1 O-C-N 130.39 4.806 . . . . 0.0 110.999 -179.869 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -120.25 99.46 6.6 Favored 'General case' 0 CA--C 1.487 -1.477 1 O-C-N 129.885 4.49 . . . . 0.0 119.933 -179.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.539 HG22 ' CB ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -72.71 173.62 8.78 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 126.921 2.638 . . . . 0.0 106.506 178.224 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.659 ' CD ' HD13 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -172.53 145.64 1.62 Allowed 'General case' 0 CA--C 1.488 -1.423 0 C-N-CA 115.975 -2.29 . . . . 0.0 111.515 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.3 t -98.13 126.82 43.75 Favored 'General case' 0 CA--C 1.496 -1.104 0 O-C-N 128.209 3.443 . . . . 0.0 109.68 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -96.76 35.11 1.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.407 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 0.9 OUTLIER -79.88 110.11 14.94 Favored 'General case' 0 N--CA 1.473 0.687 1 O-C-N 130.187 4.68 . . . . 0.0 105.176 179.642 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.47 -36.97 46.58 Favored 'General case' 0 C--O 1.209 -1.027 1 O-C-N 129.759 4.412 . . . . 0.0 108.407 -179.638 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.515 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 1.2 p90 -74.63 -23.83 58.75 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -173.77 100.76 0.11 Allowed 'General case' 0 C--O 1.21 -0.993 1 O-C-N 131.417 5.448 . . . . 0.0 116.389 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -107.52 89.79 3.1 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 108.802 -3.817 . . . . 0.0 105.718 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -77.36 -29.08 53.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.37 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 t0 69.16 131.5 0.03 OUTLIER 'General case' 0 CA--C 1.499 -0.993 0 O-C-N 127.435 2.959 . . . . 0.0 112.902 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.539 ' CB ' HG22 ' A' ' 52' ' ' THR . 3.9 tp -100.32 58.93 0.98 Allowed 'General case' 0 C--O 1.214 -0.805 0 O-C-N 125.102 1.501 . . . . 0.0 109.868 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -99.43 98.66 9.55 Favored 'General case' 0 C--O 1.203 -1.388 0 O-C-N 126.911 2.632 . . . . 0.0 112.89 -178.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.527 ' CE2' ' CZ2' ' A' ' 107' ' ' TRP . 6.8 p90 -132.73 -179.16 5.29 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 124.031 1.872 . . . . 0.0 106.396 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.761 HG22 HG23 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -129.87 155.72 45.54 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 104.165 -2.532 . . . . 0.0 104.165 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 p -78.77 135.12 26.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.072 0 O-C-N 126.775 2.547 . . . . 0.0 114.344 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 23.59 75.97 Favored Glycine 0 N--CA 1.488 2.129 0 C-N-CA 116.372 -2.823 . . . . 0.0 116.103 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.761 HG23 HG22 ' A' ' 66' ' ' THR . 3.0 t -73.28 -25.16 21.11 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.89 74.59 0.4 Allowed 'General case' 0 C--N 1.364 1.203 1 O-C-N 130.458 4.848 . . . . 0.0 109.509 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.449 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 4.4 m-85 -43.83 147.47 0.46 Allowed 'General case' 0 CA--C 1.503 -0.865 0 O-C-N 128.277 3.485 . . . . 0.0 118.324 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -107.63 56.31 0.64 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 115.995 -1.955 . . . . 0.0 112.491 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.604 ' CB ' ' CA ' ' A' ' 83' ' ' VAL . 0.6 OUTLIER 19.16 84.47 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.813 1 CA-C-O 129.267 4.365 . . . . 0.0 114.544 179.765 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.415 ' H ' ' HB2' ' A' ' 82' ' ' ASN . 47.1 t60 -169.7 125.69 0.85 Allowed 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 109.518 -3.492 . . . . 0.0 118.057 178.131 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.53 HG22 ' CB ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -161.64 168.82 22.73 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.143 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.46 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -152.91 161.89 41.98 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 125.652 2.644 . . . . 0.0 114.514 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.83 -7.1 82.33 Favored Glycine 0 C--O 1.217 -0.91 0 CA-C-N 111.155 -2.748 . . . . 0.0 113.475 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.627 HD23 HH22 ' A' ' 105' ' ' ARG . 2.8 tp -123.67 -63.88 1.19 Allowed 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -118.78 -58.15 1.98 Allowed 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 113.762 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.58 64.26 0.59 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 127.715 2.578 . . . . 0.0 110.949 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ttm105 151.64 146.38 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 O-C-N 128.556 3.151 . . . . 0.0 109.142 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.53 ' CB ' HG22 ' A' ' 75' ' ' THR . 0.0 OUTLIER -132.45 5.89 4.08 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.676 -178.463 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.604 ' CA ' ' CB ' ' A' ' 73' ' ' GLU 0.32 16.2 t 49.49 178.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 1 O-C-N 130.199 4.687 . . . . 0.0 116.177 -178.936 . . . . . . . . 4 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.587 ' N ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -76.85 82.2 3.43 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 124.193 1.949 . . . . 0.0 106.71 177.929 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.494 HG23 ' SG ' ' A' ' 96' ' ' CYS . 83.6 m -93.09 69.14 4.41 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 109.305 -3.589 . . . . 0.0 117.209 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 3.9 tt -63.6 150.89 43.1 Favored 'General case' 0 N--CA 1.432 -1.366 2 CA-C-N 106.631 -4.804 . . . . 0.0 110.338 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.7 t -130.58 143.02 42.19 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.108 0 C-N-CA 124.374 1.07 . . . . 0.0 109.308 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.1 173.47 14.3 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-O 125.854 2.74 . . . . 0.0 111.848 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.706 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 60.1 m95 -92.78 154.02 18.54 Favored 'General case' 0 CA--C 1.508 -0.672 0 C-N-CA 128.537 2.735 . . . . 0.0 106.473 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.51 ' HG3' ' CG2' ' A' ' 95' ' ' VAL . 0.3 OUTLIER -111.13 -52.23 2.8 Favored 'General case' 0 CA--C 1.485 -1.533 1 CA-C-O 129.735 4.588 . . . . 0.0 115.976 179.588 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 156.91 84.82 0.05 OUTLIER Glycine 0 C--O 1.196 -2.248 2 N-CA-C 101.829 -4.508 . . . . 0.0 101.829 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 67.37 46.15 1.48 Allowed 'General case' 0 C--O 1.216 -0.67 1 O-C-N 136.371 7.748 . . . . 0.0 110.211 -179.724 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.459 HG23 ' N ' ' A' ' 94' ' ' LEU . 0.5 OUTLIER -179.19 157.36 0.82 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 179.379 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.526 HD13 ' CD2' ' A' ' 50' ' ' PHE . 1.6 tp -87.68 136.57 32.9 Favored 'General case' 0 CA--C 1.477 -1.863 1 O-C-N 130.898 5.124 . . . . 0.0 114.044 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.51 ' CG2' ' HG3' ' A' ' 90' ' ' GLU 0.361 54.8 t -144.64 134.49 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.114 0 CA-C-N 112.387 -2.188 . . . . 0.0 116.737 179.738 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.494 ' SG ' HG23 ' A' ' 85' ' ' THR . 0.0 OUTLIER -136.67 148.94 47.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.844 2.59 . . . . 0.0 104.394 179.622 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.3 t -125.93 83.23 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.937 0 N-CA-C 118.224 2.675 . . . . 0.0 118.224 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.434 ' HG3' ' C ' ' A' ' 105' ' ' ARG . 2.6 mt-30 -58.3 105.17 0.26 Allowed 'General case' 0 C--N 1.359 0.987 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -139.08 86.83 2.16 Favored 'General case' 0 C--O 1.203 -1.392 0 O-C-N 128.775 3.797 . . . . 0.0 114.669 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 83' ' ' VAL . . . -149.7 -66.63 0.01 OUTLIER Glycine 0 C--N 1.342 0.892 0 CA-C-O 125.827 2.904 . . . . 0.0 109.367 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.81 169.8 9.61 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 108.682 -3.759 . . . . 0.0 112.222 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.43 -63.84 0.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 127.551 3.032 . . . . 0.0 114.868 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -59.7 145.56 44.52 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 111.21 -2.723 . . . . 0.0 117.714 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -111.24 87.74 2.62 Favored 'General case' 0 N--CA 1.49 1.56 1 CA-C-N 107.869 -4.241 . . . . 0.0 101.756 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.627 HH22 HD23 ' A' ' 78' ' ' LEU . 1.3 mmm180 -104.91 3.72 31.15 Favored 'General case' 0 C--O 1.199 -1.591 1 O-C-N 132.227 5.955 . . . . 0.0 113.198 -179.117 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -55.13 107.91 0.86 Allowed Glycine 0 N--CA 1.426 -2.002 2 CA-C-N 106.192 -5.004 . . . . 0.0 114.896 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.527 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE 0.262 0.0 OUTLIER -96.56 148.55 22.72 Favored 'General case' 0 C--O 1.207 -1.172 0 O-C-N 128.266 2.98 . . . . 0.0 110.38 179.344 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.453 ' N ' ' CD1' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -163.51 176.91 9.28 Favored 'General case' 0 C--O 1.2 -1.509 1 O-C-N 129.106 4.004 . . . . 0.0 113.423 -178.82 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.516 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -147.2 175.6 10.62 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.845 -2.434 . . . . 0.0 108.95 -179.48 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.462 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.1 OUTLIER -172.28 39.5 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.01 1 O-C-N 129.172 4.045 . . . . 0.0 117.816 179.863 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.401 HG22 HD12 ' A' ' 116' ' ' LEU 0.255 12.8 t 6.92 82.66 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.227 0 C-N-CA 127.55 2.34 . . . . 0.0 115.009 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -84.03 32.14 0.49 Allowed 'General case' 0 CA--C 1.488 -1.419 0 N-CA-C 117.205 2.298 . . . . 0.0 117.205 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 93.56 105.52 1.77 Allowed Glycine 0 C--O 1.21 -1.399 0 N-CA-C 117.409 1.724 . . . . 0.0 117.409 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 1.4 m-20 58.04 15.93 3.48 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 118.66 2.837 . . . . 0.0 118.66 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.424 ' HD2' ' HB2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -167.58 156.35 9.66 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 129.04 3.963 . . . . 0.0 110.13 -179.634 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.401 HD12 HG22 ' A' ' 111' ' ' VAL . 0.4 OUTLIER -111.97 106.32 14.98 Favored 'General case' 0 CA--C 1.482 -1.646 0 O-C-N 128.254 3.471 . . . . 0.0 117.574 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.421 ' CE2' ' HE2' ' A' ' 115' ' ' LYS . 1.2 m-85 -66.34 99.54 0.56 Allowed 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 116.238 -2.185 . . . . 0.0 115.985 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.08 70.8 8.44 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 114.881 -2.727 . . . . 0.0 106.498 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -83.93 111.86 19.63 Favored 'General case' 0 CA--C 1.502 -0.901 0 O-C-N 127.488 2.993 . . . . 0.0 111.268 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.75 156.21 43.9 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 128.651 3.72 . . . . 0.0 110.952 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.403 HG22 ' H ' ' A' ' 123' ' ' GLY . 59.4 m -112.24 160.26 17.79 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 126.951 2.657 . . . . 0.0 105.438 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.9 m -146.18 25.52 1.25 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 120.411 1.46 . . . . 0.0 112.799 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLY . . . . . 0.403 ' H ' HG22 ' A' ' 121' ' ' THR . . . 106.68 29.37 4.72 Favored Glycine 0 N--CA 1.437 -1.235 0 O-C-N 125.834 1.959 . . . . 0.0 114.49 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 126.39 -31.18 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 130.169 3.387 . . . . 0.0 110.996 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -79.15 81.97 5.36 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 128.132 3.395 . . . . 0.0 111.653 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.489 ' O ' HG12 ' A' ' 126' ' ' VAL . 39.1 t -68.34 94.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-N 110.068 -3.242 . . . . 0.0 111.489 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.1 m -72.75 106.12 4.6 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 116.289 -1.815 . . . . 0.0 109.884 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.9 75.98 4.19 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 128.309 3.505 . . . . 0.0 112.917 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -56.54 146.7 24.14 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 115.573 -2.156 . . . . 0.0 110.442 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.2 t -122.63 100.63 8.49 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.424 ' HB2' ' HD2' ' A' ' 115' ' ' LYS . 6.0 m-85 -75.93 176.18 8.11 Favored 'General case' 0 CA--C 1.48 -1.748 0 CA-C-N 109.753 -3.385 . . . . 0.0 116.878 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.423 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.411 0.0 OUTLIER -171.05 110.14 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 110.393 -3.094 . . . . 0.0 103.747 179.795 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.56 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 32.3 ttpt -49.58 127.78 16.28 Favored 'General case' 0 C--O 1.218 -0.576 1 O-C-N 130.149 4.655 . . . . 0.0 110.588 179.476 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 37.7 pttt . . . . . 0 CA--C 1.491 -1.322 0 O-C-N 126.903 2.627 . . . . 0.0 117.545 -179.561 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.489 ' HD3' ' CH2' ' A' ' 89' ' ' TRP . 1.1 ptpt . . . . . 0 CA--C 1.496 -1.112 0 N-CA-C 117.84 2.533 . . . . 0.0 117.84 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.27 116.43 31.93 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 102.848 -3.019 . . . . 0.0 102.848 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -133.13 -102.41 0.26 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 115.229 -2.32 . . . . 0.0 109.331 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 m120 35.38 41.4 0.09 Allowed 'General case' 0 C--N 1.307 -1.272 0 O-C-N 127.957 3.286 . . . . 0.0 114.427 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -101.43 -120.09 4.61 Favored Glycine 0 C--O 1.204 -1.766 0 CA-C-O 115.524 -2.82 . . . . 0.0 112.174 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.445 ' OG1' HG23 ' A' ' 42' ' ' ILE . 2.2 m 170.13 147.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.664 1 O-C-N 131.14 4.67 . . . . 0.0 104.132 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.588 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -142.68 91.68 2.33 Favored 'General case' 0 C--N 1.323 -0.577 1 O-C-N 133.422 6.701 . . . . 0.0 116.937 179.935 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 12' ' ' GLU . 10.6 mt-10 -61.66 111.87 2.01 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 116.321 -2.151 . . . . 0.0 107.945 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 37.0 ttp -61.4 74.24 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.715 0 O-C-N 127.096 2.748 . . . . 0.0 106.733 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.402 ' N ' ' O ' ' A' ' 10' ' ' GLU . 1.7 tt0 -23.67 -47.28 0.01 OUTLIER 'General case' 0 C--O 1.2 -1.502 0 O-C-N 128.285 3.491 . . . . 0.0 111.749 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.262 0.3 OUTLIER -145.08 152.2 39.72 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 109.013 -3.721 . . . . 0.0 111.573 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -116.31 104.46 11.51 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-N 109.716 -3.402 . . . . 0.0 112.976 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -50.85 31.82 Favored 'General case' 0 CA--C 1.503 -0.846 1 O-C-N 130.107 4.629 . . . . 0.0 112.364 179.892 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.465 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -161.05 150.34 16.78 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-O 125.239 2.447 . . . . 0.0 110.421 -179.797 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.51 ' CD1' ' N ' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -121.77 -58.15 1.76 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 124.926 2.298 . . . . 0.0 110.02 179.706 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 19' ' ' GLY . 9.2 pt-20 -71.32 -28.55 64.17 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 113.756 -1.566 . . . . 0.0 114.537 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.465 ' N ' ' OD1' ' A' ' 16' ' ' ASN . . . -70.71 -23.27 77.95 Favored Glycine 0 N--CA 1.488 2.148 0 O-C-N 128.549 3.656 . . . . 0.0 109.374 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.422 ' CD2' HD11 ' A' ' 120' ' ' LEU . 2.7 t80 -75.38 -28.28 59.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 119.049 1.425 . . . . 0.0 108.751 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.547 ' HG2' HG21 ' A' ' 26' ' ' ILE . 21.9 mtt -76.95 -33.3 57.69 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-N 113.245 -1.798 . . . . 0.0 107.838 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.481 ' HA ' ' CE ' ' A' ' 22' ' ' LYS . 4.7 mmpt? -68.59 -30.04 68.7 Favored 'General case' 0 C--O 1.203 -1.363 0 O-C-N 128.558 3.661 . . . . 0.0 114.159 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.5 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -73.48 -39.17 65.1 Favored 'General case' 0 C--O 1.208 -1.114 2 O-C-N 130.994 5.184 . . . . 0.0 114.773 179.688 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.614 HD12 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -103.7 0.24 30.33 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 127.627 3.079 . . . . 0.0 108.314 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 40.06 98.53 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.251 1 CA-C-O 129.32 4.39 . . . . 0.0 109.804 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.547 HG21 ' HG2' ' A' ' 21' ' ' MET . 6.4 tp -127.09 -45.01 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.108 0 CA-C-N 109.637 -3.438 . . . . 0.0 113.137 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -151.07 142.91 23.83 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 119.119 -2.238 . . . . 0.0 108.849 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.515 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 7.6 m-85 -80.95 65.33 6.05 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 72.19 73.47 0.16 Allowed 'General case' 0 C--O 1.203 -1.35 0 O-C-N 127.331 2.894 . . . . 0.0 107.848 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.15 -40.96 64.44 Favored 'General case' 0 N--CA 1.479 1.023 1 CA-C-N 106.658 -4.792 . . . . 0.0 114.141 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.667 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -71.01 -120.55 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.019 1 O-C-N 130.317 4.76 . . . . 0.0 112.636 -179.827 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.23 9.5 2.14 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 129.021 3.951 . . . . 0.0 108.335 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 31' ' ' ARG . 2.7 mp -142.17 -49.51 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 111.415 -2.63 . . . . 0.0 108.175 -179.487 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -93.2 35.29 1.08 Allowed 'General case' 0 C--O 1.205 -1.264 0 CA-C-O 122.228 1.013 . . . . 0.0 111.877 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.504 HG13 ' CZ ' ' A' ' 17' ' ' PHE . 55.0 t -50.47 -34.95 12.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.705 0 C-N-CA 127.48 2.312 . . . . 0.0 115.897 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 153.74 122.82 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 1 O-C-N 129.394 4.184 . . . . 0.0 111.487 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.817 HD12 ' N ' ' A' ' 38' ' ' THR . 1.3 pp -106.27 -11.52 16.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 113.937 -2.935 . . . . 0.0 110.87 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.817 ' N ' HD12 ' A' ' 37' ' ' LEU . 6.3 m 145.96 98.85 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.082 1 O-C-N 134.132 7.145 . . . . 0.0 111.039 -179.694 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.96 114.78 26.99 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 127.089 2.743 . . . . 0.0 117.562 -179.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 m -106.43 112.14 25.02 Favored 'General case' 0 C--O 1.209 -1.061 1 O-C-N 130.522 4.889 . . . . 0.0 110.824 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.544 ' NZ ' HD12 ' A' ' 43' ' ' ILE . 2.4 tmtt? -105.55 119.94 40.38 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 127.908 3.255 . . . . 0.0 107.593 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.572 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.7 mp -109.86 159.93 9.18 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 128.645 3.715 . . . . 0.0 111.625 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.572 ' N ' HG22 ' A' ' 42' ' ' ILE 0.307 1.0 OUTLIER -132.37 146.83 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-N 109.443 -3.526 . . . . 0.0 106.898 179.668 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 55.8 t -156.88 113.66 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.34 0 O-C-N 126.389 2.305 . . . . 0.0 110.428 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.456 ' HG2' ' CD2' ' A' ' 50' ' ' PHE . 1.1 mt-30 -114.73 134.37 55.15 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-O 125.159 2.409 . . . . 0.0 112.88 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -130.04 40.84 3.5 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 108.445 -3.979 . . . . 0.0 110.741 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.0 114.76 0.02 OUTLIER Glycine 0 C--N 1.349 1.304 0 CA-C-N 112.525 -2.125 . . . . 0.0 110.646 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 73.5 -68.9 0.2 Allowed 'General case' 0 C--O 1.217 -0.612 0 O-C-N 126.796 2.115 . . . . 0.0 111.735 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -78.85 92.96 4.92 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.754 1.622 . . . . 0.0 109.934 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.697 ' CE1' HD22 ' A' ' 94' ' ' LEU . 44.8 t80 -98.18 117.59 32.89 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.006 5.191 . . . . 0.0 111.259 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -130.35 86.76 2.42 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 128.236 3.46 . . . . 0.0 117.713 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.524 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -68.77 153.19 44.22 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 128.181 3.426 . . . . 0.0 106.725 179.868 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.467 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -156.33 147.1 21.89 Favored 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 128.007 3.317 . . . . 0.0 108.294 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.404 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 1.0 OUTLIER -108.83 151.9 25.61 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 127.001 2.688 . . . . 0.0 107.756 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -134.79 52.51 2.04 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.62 -92.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 1 O-C-N 131.859 5.724 . . . . 0.0 110.315 179.845 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 m 148.15 -53.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.448 1 O-C-N 130.795 5.06 . . . . 0.0 102.288 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.495 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 3.0 m-85 -51.42 -58.77 5.34 Favored 'General case' 0 N--CA 1.474 0.771 1 O-C-N 130.725 5.016 . . . . 0.0 108.231 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -154.47 111.12 3.3 Favored 'General case' 0 C--N 1.364 1.232 1 CA-C-N 106.952 -4.658 . . . . 0.0 113.823 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.404 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 0.0 OUTLIER -105.39 97.84 7.62 Favored 'General case' 0 C--O 1.218 -0.566 1 O-C-N 130.565 4.916 . . . . 0.0 110.329 179.89 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.0 89.91 3.21 Favored 'General case' 0 C--N 1.318 -0.763 1 O-C-N 129.36 4.163 . . . . 0.0 105.899 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.467 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 21.8 p30 -84.11 165.19 18.7 Favored 'General case' 0 C--O 1.199 -1.579 1 O-C-N 130.688 4.993 . . . . 0.0 115.987 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.769 HD21 ' HZ2' ' A' ' 107' ' ' TRP . 10.8 tp -100.58 54.06 0.87 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 111.43 -2.623 . . . . 0.0 112.268 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.41 100.12 12.79 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 124.266 1.984 . . . . 0.0 112.771 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.556 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -151.0 -137.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 112.774 -2.012 . . . . 0.0 110.47 179.478 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.6 m -156.14 153.44 29.31 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.478 HG11 ' CD1' ' A' ' 89' ' ' TRP . 3.4 t -76.32 151.91 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.313 0 O-C-N 125.194 1.559 . . . . 0.0 113.81 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 43.64 30.21 1.44 Allowed Glycine 0 C--O 1.215 -1.08 1 O-C-N 130.663 4.977 . . . . 0.0 115.241 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.266 0.8 OUTLIER -102.54 -5.52 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 112.679 -1.761 . . . . 0.0 109.829 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 66.37 99.45 0.05 OUTLIER 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 127.138 2.774 . . . . 0.0 111.78 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.573 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 2.4 t80 -83.38 95.48 8.23 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 127.417 2.948 . . . . 0.0 118.591 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 36.3 p-10 -74.21 76.33 1.8 Allowed 'General case' 0 C--O 1.202 -1.437 0 CA-C-O 123.991 1.853 . . . . 0.0 109.238 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -48.4 128.71 15.02 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 125.044 2.354 . . . . 0.0 113.747 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.32 49.66 2.28 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 127.067 3.318 . . . . 0.0 110.522 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.403 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 8.5 t -70.97 -172.99 0.74 Allowed 'General case' 0 C--O 1.203 -1.372 0 CA-C-N 111.161 -2.745 . . . . 0.0 110.893 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.403 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -165.77 -51.05 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 126.459 3.028 . . . . 0.0 114.262 179.97 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -90.72 61.56 3.09 Favored Glycine 0 N--CA 1.473 1.141 0 CA-C-N 109.352 -3.567 . . . . 0.0 112.792 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.514 ' O ' HD11 ' A' ' 24' ' ' LEU 0.268 8.4 tp 176.27 -32.43 0.0 OUTLIER 'General case' 0 C--O 1.241 0.612 0 CA-C-N 109.822 -3.189 . . . . 0.0 115.487 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.554 ' HA ' HD11 ' A' ' 24' ' ' LEU . 15.8 t0 -141.16 -53.68 0.47 Allowed 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.23 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 62.83 65.88 2.88 Favored Glycine 0 C--O 1.206 -1.623 0 CA-C-O 125.481 2.712 . . . . 0.0 111.519 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -127.65 -86.82 0.58 Allowed 'General case' 0 C--N 1.364 1.211 1 CA-C-N 107.043 -4.578 . . . . 0.0 114.372 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 132.36 73.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.117 1 O-C-N 129.271 4.107 . . . . 0.0 108.646 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.67 178.17 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 128.281 3.488 . . . . 0.0 115.929 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -108.85 158.06 18.02 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 133.401 6.688 . . . . 0.0 107.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.573 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.7 m -156.1 75.47 0.89 Allowed 'General case' 0 C--O 1.199 -1.602 0 O-C-N 128.267 3.479 . . . . 0.0 111.547 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.06 146.05 44.31 Favored 'General case' 0 N--CA 1.429 -1.507 1 CA-C-N 107.243 -4.526 . . . . 0.0 109.644 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 t -131.28 148.98 32.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 C-N-CA 127.08 2.152 . . . . 0.0 107.648 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.44 ' CG2' ' N ' ' A' ' 89' ' ' TRP 0.345 0.9 OUTLIER -166.88 165.89 15.84 Favored 'General case' 0 CA--C 1.473 -2.007 0 CA-C-O 125.893 2.759 . . . . 0.0 112.414 -179.712 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.618 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 38.4 m95 -96.3 113.73 25.34 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-O 113.472 -3.156 . . . . 0.0 109.284 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.702 ' CB ' HG23 ' A' ' 93' ' ' THR . 4.9 tp10 -73.74 -45.87 49.37 Favored 'General case' 0 CA--C 1.477 -1.858 1 CA-C-O 131.861 5.601 . . . . 0.0 112.784 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.78 -46.36 0.15 Allowed Glycine 0 CA--C 1.542 1.775 0 CA-C-N 108.692 -3.867 . . . . 0.0 104.94 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -144.16 57.44 1.33 Allowed 'General case' 0 N--CA 1.427 -1.622 0 O-C-N 128.121 2.895 . . . . 0.0 111.268 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.702 HG23 ' CB ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER 170.83 151.93 0.05 OUTLIER 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 108.537 -3.938 . . . . 0.0 117.688 179.475 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.697 HD22 ' CE1' ' A' ' 50' ' ' PHE . 0.4 OUTLIER -85.21 3.9 37.14 Favored 'General case' 0 CA--C 1.476 -1.873 1 O-C-N 131.548 5.53 . . . . 0.0 119.637 -178.941 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.481 ' O ' HG12 ' A' ' 95' ' ' VAL 0.435 27.4 t -3.45 117.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -131.14 149.11 52.74 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-O 123.538 1.637 . . . . 0.0 109.019 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.6 122.35 54.96 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.597 0 CA-C-N 111.854 -2.43 . . . . 0.0 117.369 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.457 ' CG ' ' HB3' ' A' ' 105' ' ' ARG . 1.2 tt0 -90.22 117.54 29.04 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 120.821 -1.174 . . . . 0.0 108.295 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.0 tppt? -47.94 -36.19 12.01 Favored 'General case' 0 N--CA 1.486 1.341 1 O-C-N 129.476 4.235 . . . . 0.0 108.659 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 65.91 -83.22 0.09 OUTLIER Glycine 0 C--O 1.199 -2.063 0 CA-C-N 112.543 -2.117 . . . . 0.0 113.269 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 91.31 35.32 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.052 1 CA-C-N 107.177 -4.511 . . . . 0.0 110.477 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.574 ' CD ' ' HG2' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 169.69 -42.79 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 110.952 -2.84 . . . . 0.0 113.556 -179.881 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.574 ' HG2' ' CD ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -129.38 151.56 49.88 Favored 'General case' 0 N--CA 1.433 -1.321 0 O-C-N 127.096 2.747 . . . . 0.0 115.236 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -82.82 103.06 12.02 Favored 'General case' 0 N--CA 1.491 1.59 1 O-C-N 132.271 5.982 . . . . 0.0 101.888 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.616 ' NH2' HD13 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -118.96 28.02 8.53 Favored 'General case' 0 C--N 1.31 -1.126 1 O-C-N 130.57 4.919 . . . . 0.0 110.562 -178.88 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -93.7 131.05 10.58 Favored Glycine 0 N--CA 1.427 -1.936 1 CA-C-N 106.583 -4.826 . . . . 0.0 112.703 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.769 ' HZ2' HD21 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -111.78 147.01 36.58 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 129.133 3.49 . . . . 0.0 107.047 177.383 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.464 ' HB2' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -138.97 -176.16 4.4 Favored 'General case' 0 C--O 1.215 -0.721 1 O-C-N 129.724 4.39 . . . . 0.0 111.111 -179.102 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.678 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -156.18 115.61 3.54 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 115.308 -2.557 . . . . 0.0 111.119 -176.168 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.52 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -132.7 124.26 27.85 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 117.422 2.379 . . . . 0.0 117.422 179.506 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 42.3 t -59.5 103.98 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.819 0 CA-C-O 123.718 1.723 . . . . 0.0 112.497 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -101.21 40.34 1.3 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 112.239 -2.255 . . . . 0.0 114.406 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.85 -112.7 3.7 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-N 111.789 -2.46 . . . . 0.0 115.036 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -68.15 -49.51 60.51 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -98.27 -179.08 4.25 Favored 'General case' 0 C--O 1.22 -0.48 0 O-C-N 128.963 3.915 . . . . 0.0 107.568 -179.712 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.422 ' HG ' ' N ' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -143.73 136.72 27.54 Favored 'General case' 0 C--O 1.202 -1.41 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.503 179.722 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.52 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 10.1 m-85 -81.76 163.77 22.17 Favored 'General case' 0 C--O 1.208 -1.115 0 C-N-CA 115.538 -2.465 . . . . 0.0 114.133 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 118' ' ' LEU . 2.2 tt -130.34 21.0 5.23 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 128.264 3.477 . . . . 0.0 106.804 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -28.58 125.55 0.1 Allowed 'General case' 0 N--CA 1.48 1.053 1 O-C-N 131.372 5.42 . . . . 0.0 109.922 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.616 HD13 ' NH2' ' A' ' 105' ' ' ARG . 0.2 OUTLIER -143.78 155.8 44.28 Favored 'General case' 0 CA--C 1.488 -1.406 0 C-N-CA 116.012 -2.275 . . . . 0.0 110.518 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.546 ' O ' HD12 ' A' ' 120' ' ' LEU . 23.5 m -114.82 158.8 21.42 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.358 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.5 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -157.66 49.6 0.42 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 126.379 2.99 . . . . 0.0 113.612 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLY . . . . . 0.426 ' CA ' ' HB2' ' A' ' 103' ' ' GLU . . . 93.09 -100.95 2.72 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 112.968 -1.923 . . . . 0.0 108.699 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.92 -59.93 2.49 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 111.665 -2.267 . . . . 0.0 112.236 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -73.59 174.87 7.68 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 128.031 3.332 . . . . 0.0 108.963 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.1 t -150.35 71.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.821 2 O-C-N 131.307 5.38 . . . . 0.0 113.219 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 114.63 1.45 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 116.337 -1.792 . . . . 0.0 110.696 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.12 79.89 1.66 Allowed 'General case' 0 CA--C 1.497 -1.063 0 O-C-N 128.608 3.693 . . . . 0.0 114.171 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -56.13 129.59 40.7 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.277 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.25 0.4 OUTLIER -110.12 136.92 44.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 123.905 1.812 . . . . 0.0 108.753 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.497 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 67.4 m-85 -128.09 168.23 15.65 Favored 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 111.111 -2.768 . . . . 0.0 116.92 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.484 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.354 0.0 OUTLIER -143.61 30.13 1.37 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 116.234 -1.841 . . . . 0.0 108.813 179.881 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.588 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 62.2 176.65 0.13 Allowed 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 117.449 -1.7 . . . . 0.0 111.42 -179.43 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.448 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.259 1.594 0 CA-C-O 116.224 -1.846 . . . . 0.0 114.963 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.497 -1.083 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 63.5 t0 67.53 84.54 0.15 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 102.709 -3.071 . . . . 0.0 102.709 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -116.31 46.36 1.6 Allowed 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 44' ' ' VAL . 5.1 t-20 -34.13 137.5 0.11 Allowed 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 126.172 2.17 . . . . 0.0 113.976 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 160.26 -163.53 33.94 Favored Glycine 0 C--O 1.218 -0.887 0 CA-C-O 115.271 -2.961 . . . . 0.0 112.463 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.477 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -136.91 144.47 43.5 Favored 'General case' 0 C--O 1.202 -1.434 1 O-C-N 132.725 5.603 . . . . 0.0 103.688 -179.828 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.554 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.283 0.0 OUTLIER -141.56 137.16 31.77 Favored 'General case' 0 CA--C 1.496 -1.119 1 O-C-N 131.832 5.708 . . . . 0.0 112.891 -179.191 . . . . . . . . 5 4 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.5 mm-40 -81.5 5.12 18.82 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 125.52 1.763 . . . . 0.0 115.551 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.0 ttp 58.61 -91.01 0.03 OUTLIER 'General case' 0 C--O 1.246 0.919 0 CA-C-O 111.955 -3.879 . . . . 0.0 104.134 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.8 tt0 119.54 -45.56 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.985 1 O-C-N 129.495 4.247 . . . . 0.0 110.106 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.96 155.84 5.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.479 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.84 169.89 12.77 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 110.563 -3.017 . . . . 0.0 111.882 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.405 ' HB3' ' O ' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -121.93 124.96 45.3 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 128.812 3.82 . . . . 0.0 113.118 179.923 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 t30 46.35 84.5 0.03 OUTLIER 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 124.051 1.881 . . . . 0.0 112.645 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -92.12 -30.56 15.91 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-N 112.769 -2.014 . . . . 0.0 112.871 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.468 ' HG3' ' CZ ' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -71.24 -56.78 5.35 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.064 -2.398 . . . . 0.0 112.608 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.448 ' HA2' ' HB2' ' A' ' 22' ' ' LYS . . . -53.87 -23.59 23.25 Favored Glycine 0 CA--C 1.489 -1.57 1 O-C-N 132.276 5.985 . . . . 0.0 113.252 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.87 -49.58 19.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 126.843 3.211 . . . . 0.0 108.128 179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.468 ' O ' HG22 ' A' ' 26' ' ' ILE . 19.7 mmm -68.77 -20.54 64.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 119.73 -1.856 . . . . 0.0 112.345 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.448 ' HB2' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.8 -22.77 42.69 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.55 3.031 . . . . 0.0 110.341 179.754 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -37.33 63.71 Favored 'General case' 0 C--O 1.207 -1.177 1 O-C-N 131.745 5.653 . . . . 0.0 112.806 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.84 9.36 40.78 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 128.446 3.591 . . . . 0.0 108.802 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 32.53 66.94 0.17 Allowed 'General case' 0 CA--C 1.482 -1.647 0 CA-C-O 127.008 3.29 . . . . 0.0 113.348 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.666 HD12 ' O ' ' A' ' 78' ' ' LEU . 10.7 tt -87.5 -31.48 5.91 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-O 126.685 3.136 . . . . 0.0 112.355 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.05 -176.55 0.25 Allowed 'General case' 0 C--N 1.36 1.044 0 CA-C-N 112.72 -2.036 . . . . 0.0 112.832 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.445 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 26.4 m-85 -125.0 35.73 4.73 Favored 'General case' 0 CA--C 1.501 -0.915 0 O-C-N 126.517 2.386 . . . . 0.0 111.127 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.52 177.36 6.71 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.258 3.474 . . . . 0.0 106.736 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.602 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.8 OUTLIER 76.97 -62.46 0.4 Allowed 'General case' 0 C--O 1.214 -0.807 0 O-C-N 128.747 3.78 . . . . 0.0 111.423 -179.564 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.468 ' CZ ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -38.4 -19.74 0.01 OUTLIER 'General case' 0 C--O 1.243 0.755 1 O-C-N 130.735 5.022 . . . . 0.0 113.079 -179.86 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -86.81 -32.4 20.34 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 127.668 3.105 . . . . 0.0 111.906 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 30' ' ' THR . 0.2 OUTLIER -111.42 36.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 128.665 3.728 . . . . 0.0 115.071 -179.586 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.26 23.25 11.95 Favored 'General case' 0 C--O 1.201 -1.491 0 CA-C-O 126.081 2.848 . . . . 0.0 108.568 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.431 ' O ' ' CE1' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -62.96 178.74 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 108.785 -3.825 . . . . 0.0 106.65 176.935 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.412 ' HD2' ' HA ' ' A' ' 36' ' ' ARG . 4.2 mpt_? -49.04 -30.39 6.19 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 127.584 3.052 . . . . 0.0 112.254 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.863 HD21 ' HB3' ' A' ' 58' ' ' PHE . 3.8 pp 29.84 108.48 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 2 O-C-N 134.822 7.576 . . . . 0.0 113.479 177.987 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.6 m 57.17 42.95 24.77 Favored 'General case' 0 CA--C 1.479 -1.767 0 CA-C-N 110.793 -2.912 . . . . 0.0 118.333 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.512 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.3 OUTLIER -159.34 -97.59 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.517 ' CG2' ' N ' ' A' ' 41' ' ' LYS . 1.3 m 172.56 159.15 0.11 Allowed 'General case' 0 C--O 1.199 -1.566 0 O-C-N 128.842 3.839 . . . . 0.0 112.387 -175.049 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.517 ' N ' ' CG2' ' A' ' 40' ' ' THR . 0.0 OUTLIER -111.98 158.21 19.79 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 101.708 -3.441 . . . . 0.0 101.708 178.43 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.783 HD11 ' HB2' ' A' ' 55' ' ' ASN . 2.1 mp -134.32 156.85 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 119.912 1.233 . . . . 0.0 111.587 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.556 ' N ' HG22 ' A' ' 42' ' ' ILE . 5.3 tt -132.31 135.74 57.49 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 0 CA-C-N 111.248 -2.705 . . . . 0.0 107.828 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.693 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.3 t -110.49 -64.97 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 N-CA-C 116.323 1.971 . . . . 0.0 116.323 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.693 ' N ' HG12 ' A' ' 44' ' ' VAL . 1.7 tm0? 65.32 140.24 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 125.851 2.739 . . . . 0.0 112.071 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -165.6 71.93 0.16 Allowed 'General case' 0 C--N 1.363 1.189 0 CA-C-N 110.244 -3.162 . . . . 0.0 114.007 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.06 -89.07 1.5 Allowed Glycine 0 C--O 1.216 -1.025 0 CA-C-O 122.893 1.274 . . . . 0.0 110.793 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -108.76 -44.47 4.02 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 109.586 -3.307 . . . . 0.0 110.788 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -64.16 95.49 0.13 Allowed 'General case' 0 C--N 1.357 0.904 0 O-C-N 127.269 2.856 . . . . 0.0 109.172 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.631 ' CD2' HD22 ' A' ' 94' ' ' LEU . 42.5 t80 -95.91 95.75 8.46 Favored 'General case' 0 CA--C 1.496 -1.134 1 O-C-N 129.539 4.274 . . . . 0.0 113.021 -179.933 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.442 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 43.7 mttt -105.65 165.63 11.03 Favored 'General case' 0 CA--C 1.491 -1.297 0 O-C-N 128.789 3.806 . . . . 0.0 113.84 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.54 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -148.61 111.35 4.79 Favored 'General case' 0 CA--C 1.499 -0.997 1 O-C-N 131.047 5.217 . . . . 0.0 107.797 179.713 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.57 153.17 42.55 Favored 'General case' 0 C--O 1.208 -1.128 0 C-N-CA 117.666 -1.614 . . . . 0.0 111.289 -179.468 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.6 157.67 17.02 Favored 'General case' 0 C--N 1.313 -0.979 0 O-C-N 125.878 1.986 . . . . 0.0 111.073 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.783 ' HB2' HD11 ' A' ' 42' ' ' ILE . 1.7 t-20 -107.82 -18.58 13.78 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-O 113.824 -2.989 . . . . 0.0 115.233 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.475 ' HA ' ' HB3' ' A' ' 39' ' ' GLN . 16.5 p -16.85 152.22 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.181 1 O-C-N 135.703 8.127 . . . . 0.0 113.566 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.84 -33.19 57.94 Favored 'General case' 0 CA--C 1.504 -0.819 1 CA-C-N 107.588 -4.369 . . . . 0.0 109.038 179.519 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.863 ' HB3' HD21 ' A' ' 37' ' ' LEU . 5.8 p90 -68.14 -53.31 26.1 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 126.938 2.648 . . . . 0.0 114.438 -179.349 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -172.47 130.81 0.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 O-C-N 127.985 3.303 . . . . 0.0 110.183 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 90.64 5.81 Favored 'General case' 0 C--O 1.204 -1.318 0 O-C-N 127.604 3.065 . . . . 0.0 113.409 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.58 141.68 37.46 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 109.083 -3.689 . . . . 0.0 109.047 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.91 161.52 14.38 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 126.877 2.611 . . . . 0.0 116.095 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.54 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 11.1 tp -109.99 62.22 0.6 Allowed 'General case' 0 C--O 1.214 -0.781 0 O-C-N 129.096 3.997 . . . . 0.0 110.753 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.442 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 7.2 p-10 -71.11 93.99 1.09 Allowed 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 112.568 -2.106 . . . . 0.0 111.141 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.675 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -127.85 169.36 13.99 Favored 'General case' 0 CA--C 1.494 -1.181 0 CA-C-O 126.686 3.136 . . . . 0.0 109.31 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.63 HG22 ' HB ' ' A' ' 69' ' ' VAL . 0.6 OUTLIER -147.97 172.82 13.61 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 110.302 -3.135 . . . . 0.0 106.972 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.447 HG12 ' N ' ' A' ' 68' ' ' GLY . 21.3 t -87.59 142.82 12.44 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.463 0 O-C-N 126.459 2.35 . . . . 0.0 115.664 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 67' ' ' VAL . . . 37.78 33.55 0.14 Allowed Glycine 0 C--N 1.342 0.894 1 O-C-N 129.806 4.441 . . . . 0.0 116.721 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.63 ' HB ' HG22 ' A' ' 66' ' ' THR . 13.4 p -81.24 -14.22 12.6 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.941 0 C-N-CA 117.797 -1.561 . . . . 0.0 108.459 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 72' ' ' ASP . 24.6 tt0 58.31 75.77 0.37 Allowed 'General case' 0 C--N 1.355 0.815 0 O-C-N 128.692 3.745 . . . . 0.0 109.361 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.569 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.2 OUTLIER -62.11 81.13 0.02 OUTLIER 'General case' 0 C--N 1.345 0.409 1 O-C-N 131.983 5.802 . . . . 0.0 111.039 179.769 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 70' ' ' GLU . 24.3 t70 -60.27 76.74 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.427 ' HG2' ' CA ' ' A' ' 83' ' ' VAL 0.272 32.6 mt-10 57.45 111.48 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.207 0 O-C-N 125.823 1.952 . . . . 0.0 113.698 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.525 ' CE1' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER 176.2 69.17 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 108.667 -3.879 . . . . 0.0 111.923 179.558 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 82.4 p -99.26 -27.97 13.54 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 110.318 -3.128 . . . . 0.0 115.675 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.525 ' HE2' ' CE1' ' A' ' 74' ' ' HIS . 0.1 OUTLIER -35.92 153.94 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 1 O-C-N 130.049 4.593 . . . . 0.0 114.772 -179.819 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.6 24.12 Favored Glycine 0 C--O 1.218 -0.89 0 CA-C-N 111.218 -2.719 . . . . 0.0 110.664 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.666 ' O ' HD12 ' A' ' 26' ' ' ILE . 10.8 tp -163.73 -47.75 0.03 OUTLIER 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 126.963 3.268 . . . . 0.0 112.505 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.79 -67.04 1.03 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 110.562 -3.017 . . . . 0.0 113.24 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.98 69.93 1.16 Allowed Glycine 0 C--O 1.209 -1.44 0 CA-C-O 125.727 2.848 . . . . 0.0 110.842 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.521 ' NE ' ' HA ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -114.47 -156.04 0.59 Allowed 'General case' 0 N--CA 1.49 1.567 1 CA-C-N 107.399 -4.4 . . . . 0.0 107.944 -179.585 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.415 ' CG ' ' HB3' ' A' ' 73' ' ' GLU . 0.3 OUTLIER -174.52 82.21 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 127.544 3.027 . . . . 0.0 108.118 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.438 HG13 ' HA3' ' A' ' 100' ' ' GLY . 2.3 t -138.09 153.54 27.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 N-CA-C 118.17 2.655 . . . . 0.0 118.17 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -55.97 147.05 20.59 Favored 'General case' 0 C--O 1.239 0.524 1 O-C-N 129.592 4.307 . . . . 0.0 106.334 179.448 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.569 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 2.1 m -152.83 70.79 0.9 Allowed 'General case' 0 C--O 1.199 -1.553 1 O-C-N 130.589 4.931 . . . . 0.0 112.066 -179.161 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 70' ' ' GLU . 2.0 tp -70.65 140.88 51.67 Favored 'General case' 0 C--O 1.209 -1.039 1 CA-C-N 107.114 -4.585 . . . . 0.0 115.298 -179.915 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.532 HG12 HD11 ' A' ' 94' ' ' LEU . 2.2 t -116.79 142.31 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 111.728 -2.487 . . . . 0.0 107.012 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.253 16.4 m -159.1 161.82 36.45 Favored 'General case' 0 CA--C 1.48 -1.75 0 O-C-N 126.175 2.172 . . . . 0.0 111.499 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.663 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 33.5 m95 -98.87 143.97 28.6 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 128.309 2.644 . . . . 0.0 107.957 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.686 ' HB3' HG22 ' A' ' 93' ' ' THR . 9.7 tp10 -99.46 -30.78 11.98 Favored 'General case' 0 C--O 1.195 -1.794 1 CA-C-O 128.521 4.01 . . . . 0.0 112.09 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.44 -40.25 0.51 Allowed Glycine 0 C--O 1.21 -1.371 1 N-CA-C 102.751 -4.14 . . . . 0.0 102.751 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -149.54 31.04 0.74 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.767 5.04 . . . . 0.0 111.579 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.686 HG22 ' HB3' ' A' ' 90' ' ' GLU . 5.5 t -167.74 149.67 5.59 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 117.672 2.471 . . . . 0.0 117.672 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.631 HD22 ' CD2' ' A' ' 50' ' ' PHE . 1.6 tp -85.81 87.24 7.38 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 118.036 2.606 . . . . 0.0 118.036 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.556 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.335 53.4 t -81.79 120.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.361 1.101 0 O-C-N 128.006 3.317 . . . . 0.0 112.451 179.712 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.524 ' HB2' ' CZ3' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -143.07 143.69 31.96 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 126.79 3.185 . . . . 0.0 108.916 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.9 m -133.55 144.08 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 108.459 -3.973 . . . . 0.0 117.813 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -96.57 101.03 12.58 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 110.692 -2.958 . . . . 0.0 106.959 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -92.31 96.11 10.09 Favored 'General case' 0 CA--C 1.496 -1.101 0 C-N-CA 114.449 -2.9 . . . . 0.0 114.229 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.438 ' HA3' HG13 ' A' ' 83' ' ' VAL . . . 138.86 160.49 8.4 Favored Glycine 0 C--N 1.348 1.218 1 CA-C-O 128.055 4.142 . . . . 0.0 114.267 179.137 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.16 178.19 0.06 Allowed 'General case' 0 CA--C 1.499 -1.016 1 CA-C-N 106.631 -4.785 . . . . 0.0 108.553 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.86 -68.35 0.2 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 117.218 2.303 . . . . 0.0 117.218 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -56.31 158.87 3.9 Favored 'General case' 0 C--O 1.2 -1.511 0 CA-C-N 111.253 -2.703 . . . . 0.0 116.671 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.82 105.98 11.23 Favored 'General case' 0 N--CA 1.492 1.637 2 O-C-N 130.094 4.621 . . . . 0.0 102.493 179.719 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 122' ' ' CYS . 19.5 mmm-85 -108.05 31.78 5.26 Favored 'General case' 0 C--N 1.32 -0.68 1 O-C-N 130.308 4.755 . . . . 0.0 112.272 -179.68 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -62.77 83.78 0.04 OUTLIER Glycine 0 N--CA 1.428 -1.848 2 O-C-N 131.209 5.318 . . . . 0.0 113.564 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.675 ' CH2' ' CE2' ' A' ' 65' ' ' PHE 0.283 0.0 OUTLIER -99.44 128.38 45.55 Favored 'General case' 0 C--N 1.319 -0.728 1 O-C-N 131.817 5.069 . . . . 0.0 109.962 179.721 . . . . . . . . 5 4 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.529 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.8 OUTLIER -160.92 150.13 16.83 Favored 'General case' 0 CA--C 1.508 -0.647 1 O-C-N 130.074 4.609 . . . . 0.0 117.052 -177.007 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.444 HE22 HD23 ' A' ' 118' ' ' LEU . 28.0 mm-40 -106.42 179.01 4.39 Favored 'General case' 0 C--N 1.359 0.984 0 CA-C-O 113.497 -3.144 . . . . 0.0 109.648 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.529 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 0.7 OUTLIER 173.37 82.69 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.279 1 O-C-N 131.726 5.641 . . . . 0.0 117.71 178.526 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 80.6 t -45.57 102.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.761 0 CA-C-O 127.973 3.749 . . . . 0.0 116.239 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -85.31 20.28 2.04 Favored 'General case' 0 N--CA 1.484 1.238 1 CA-C-N 108.345 -4.025 . . . . 0.0 116.042 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.49 -101.28 0.33 Allowed Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.148 1.219 . . . . 0.0 116.148 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.53 12.69 25.88 Favored 'General case' 0 C--O 1.207 -1.137 0 N-CA-C 118.302 2.705 . . . . 0.0 118.302 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.417 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.7 OUTLIER -143.7 172.89 12.2 Favored 'General case' 0 C--N 1.32 -0.705 2 O-C-N 132.192 5.933 . . . . 0.0 109.388 179.837 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.737 HD23 ' O ' ' A' ' 116' ' ' LEU . 0.6 OUTLIER -138.78 121.05 15.88 Favored 'General case' 0 CA--C 1.48 -1.74 1 O-C-N 129.88 4.487 . . . . 0.0 111.713 179.942 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.484 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 4.7 m-85 -76.83 158.51 30.77 Favored 'General case' 0 C--O 1.213 -0.857 0 C-N-CA 115.888 -2.325 . . . . 0.0 116.097 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.511 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -137.95 46.49 2.07 Favored 'General case' 0 C--N 1.349 0.572 2 O-C-N 130.039 4.587 . . . . 0.0 108.261 179.789 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -62.03 157.32 19.07 Favored 'General case' 0 CA--C 1.506 -0.739 0 C-N-CA 127.067 2.147 . . . . 0.0 109.338 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.81 177.08 5.93 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 116.735 -1.986 . . . . 0.0 111.305 179.696 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 47.7 m -135.8 155.71 49.93 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.2 OUTLIER -159.05 72.28 0.55 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 126.01 2.814 . . . . 0.0 114.155 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.27 58.15 9.24 Favored Glycine 0 CA--C 1.532 1.131 0 CA-C-N 112.039 -2.346 . . . . 0.0 111.273 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 62.98 52.6 2.55 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 126.523 1.929 . . . . 0.0 109.594 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -137.46 26.23 2.86 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-N 111.684 -2.507 . . . . 0.0 109.191 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 126' ' ' VAL . 89.6 t -18.63 86.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.963 1 O-C-N 129.688 4.367 . . . . 0.0 111.653 179.926 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.42 150.78 31.2 Favored 'General case' 0 CA--C 1.49 -1.357 0 CA-C-N 111.936 -2.393 . . . . 0.0 112.843 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 3.9 ttp85 -124.71 151.13 45.41 Favored 'General case' 0 C--N 1.353 0.749 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.333 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -136.95 166.31 23.95 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 127.015 2.697 . . . . 0.0 114.862 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.3 t -150.94 143.26 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-O 128.117 3.818 . . . . 0.0 105.99 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.511 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 29.6 m-85 -137.34 -175.83 4.19 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-N 108.988 -3.733 . . . . 0.0 114.48 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -168.77 122.74 0.85 Allowed 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 178.767 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.554 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 35.7 ttpt -50.54 95.55 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 112.467 -2.152 . . . . 0.0 116.013 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt . . . . . 0 C--O 1.259 1.556 0 O-C-N 126.789 2.556 . . . . 0.0 116.499 179.604 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm . . . . . 0 CA--C 1.493 -1.22 0 N-CA-C 118.654 2.835 . . . . 0.0 118.654 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.405 ' HA ' ' CG2' ' A' ' 111' ' ' VAL . 22.9 m-20 53.1 -104.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -170.22 -146.96 0.05 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 114.96 -2.447 . . . . 0.0 105.888 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -170.77 104.94 0.25 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 130.513 3.525 . . . . 0.0 113.242 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -179.81 -117.43 0.55 Allowed Glycine 0 C--O 1.201 -1.953 0 CA-C-O 116.844 -2.087 . . . . 0.0 113.725 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 40' ' ' THR . 30.8 m -167.69 145.61 4.55 Favored 'General case' 0 C--O 1.216 -0.664 1 O-C-N 130.26 4.153 . . . . 0.0 108.439 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.778 ' CZ2' HD12 ' A' ' 116' ' ' LEU 0.287 0.0 OUTLIER -132.65 125.27 29.97 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 128.441 3.588 . . . . 0.0 112.489 -179.785 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -75.37 -4.06 37.2 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 127.16 2.787 . . . . 0.0 115.004 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.531 ' HG3' ' CE1' ' A' ' 131' ' ' PHE 0.27 16.0 ttm 57.86 62.0 2.22 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 116.209 -1.853 . . . . 0.0 107.266 179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -34.91 -34.7 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 127.766 3.166 . . . . 0.0 111.842 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.29 0.2 OUTLIER -151.39 154.67 37.11 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-O 124.889 2.281 . . . . 0.0 112.254 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -129.92 125.2 34.95 Favored 'General case' 0 CA--C 1.503 -0.864 1 CA-C-N 107.629 -4.351 . . . . 0.0 116.695 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.416 ' HB3' ' HB3' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -112.34 122.88 48.98 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 132.042 5.839 . . . . 0.0 113.892 179.934 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.5 t30 49.99 84.64 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 124.024 1.868 . . . . 0.0 114.323 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.62 -37.58 9.08 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-O 125.725 2.679 . . . . 0.0 111.88 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.255 28.9 tt0 -79.24 -36.25 40.25 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 110.708 -2.951 . . . . 0.0 113.032 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.05 -22.92 76.15 Favored Glycine 0 CA--C 1.486 -1.775 0 O-C-N 128.914 3.884 . . . . 0.0 112.286 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -29.75 65.94 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 123.274 1.511 . . . . 0.0 108.899 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.43 -29.99 57.23 Favored 'General case' 0 CA--C 1.49 -1.338 0 C-N-CA 116.616 -2.034 . . . . 0.0 110.648 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -75.6 -29.76 59.37 Favored 'General case' 0 C--N 1.313 -0.981 0 O-C-N 128.089 3.368 . . . . 0.0 111.25 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.502 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -58.19 -48.71 79.47 Favored 'General case' 0 C--N 1.315 -0.91 1 O-C-N 129.979 4.549 . . . . 0.0 114.485 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 79' ' ' ASP . 1.0 OUTLIER -90.15 -12.33 38.54 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 110.262 -3.154 . . . . 0.0 108.789 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.424 ' N ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER 53.27 104.83 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 O-C-N 128.279 3.487 . . . . 0.0 107.387 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 9.6 tt -112.17 -43.05 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 CA-C-N 110.656 -2.975 . . . . 0.0 109.18 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -170.09 33.69 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 118.489 -2.632 . . . . 0.0 112.844 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.463 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.2 OUTLIER 36.16 76.44 0.05 OUTLIER 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 76.83 63.06 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 124.96 2.314 . . . . 0.0 106.29 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -63.69 -43.28 97.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 108.531 -3.941 . . . . 0.0 109.763 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.503 ' HB3' ' HB3' ' A' ' 34' ' ' ALA 0.272 0.0 OUTLIER -74.69 -105.19 0.01 OUTLIER 'General case' 0 C--O 1.246 0.874 2 O-C-N 130.655 4.972 . . . . 0.0 110.527 179.88 . . . . . . . . 5 4 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 31' ' ' ARG . 29.9 tttm 86.77 -3.19 0.67 Allowed 'General case' 0 C--O 1.203 -1.376 0 O-C-N 128.223 3.452 . . . . 0.0 110.07 -178.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.602 HD13 ' N ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -155.42 31.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 O-C-N 127.059 2.725 . . . . 0.0 108.588 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.503 ' HB3' ' HB3' ' A' ' 31' ' ' ARG . . . -138.86 24.09 2.6 Favored 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 112.864 -1.971 . . . . 0.0 110.151 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 t -44.85 -37.37 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.168 0 CA-C-O 125.276 2.465 . . . . 0.0 109.497 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.967 ' C ' HD13 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 177.89 168.85 0.72 Allowed 'General case' 0 C--O 1.216 -0.702 1 CA-C-N 106.568 -4.833 . . . . 0.0 111.081 178.814 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.967 HD13 ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -150.64 -103.98 0.06 Allowed 'General case' 0 C--N 1.316 -0.89 2 O-C-N 132.1 5.875 . . . . 0.0 107.662 -176.922 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.494 HG22 ' O ' ' A' ' 38' ' ' THR . 35.0 m -130.15 38.65 3.76 Favored 'General case' 0 CA--C 1.488 -1.429 0 O-C-N 127.633 3.083 . . . . 0.0 111.991 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -47.2 150.28 0.86 Allowed 'General case' 0 N--CA 1.481 1.076 0 O-C-N 120.236 -1.54 . . . . 0.0 115.066 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 8' ' ' THR . 22.1 m -168.88 108.09 0.46 Allowed 'General case' 0 C--O 1.216 -0.702 1 O-C-N 130.904 5.128 . . . . 0.0 114.33 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 3.7 tmtt? -94.13 144.34 25.58 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 127.482 2.989 . . . . 0.0 107.166 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.569 HD12 ' O ' ' A' ' 53' ' ' LYS . 4.2 mt -124.9 161.67 28.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.327 0 O-C-N 126.449 2.343 . . . . 0.0 110.622 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.528 ' N ' HG22 ' A' ' 42' ' ' ILE . 12.7 tt -139.26 130.61 34.37 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.508 0 CA-C-N 110.419 -3.082 . . . . 0.0 107.517 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.0 t -106.94 -61.14 2.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 CA-C-O 115.538 -2.172 . . . . 0.0 112.117 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 50.5 130.08 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.265 0 CA-C-O 126.64 3.114 . . . . 0.0 115.946 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -163.95 32.46 0.08 Allowed 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 109.434 -3.53 . . . . 0.0 112.913 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 114.92 -118.67 4.4 Favored Glycine 0 C--N 1.345 1.04 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -79.57 -31.01 41.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 118.073 -1.451 . . . . 0.0 112.69 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -105.45 91.51 3.8 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.729 2.811 . . . . 0.0 108.755 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.495 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 14.7 t80 -103.55 137.6 41.4 Favored 'General case' 0 CA--C 1.48 -1.73 1 O-C-N 129.642 4.339 . . . . 0.0 114.766 -179.444 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.481 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -147.99 99.8 3.11 Favored 'General case' 0 C--O 1.203 -1.363 0 N-CA-C 118.317 2.71 . . . . 0.0 118.317 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.588 ' HB ' HD23 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -73.87 153.88 39.68 Favored 'General case' 0 C--O 1.245 0.822 0 O-C-N 128.629 3.706 . . . . 0.0 105.739 177.807 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.569 ' O ' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -159.69 134.76 8.08 Favored 'General case' 0 CA--C 1.483 -1.62 0 C-N-CA 115.197 -2.601 . . . . 0.0 111.876 -178.554 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -97.64 152.52 18.99 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.736 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -144.49 36.21 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 114.267 -1.333 . . . . 0.0 114.021 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.451 ' O ' HG22 ' A' ' 57' ' ' THR . 3.4 p -37.73 -46.48 0.9 Allowed 'General case' 0 C--N 1.317 -0.824 0 O-C-N 128.535 3.647 . . . . 0.0 106.171 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 57' ' ' THR . 0.6 OUTLIER 88.95 10.35 0.09 Allowed 'General case' 0 N--CA 1.481 1.101 1 O-C-N 130.959 5.162 . . . . 0.0 106.219 -179.941 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -110.4 -51.99 2.82 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 110.765 -2.925 . . . . 0.0 110.998 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.517 ' NH2' ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -164.73 90.56 0.54 Allowed 'General case' 0 C--N 1.359 1.019 0 CA-C-N 109.076 -3.693 . . . . 0.0 109.985 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -91.85 126.27 36.87 Favored 'General case' 0 N--CA 1.431 -1.418 1 CA-C-N 108.061 -4.154 . . . . 0.0 111.854 -179.708 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.517 ' CE1' ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -128.55 47.57 2.43 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 128.722 3.764 . . . . 0.0 107.184 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -28.86 133.54 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 O-C-N 128.937 3.898 . . . . 0.0 113.769 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.588 HD23 ' HB ' ' A' ' 52' ' ' THR . 11.7 tp -82.48 56.31 3.25 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -92.4 99.89 12.56 Favored 'General case' 0 C--O 1.205 -1.252 0 O-C-N 126.182 2.176 . . . . 0.0 112.823 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.513 ' HE2' HD11 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -147.89 -157.19 0.79 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 126.526 1.931 . . . . 0.0 107.386 179.134 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.44 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.5 OUTLIER -128.27 179.27 5.71 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 178.209 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.957 HG11 ' CD1' ' A' ' 89' ' ' TRP . 4.1 t -118.97 115.58 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.8 1 O-C-N 129.714 4.384 . . . . 0.0 109.96 -179.206 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.72 -24.34 22.06 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 116.448 -2.787 . . . . 0.0 111.561 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 69' ' ' VAL . 20.8 t -92.48 89.69 2.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 112.587 -1.806 . . . . 0.0 109.378 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.434 ' CG ' HD12 ' A' ' 86' ' ' LEU . 1.4 tm-20 -37.28 102.71 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.761 1 O-C-N 129.879 4.487 . . . . 0.0 113.137 179.472 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.404 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.1 OUTLIER -70.44 86.95 0.63 Allowed 'General case' 0 C--N 1.355 0.828 0 O-C-N 126.045 2.091 . . . . 0.0 111.432 -179.879 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -48.04 85.3 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.51 0 CA-C-N 112.153 -2.294 . . . . 0.0 116.193 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.403 ' CD ' ' HB2' ' A' ' 82' ' ' ASN . 9.8 mt-10 57.84 -165.76 0.16 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 120.827 1.649 . . . . 0.0 108.824 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 92.08 112.83 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.963 0 CA-C-N 110.251 -3.159 . . . . 0.0 110.48 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.418 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 71.4 p -134.11 -105.81 0.23 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 110.921 -2.854 . . . . 0.0 113.462 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.418 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 58.56 162.89 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 126.235 2.922 . . . . 0.0 114.613 -179.694 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 64.23 19.95 64.6 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-N 108.582 -3.917 . . . . 0.0 107.713 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.541 ' O ' HD11 ' A' ' 24' ' ' LEU . 9.9 tp -159.15 -52.75 0.06 Allowed 'General case' 0 N--CA 1.475 0.796 0 O-C-N 127.485 2.52 . . . . 0.0 114.826 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.542 ' CB ' HD13 ' A' ' 24' ' ' LEU . 38.7 t0 -125.13 -66.23 0.97 Allowed 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 125.679 2.657 . . . . 0.0 110.421 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.35 74.07 1.21 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.665 2.079 . . . . 0.0 116.608 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -150.65 -130.97 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 112.045 -2.078 . . . . 0.0 113.672 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.403 ' HB2' ' CD ' ' A' ' 73' ' ' GLU . 1.4 p-10 -169.4 115.67 0.58 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.659 1.118 . . . . 0.0 108.843 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.571 HG11 ' OE1' ' A' ' 98' ' ' GLN . 75.6 t -138.09 149.61 24.74 Favored 'Isoleucine or valine' 0 C--N 1.365 1.254 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -179.071 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -63.39 103.86 0.56 Allowed 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 112.281 -2.236 . . . . 0.0 106.877 178.7 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.404 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 14.4 m -115.95 78.47 1.19 Allowed 'General case' 0 C--O 1.208 -1.131 0 O-C-N 126.994 2.684 . . . . 0.0 111.557 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 2.5 tp -86.6 148.95 25.26 Favored 'General case' 0 C--O 1.209 -1.072 1 CA-C-N 106.572 -4.831 . . . . 0.0 109.647 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.607 HG22 ' HB2' ' A' ' 96' ' ' CYS . 49.7 t -135.82 147.33 28.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 125.826 1.651 . . . . 0.0 107.602 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.487 ' O ' HG23 ' A' ' 88' ' ' THR . 8.7 t -167.71 126.96 1.31 Allowed 'General case' 0 CA--C 1.474 -1.979 0 CA-C-O 127.561 3.553 . . . . 0.0 111.934 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.957 ' CD1' HG11 ' A' ' 67' ' ' VAL . 21.2 m95 -64.09 144.38 57.15 Favored 'General case' 0 C--N 1.346 0.454 0 O-C-N 116.877 -3.639 . . . . 0.0 102.792 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.7 OUTLIER -104.33 -3.48 24.12 Favored 'General case' 0 CA--C 1.471 -2.087 1 CA-C-O 131.673 5.511 . . . . 0.0 118.689 -177.83 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 116.08 -13.51 16.7 Favored Glycine 0 C--O 1.198 -2.126 1 N-CA-C 102.883 -4.087 . . . . 0.0 102.883 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.473 ' O ' ' HB ' ' A' ' 93' ' ' THR . 1.1 p-10 179.33 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.609 1 O-C-N 131.325 4.78 . . . . 0.0 111.891 -179.979 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.645 HG23 ' CG2' ' A' ' 95' ' ' VAL 0.315 12.6 t 161.49 130.26 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 128.093 2.557 . . . . 0.0 116.386 179.448 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.576 ' N ' ' CZ3' ' A' ' 89' ' ' TRP . 6.4 tp -52.48 -38.16 58.83 Favored 'General case' 0 CA--C 1.482 -1.66 0 N-CA-C 118.63 2.826 . . . . 0.0 118.63 -177.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.645 ' CG2' HG23 ' A' ' 93' ' ' THR . 18.1 t 28.7 120.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.285 0 N-CA-C 120.63 3.567 . . . . 0.0 120.63 -178.082 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.607 ' HB2' HG22 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -139.52 137.79 35.77 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 103.416 -2.809 . . . . 0.0 103.416 179.314 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.41 ' O ' ' N ' ' A' ' 99' ' ' LYS . 3.5 t -119.93 96.57 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 119.439 3.125 . . . . 0.0 119.439 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.571 ' OE1' HG11 ' A' ' 83' ' ' VAL . 5.1 mm-40 -66.0 94.12 0.22 Allowed 'General case' 0 C--N 1.364 1.215 0 CA-C-O 123.992 1.853 . . . . 0.0 106.504 178.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' A' ' 97' ' ' VAL . 3.4 tttp -91.59 -56.19 3.21 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 110.036 -3.257 . . . . 0.0 114.404 -178.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.556 ' O ' HG22 ' A' ' 83' ' ' VAL . . . -49.58 146.13 7.56 Favored Glycine 0 C--O 1.206 -1.612 0 CA-C-O 124.426 2.125 . . . . 0.0 112.599 -179.217 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 69.98 165.79 0.28 Allowed 'General case' 0 CA--C 1.498 -1.046 1 CA-C-N 107.808 -4.196 . . . . 0.0 108.865 179.8 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.43 ' HD2' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -43.57 -48.68 7.56 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.468 2.307 . . . . 0.0 113.09 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.43 ' N ' ' HD2' ' A' ' 102' ' ' LYS . 3.3 mm-40 -42.27 147.72 0.24 Allowed 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 109.964 -3.289 . . . . 0.0 116.147 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.411 ' O ' ' HB ' ' A' ' 121' ' ' THR . 2.8 m120 -125.15 71.4 1.19 Allowed 'General case' 0 N--CA 1.492 1.632 1 CA-C-N 106.451 -4.886 . . . . 0.0 101.971 179.573 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 28.8 mmm-85 -88.65 1.85 54.3 Favored 'General case' 0 C--O 1.204 -1.326 1 O-C-N 131.749 5.656 . . . . 0.0 114.045 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.412 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.65 98.43 0.01 OUTLIER Glycine 0 N--CA 1.43 -1.764 2 O-C-N 134.256 7.222 . . . . 0.0 116.596 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.609 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.283 0.0 OUTLIER -108.89 126.92 53.58 Favored 'General case' 0 C--O 1.214 -0.764 1 O-C-N 131.074 4.632 . . . . 0.0 109.068 178.725 . . . . . . . . 5 4 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.543 ' HG3' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -162.48 178.57 8.49 Favored 'General case' 0 C--O 1.209 -1.055 1 O-C-N 130.877 5.111 . . . . 0.0 112.81 -179.074 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.589 HE22 ' HG ' ' A' ' 118' ' ' LEU 0.286 0.0 OUTLIER -133.28 -177.22 4.42 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 112.985 -3.388 . . . . 0.0 107.644 -179.825 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.543 ' CZ3' ' HG3' ' A' ' 108' ' ' LYS . 0.6 OUTLIER 174.93 92.66 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.416 1 O-C-N 131.445 5.466 . . . . 0.0 118.183 178.221 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.405 ' CG2' ' HA ' ' A' ' 4' ' ' ASP 0.277 77.5 t -31.64 100.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.783 0 O-C-N 119.134 -2.229 . . . . 0.0 115.774 179.714 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.546 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -101.41 4.05 41.03 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 112.348 -2.205 . . . . 0.0 116.617 -179.595 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 151.0 -94.08 0.15 Allowed Glycine 0 N--CA 1.435 -1.368 0 O-C-N 120.767 -1.208 . . . . 0.0 113.789 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -118.62 24.66 10.76 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 117.692 2.479 . . . . 0.0 117.692 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.429 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -172.79 153.38 2.68 Favored 'General case' 0 CA--C 1.508 -0.654 1 O-C-N 129.931 4.519 . . . . 0.0 110.477 -179.792 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.778 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 2.3 mt -96.26 112.53 24.24 Favored 'General case' 0 C--O 1.199 -1.565 1 O-C-N 129.386 4.179 . . . . 0.0 114.667 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.546 ' CD1' ' HB2' ' A' ' 112' ' ' GLU . 17.6 m-85 -74.0 98.11 2.99 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 114.596 -2.842 . . . . 0.0 115.661 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.589 ' HG ' HE22 ' A' ' 109' ' ' GLN . 0.2 OUTLIER -80.27 79.14 6.89 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 128.73 3.769 . . . . 0.0 108.047 179.786 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -93.88 122.34 36.28 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 125.373 1.671 . . . . 0.0 109.783 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.444 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -134.03 150.47 51.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 126.363 2.29 . . . . 0.0 109.025 179.856 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.439 HG23 HG22 ' A' ' 126' ' ' VAL . 2.5 m -106.24 168.04 9.41 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.472 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -162.72 41.91 0.12 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 125.991 2.805 . . . . 0.0 115.618 -179.704 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 76.06 70.62 1.25 Allowed Glycine 0 C--O 1.218 -0.876 0 CA-C-N 109.547 -3.478 . . . . 0.0 111.731 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 102.72 -50.01 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.977 0 C-N-CA 129.088 2.955 . . . . 0.0 110.672 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.502 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 3.3 mm-40 -73.64 143.38 46.32 Favored 'General case' 0 C--O 1.217 -0.657 1 O-C-N 129.197 4.061 . . . . 0.0 108.562 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.439 HG22 HG23 ' A' ' 121' ' ' THR . 94.9 t -124.81 87.02 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 O-C-N 128.114 3.384 . . . . 0.0 112.523 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.9 t -56.83 143.46 37.05 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ARG . . . . . 0.416 ' HB3' ' HB3' ' A' ' 15' ' ' GLU . 4.8 ttp180 -127.51 135.68 50.7 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 128.495 3.622 . . . . 0.0 110.467 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -124.42 135.56 53.36 Favored 'General case' 0 N--CA 1.481 1.122 1 O-C-N 129.157 4.036 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.452 ' O ' HG12 ' A' ' 130' ' ' VAL . 54.1 t -127.99 74.74 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.202 -1.445 0 N-CA-C 102.996 -2.965 . . . . 0.0 102.996 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 2.5 m-85 -54.86 -176.34 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.807 2 CA-C-N 104.677 -5.692 . . . . 0.0 111.52 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -164.16 107.71 0.95 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 114.846 -2.502 . . . . 0.0 105.271 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.583 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -51.99 129.55 27.44 Favored 'General case' 0 N--CA 1.475 0.795 1 O-C-N 130.536 4.897 . . . . 0.0 108.682 178.521 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.423 ' HD3' ' HB ' ' A' ' 8' ' ' THR . 1.2 pttt . . . . . 0 CA--C 1.504 -0.819 0 N-CA-C 118.075 2.62 . . . . 0.0 118.075 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.486 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.505 -0.761 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.455 ' HA ' ' NE2' ' A' ' 45' ' ' GLN . 1.4 m-20 -77.09 132.19 38.75 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -154.3 66.4 0.7 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 116.938 -1.905 . . . . 0.0 107.62 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -44.31 146.3 0.69 Allowed 'General case' 0 N--CA 1.44 -0.959 1 O-C-N 129.96 4.538 . . . . 0.0 111.579 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.38 -169.81 33.87 Favored Glycine 0 C--O 1.207 -1.536 0 C-N-CA 117.546 -2.264 . . . . 0.0 111.993 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.474 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -127.64 147.98 50.37 Favored 'General case' 0 C--O 1.203 -1.381 1 O-C-N 131.954 5.149 . . . . 0.0 104.515 179.704 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.518 ' CZ3' ' HG3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.05 105.92 3.99 Favored 'General case' 0 C--N 1.32 -0.717 0 O-C-N 128.499 3.624 . . . . 0.0 116.705 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' N ' ' A' ' 12' ' ' GLU . 3.1 mt-10 -78.75 107.96 11.83 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 127.258 2.849 . . . . 0.0 108.997 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.428 ' HB3' ' HG2' ' A' ' 39' ' ' GLN 0.273 5.8 ttp -64.08 85.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 103.507 -2.775 . . . . 0.0 103.507 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 10' ' ' GLU . 36.8 tt0 -45.24 -30.28 1.19 Allowed 'General case' 0 C--N 1.312 -1.042 1 O-C-N 130.988 5.18 . . . . 0.0 112.006 -179.955 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.1 m -144.7 149.53 35.78 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 113.377 -1.738 . . . . 0.0 111.447 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.421 ' ND2' ' CE ' ' A' ' 11' ' ' MET . 5.9 t-20 -128.59 110.18 12.02 Favored 'General case' 0 C--O 1.206 -1.236 1 O-C-N 129.503 4.252 . . . . 0.0 112.665 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -110.97 125.31 53.57 Favored 'General case' 0 CA--C 1.496 -1.103 1 O-C-N 131.348 5.405 . . . . 0.0 113.717 179.446 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 57.66 85.97 0.08 Allowed 'General case' 0 C--O 1.209 -1.07 0 CA-C-O 122.277 1.037 . . . . 0.0 109.393 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.678 ' CE2' HG22 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -105.4 -29.36 10.29 Favored 'General case' 0 CA--C 1.487 -1.449 0 CA-C-O 124.944 2.307 . . . . 0.0 109.148 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.451 ' HG3' ' HB3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -78.7 -48.68 14.5 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 114.982 -2.437 . . . . 0.0 110.601 179.154 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -59.58 -20.88 53.29 Favored Glycine 0 N--CA 1.475 1.241 0 O-C-N 128.43 3.581 . . . . 0.0 111.214 178.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.44 -38.69 48.95 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-O 127.434 3.492 . . . . 0.0 105.611 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.451 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -69.12 -36.3 77.35 Favored 'General case' 0 C--O 1.214 -0.789 0 CA-C-N 111.194 -2.73 . . . . 0.0 109.617 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.82 -22.57 60.78 Favored 'General case' 0 C--O 1.207 -1.164 1 O-C-N 134.03 7.081 . . . . 0.0 114.617 -179.328 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.14 -27.65 61.79 Favored 'General case' 0 N--CA 1.477 0.924 2 O-C-N 132.082 5.864 . . . . 0.0 109.11 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.729 HD12 ' HB ' ' A' ' 26' ' ' ILE . 0.6 OUTLIER -122.95 25.53 8.54 Favored 'General case' 0 CA--C 1.542 0.651 1 O-C-N 130.362 4.789 . . . . 0.0 105.484 179.775 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.402 ' C ' ' N ' ' A' ' 27' ' ' ASP . 1.6 m-20 57.72 -73.72 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.646 0 C-N-CA 130.826 3.65 . . . . 0.0 111.786 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.729 ' HB ' HD12 ' A' ' 24' ' ' LEU . 4.5 tt 28.54 49.8 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.046 3 CA-C-O 130.333 4.873 . . . . 0.0 106.84 179.557 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -67.87 62.41 0.08 Allowed 'General case' 0 N--CA 1.49 1.552 1 CA-C-N 107.992 -4.186 . . . . 0.0 113.844 -177.454 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.488 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 2.8 m-30 -106.72 -43.14 4.77 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 118.153 2.649 . . . . 0.0 118.153 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' A' ' 28' ' ' PHE . . . 158.36 155.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 104.328 -2.471 . . . . 0.0 104.328 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.769 HG23 ' O ' ' A' ' 34' ' ' ALA . 2.4 m 154.04 -50.26 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.099 1 O-C-N 131.148 5.28 . . . . 0.0 110.392 -178.972 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.48 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -50.36 -32.66 17.97 Favored 'General case' 0 N--CA 1.472 0.632 1 O-C-N 132.597 6.186 . . . . 0.0 106.288 179.234 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.48 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.6 OUTLIER -82.89 -45.69 13.9 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 127.807 3.192 . . . . 0.0 106.493 178.366 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.547 HD13 ' HA ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -172.76 97.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.383 0 CA-C-O 128.245 3.878 . . . . 0.0 115.948 177.305 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.769 ' O ' HG23 ' A' ' 30' ' ' THR . . . 169.25 46.25 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.543 0 CA-C-O 127.697 3.618 . . . . 0.0 107.732 175.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.678 HG22 ' CE2' ' A' ' 17' ' ' PHE . 58.6 t -62.03 -25.93 38.68 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.622 1 CA-C-N 106.932 -4.667 . . . . 0.0 108.282 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.537 ' C ' HD12 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 174.84 -80.83 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.868 1 CA-C-N 107.917 -4.22 . . . . 0.0 108.421 177.133 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.75 HD23 ' CD1' ' A' ' 58' ' ' PHE . 0.0 OUTLIER 123.1 2.09 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.035 1 O-C-N 132.613 6.196 . . . . 0.0 110.977 178.3 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.462 ' N ' HD13 ' A' ' 37' ' ' LEU . 1.3 m 157.85 -70.34 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.309 1 O-C-N 129.871 4.482 . . . . 0.0 112.675 179.359 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.497 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 0.5 OUTLIER 57.56 101.14 0.02 OUTLIER 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -121.44 75.22 1.16 Allowed 'General case' 0 C--O 1.2 -1.539 1 O-C-N 131.44 5.462 . . . . 0.0 109.712 179.122 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.411 ' HD3' ' C ' ' A' ' 41' ' ' LYS . 0.1 OUTLIER -56.82 138.0 54.02 Favored 'General case' 0 N--CA 1.49 1.564 1 O-C-N 132.373 6.046 . . . . 0.0 106.823 -179.646 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.531 ' HB ' ' HD3' ' A' ' 53' ' ' LYS . 5.3 mt -136.46 109.1 8.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 O-C-N 127.509 3.005 . . . . 0.0 111.901 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.499 HD11 ' HB2' ' A' ' 45' ' ' GLN 0.262 0.3 OUTLIER -83.97 118.62 31.65 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.672 1 CA-C-N 106.922 -4.672 . . . . 0.0 110.157 -179.432 . . . . . . . . 5 4 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 45' ' ' GLN . 0.9 OUTLIER -95.84 -40.77 11.19 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.485 0 CA-C-N 112.047 -2.342 . . . . 0.0 112.939 -179.143 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.499 ' HB2' HD11 ' A' ' 43' ' ' ILE . 47.3 tt0 18.4 102.7 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.523 0 O-C-N 127.936 3.272 . . . . 0.0 117.617 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -118.86 23.95 11.13 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-N 111.124 -2.762 . . . . 0.0 117.017 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.31 106.01 2.24 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-O 116.601 -2.222 . . . . 0.0 109.904 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 68.37 -68.13 0.18 Allowed 'General case' 0 C--O 1.211 -0.962 0 O-C-N 128.509 3.123 . . . . 0.0 109.454 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -71.63 99.29 2.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 112.833 -3.461 . . . . 0.0 107.58 178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.489 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 2.3 t80 -122.55 102.88 8.33 Favored 'General case' 0 CA--C 1.484 -1.576 1 O-C-N 130.444 4.84 . . . . 0.0 113.509 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 93.03 3.95 Favored 'General case' 0 C--O 1.194 -1.835 0 O-C-N 128.375 3.547 . . . . 0.0 115.198 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 62' ' ' ASP . 0.3 OUTLIER -69.21 155.19 40.81 Favored 'General case' 0 CA--C 1.499 -0.984 0 O-C-N 127.248 2.842 . . . . 0.0 107.322 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HD3' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -168.58 143.46 3.36 Favored 'General case' 0 CA--C 1.485 -1.52 0 C-N-CA 115.843 -2.343 . . . . 0.0 112.551 -179.712 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.7 t -90.1 175.06 7.3 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 112.905 -1.952 . . . . 0.0 108.218 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.85 23.58 2.62 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.657 ' CB ' HD11 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -36.48 -64.88 0.31 Allowed 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.572 5.545 . . . . 0.0 110.187 179.969 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.414 ' HB ' ' O ' ' A' ' 56' ' ' SER . 1.4 t 118.62 -36.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 O-C-N 130.076 4.61 . . . . 0.0 103.02 -179.747 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.75 ' CD1' HD23 ' A' ' 37' ' ' LEU . 2.2 m-85 -58.55 -64.83 0.79 Allowed 'General case' 0 C--O 1.241 0.632 0 O-C-N 126.849 2.593 . . . . 0.0 110.987 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.79 106.76 4.14 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 127.788 3.18 . . . . 0.0 110.291 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -99.4 64.92 1.36 Allowed 'General case' 0 C--O 1.21 -0.992 1 O-C-N 129.286 4.116 . . . . 0.0 107.508 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.76 77.89 1.74 Allowed 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 128.957 3.911 . . . . 0.0 108.692 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB3' HG22 ' A' ' 52' ' ' THR . 0.2 OUTLIER -101.83 -65.73 0.96 Allowed 'General case' 0 C--O 1.204 -1.331 0 O-C-N 126.632 2.457 . . . . 0.0 114.232 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.5 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 0.5 OUTLIER -149.41 103.86 3.33 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.916 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.442 ' C ' ' CD1' ' A' ' 65' ' ' PHE . 8.2 p-10 -126.23 70.76 1.24 Allowed 'General case' 0 CA--C 1.499 -1.018 0 C-N-CA 118.158 -1.417 . . . . 0.0 110.597 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.5 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -134.84 160.83 36.97 Favored 'General case' 0 C--N 1.353 0.743 1 CA-C-O 129.205 4.336 . . . . 0.0 111.02 179.842 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.429 HG22 HG23 ' A' ' 69' ' ' VAL . 1.2 m -107.77 102.44 11.66 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 109.454 -3.521 . . . . 0.0 102.862 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.525 HG11 ' CD1' ' A' ' 89' ' ' TRP . 14.1 t -33.52 129.39 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.489 -1.379 1 O-C-N 129.568 4.293 . . . . 0.0 115.97 -179.258 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.61 -18.39 56.58 Favored Glycine 0 N--CA 1.481 1.638 0 CA-C-N 111.517 -2.583 . . . . 0.0 112.968 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 69' ' ' VAL . 97.2 t -88.38 79.03 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 119.136 -1.025 . . . . 0.0 109.486 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.777 ' HG3' HD12 ' A' ' 86' ' ' LEU . 4.8 tt0 -38.04 105.45 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.501 2 O-C-N 132.871 6.357 . . . . 0.0 110.611 179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.491 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -64.86 92.5 0.1 Allowed 'General case' 0 CA--C 1.51 -0.569 0 O-C-N 129.043 3.964 . . . . 0.0 114.314 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -58.22 70.77 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 0 O-C-N 126.656 2.473 . . . . 0.0 113.125 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.598 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 13.9 mt-10 54.51 -165.79 0.09 Allowed 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 123.274 1.511 . . . . 0.0 110.688 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 72.84 86.31 0.11 Allowed 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 110.307 -3.133 . . . . 0.0 114.513 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.455 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 14.4 p -94.98 -70.88 0.69 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.4 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.455 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 43.54 140.62 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.954 2 O-C-N 130.218 4.699 . . . . 0.0 116.781 179.666 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.02 -15.77 61.1 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.644 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.497 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 8.2 tp -153.1 53.24 0.75 Allowed 'General case' 0 C--N 1.347 0.459 0 O-C-N 128.994 3.408 . . . . 0.0 116.028 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.5 t0 141.63 -67.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 O-C-N 128.568 3.667 . . . . 0.0 110.22 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.05 82.6 0.32 Allowed Glycine 0 C--O 1.213 -1.185 0 CA-C-N 110.073 -3.239 . . . . 0.0 110.557 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.97 -125.36 0.14 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 108.512 -3.844 . . . . 0.0 113.803 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER 178.68 93.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 120.455 1.48 . . . . 0.0 107.476 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.46 HG13 ' N ' ' A' ' 99' ' ' LYS . 68.0 t -128.88 151.6 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 O-C-N 127.8 3.187 . . . . 0.0 118.445 -178.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.492 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.3 OUTLIER -78.24 95.65 5.04 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.064 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.491 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 76.7 m -99.84 81.74 2.49 Favored 'General case' 0 C--O 1.202 -1.439 0 CA-C-N 109.41 -3.541 . . . . 0.0 116.566 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.777 HD12 ' HG3' ' A' ' 70' ' ' GLU . 0.6 OUTLIER -82.12 141.93 32.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 108.684 -3.871 . . . . 0.0 113.437 179.853 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.426 HG21 ' CD2' ' A' ' 65' ' ' PHE . 39.1 t -131.02 131.37 64.07 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 125.699 1.6 . . . . 0.0 108.673 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.441 HG22 ' N ' ' A' ' 89' ' ' TRP 0.261 99.2 m -156.42 170.73 21.64 Favored 'General case' 0 CA--C 1.476 -1.89 0 CA-C-N 113.02 -1.9 . . . . 0.0 111.412 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.68 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 31.1 m95 -100.37 143.54 30.43 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 129.134 2.973 . . . . 0.0 106.61 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.538 ' CG ' HG21 ' A' ' 95' ' ' VAL . 0.9 OUTLIER -99.07 -12.49 20.49 Favored 'General case' 0 CA--C 1.477 -1.852 0 CA-C-O 127.237 3.399 . . . . 0.0 113.286 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 128.31 -29.61 4.04 Favored Glycine 0 C--O 1.196 -2.264 0 CA-C-N 109.961 -3.29 . . . . 0.0 105.226 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -150.11 24.15 0.83 Allowed 'General case' 0 N--CA 1.434 -1.257 1 O-C-N 130.041 4.024 . . . . 0.0 111.841 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.507 HG22 ' CB ' ' A' ' 90' ' ' GLU . 5.3 t -174.01 163.48 4.01 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.562 2.43 . . . . 0.0 117.562 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.436 ' N ' ' OG1' ' A' ' 93' ' ' THR . 1.1 tp -92.99 98.41 11.33 Favored 'General case' 0 C--O 1.209 -1.046 0 CA-C-O 125.332 2.491 . . . . 0.0 114.343 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.538 HG21 ' CG ' ' A' ' 90' ' ' GLU 0.271 90.6 t -100.0 112.2 31.83 Favored 'Isoleucine or valine' 0 C--N 1.363 1.159 0 CA-C-N 110.406 -3.088 . . . . 0.0 112.623 179.672 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.416 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -139.42 150.04 44.78 Favored 'General case' 0 C--O 1.196 -1.726 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.36 139.48 43.66 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 128.102 3.376 . . . . 0.0 114.489 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.524 ' CD ' ' HB3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -111.07 107.69 17.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.328 1.851 . . . . 0.0 107.266 179.065 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.46 ' N ' HG13 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.69 98.92 3.5 Favored 'General case' 0 C--O 1.201 -1.464 0 C-N-CA 115.203 -2.599 . . . . 0.0 112.797 -179.329 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -165.92 57.36 0.25 Allowed Glycine 0 C--O 1.212 -1.239 0 CA-C-O 124.428 2.127 . . . . 0.0 111.95 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 62.3 145.65 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.188 1 CA-C-N 106.365 -4.918 . . . . 0.0 113.916 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.406 ' HD3' ' C ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER 99.17 -49.71 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 110.94 -2.846 . . . . 0.0 116.348 179.357 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -156.11 -177.87 6.9 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 108.46 -3.973 . . . . 0.0 114.899 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -128.22 88.63 2.78 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 113.633 -3.079 . . . . 0.0 104.107 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.651 ' NH1' HD22 ' A' ' 24' ' ' LEU . 10.3 mmm-85 -68.59 -9.27 48.6 Favored 'General case' 0 C--O 1.201 -1.468 1 O-C-N 130.508 4.88 . . . . 0.0 113.345 179.419 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.435 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -33.43 114.85 0.11 Allowed Glycine 0 C--N 1.352 1.441 1 O-C-N 130.483 4.864 . . . . 0.0 116.983 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.416 ' CZ2' ' SG ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -123.1 142.34 50.99 Favored 'General case' 0 C--N 1.32 -0.693 1 O-C-N 132.051 5.207 . . . . 0.0 109.878 178.738 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -165.27 170.85 14.29 Favored 'General case' 0 CA--C 1.505 -0.786 1 O-C-N 129.442 4.214 . . . . 0.0 112.697 -179.292 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.453 ' C ' ' CG ' ' A' ' 110' ' ' TRP . 3.9 mp0 -132.71 -178.35 4.9 Favored 'General case' 0 C--N 1.365 1.265 0 C-N-CA 115.989 -2.284 . . . . 0.0 108.616 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.453 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.0 OUTLIER -159.67 15.75 0.15 Allowed 'General case' 0 CA--C 1.501 -0.925 1 O-C-N 129.279 4.112 . . . . 0.0 118.063 -179.823 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.3 t 39.87 71.13 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.628 0 CA-C-O 125.821 2.724 . . . . 0.0 115.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.439 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 2.8 mm-40 -97.02 84.8 3.6 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-O 125.924 2.773 . . . . 0.0 117.308 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.58 87.79 0.01 OUTLIER Glycine 0 C--O 1.197 -2.206 0 O-C-N 119.048 -2.283 . . . . 0.0 117.347 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 41.16 51.79 3.44 Favored 'General case' 0 CA--C 1.501 -0.936 0 C-N-CA 128.576 2.75 . . . . 0.0 118.39 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 6.4 pttt 177.14 146.12 0.1 Allowed 'General case' 0 C--N 1.32 -0.713 0 O-C-N 129.057 3.973 . . . . 0.0 109.982 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.406 HD13 ' CH2' ' A' ' 9' ' ' TRP . 4.9 mp -105.3 104.56 14.32 Favored 'General case' 0 C--O 1.199 -1.563 0 O-C-N 128.308 3.505 . . . . 0.0 118.605 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.479 ' HE1' HG13 ' A' ' 130' ' ' VAL . 6.8 m-30 -70.2 93.27 0.82 Allowed 'General case' 0 C--O 1.203 -1.369 0 O-C-N 127.988 3.305 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.811 HD12 ' CZ ' ' A' ' 131' ' ' PHE . 1.2 mt -82.73 69.4 9.51 Favored 'General case' 0 C--N 1.346 0.449 1 CA-C-N 108.356 -4.02 . . . . 0.0 107.338 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -73.88 111.01 8.62 Favored 'General case' 0 CA--C 1.501 -0.938 1 O-C-N 129.316 4.135 . . . . 0.0 110.26 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.44 160.13 23.73 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 126.821 2.576 . . . . 0.0 113.46 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.23 160.4 36.25 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 127.006 2.691 . . . . 0.0 105.175 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.429 ' HB3' ' CD ' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -163.95 70.57 0.21 Allowed 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 125.197 2.427 . . . . 0.0 110.952 -179.647 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.2 -57.59 0.44 Allowed Glycine 0 CA--C 1.525 0.708 0 CA-C-N 111.76 -2.473 . . . . 0.0 108.769 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.8 t0 166.8 53.05 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 125.933 1.693 . . . . 0.0 106.549 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -119.8 10.23 11.57 Favored 'General case' 0 N--CA 1.475 0.776 1 O-C-N 129.259 4.099 . . . . 0.0 109.06 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.533 HG13 ' O ' ' A' ' 126' ' ' VAL . 12.6 p 4.39 72.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.967 1 O-C-N 130.082 4.614 . . . . 0.0 116.761 179.914 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 64.1 m -64.33 133.44 52.67 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 119.744 -1.847 . . . . 0.0 112.019 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.28 93.32 4.43 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 128.241 3.463 . . . . 0.0 113.701 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -84.54 157.07 21.38 Favored 'General case' 0 CA--C 1.499 -1.001 0 C-N-CA 116.12 -2.232 . . . . 0.0 115.311 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.479 HG13 ' HE1' ' A' ' 117' ' ' TYR . 74.3 t -140.43 123.54 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 126.482 3.039 . . . . 0.0 106.958 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.811 ' CZ ' HD12 ' A' ' 118' ' ' LEU . 4.3 m-85 -100.74 -177.75 3.57 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 110.226 -3.17 . . . . 0.0 115.82 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.464 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.257 0.0 OUTLIER -157.89 124.29 4.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 110.751 -2.931 . . . . 0.0 103.885 179.895 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.518 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 30.6 tttt -75.66 113.77 13.48 Favored 'General case' 0 C--O 1.198 -1.643 1 O-C-N 129.147 4.029 . . . . 0.0 112.406 179.609 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt . . . . . 0 CA--C 1.498 -1.039 0 N-CA-C 116.547 2.055 . . . . 0.0 116.547 -179.968 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 89' ' ' TRP . 9.4 mttm . . . . . 0 CA--C 1.504 -0.822 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.752 ' HA ' HG21 ' A' ' 111' ' ' VAL . 83.8 m-20 -80.52 -97.32 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 102.704 -3.073 . . . . 0.0 102.704 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -175.28 -94.18 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 113.506 -3.14 . . . . 0.0 107.692 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 158.25 112.83 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.018 1 O-C-N 130.116 4.635 . . . . 0.0 111.771 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 177.65 -141.17 5.1 Favored Glycine 0 C--O 1.209 -1.456 0 CA-C-O 117.057 -1.968 . . . . 0.0 114.967 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.728 HG23 ' CG1' ' A' ' 42' ' ' ILE . 63.2 m -147.31 148.86 31.83 Favored 'General case' 0 C--O 1.215 -0.715 1 O-C-N 130.193 4.114 . . . . 0.0 104.003 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.536 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.258 0.0 OUTLIER -139.26 118.06 12.38 Favored 'General case' 0 CA--C 1.508 -0.65 1 O-C-N 130.128 4.642 . . . . 0.0 111.594 -179.112 . . . . . . . . 5 4 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.94 -6.29 32.0 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 126.891 2.62 . . . . 0.0 115.581 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.421 ' O ' ' HA ' ' A' ' 131' ' ' PHE . 1.9 ttm 83.56 -79.91 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 112.857 -3.449 . . . . 0.0 107.219 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 11' ' ' MET . 0.5 OUTLIER 123.8 -28.23 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.069 0 O-C-N 128.875 3.859 . . . . 0.0 106.62 -179.236 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.288 3.1 p 164.18 160.97 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 110.872 -2.876 . . . . 0.0 110.182 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -121.67 136.23 54.95 Favored 'General case' 0 CA--C 1.486 -1.514 0 O-C-N 128.55 3.656 . . . . 0.0 115.96 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -87.45 -137.38 0.09 Allowed 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 110.902 -2.863 . . . . 0.0 111.279 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -41.34 95.81 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.186 0 C-N-CA 124.37 1.068 . . . . 0.0 113.077 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -111.07 -36.92 5.5 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-O 126.646 3.117 . . . . 0.0 110.454 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.47 ' HG3' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.04 -29.39 60.77 Favored 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 119.758 -1.838 . . . . 0.0 115.455 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.47 ' N ' ' HG3' ' A' ' 18' ' ' GLU . . . -78.29 -23.78 64.89 Favored Glycine 0 N--CA 1.485 1.909 0 O-C-N 127.723 3.14 . . . . 0.0 109.194 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -71.79 -20.37 61.87 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 123.747 1.737 . . . . 0.0 107.966 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.503 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -78.52 -34.68 47.08 Favored 'General case' 0 CA--C 1.488 -1.417 0 C-N-CA 116.705 -1.998 . . . . 0.0 109.237 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.412 ' HD3' ' HB3' ' A' ' 28' ' ' PHE . 2.7 mtmt -71.61 -27.74 63.32 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-N 109.668 -3.424 . . . . 0.0 115.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.661 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -66.87 -31.64 72.38 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 108.764 -3.835 . . . . 0.0 111.369 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.746 HD23 ' N ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -93.36 -24.61 18.04 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 128.462 3.601 . . . . 0.0 107.579 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t0 65.7 74.88 0.36 Allowed 'General case' 0 C--O 1.2 -1.534 1 O-C-N 129.4 4.188 . . . . 0.0 105.38 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.722 HD12 HD12 ' A' ' 78' ' ' LEU . 2.1 tt -104.64 -54.88 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 CA-C-N 109.426 -3.534 . . . . 0.0 115.316 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.432 ' N ' HG23 ' A' ' 26' ' ' ILE . 1.4 t0 -167.2 32.44 0.03 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 115.138 -2.363 . . . . 0.0 113.874 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.418 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -16.99 129.35 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 O-C-N 127.975 3.297 . . . . 0.0 117.916 179.568 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 92.91 66.53 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 127.66 3.1 . . . . 0.0 107.745 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -119.69 -47.5 2.42 Favored 'General case' 0 C--O 1.218 -0.598 2 CA-C-N 105.576 -5.284 . . . . 0.0 112.949 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.51 113.51 0.46 Allowed 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 129.691 4.369 . . . . 0.0 107.805 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttt 179.62 -47.76 0.01 OUTLIER 'General case' 0 CA--C 1.491 -1.319 0 O-C-N 127.892 3.245 . . . . 0.0 110.23 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.702 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.2 OUTLIER -124.11 -11.18 6.54 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.241 0 O-C-N 126.987 2.68 . . . . 0.0 112.894 -179.831 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -101.61 19.09 18.69 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-O 124.071 1.891 . . . . 0.0 112.091 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.4 t -49.27 -37.34 10.36 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.374 0 CA-C-N 109.519 -3.491 . . . . 0.0 109.386 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.766 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -171.38 151.01 2.97 Favored 'General case' 0 C--O 1.21 -0.991 1 CA-C-N 106.42 -4.9 . . . . 0.0 112.123 179.833 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.112 HD11 ' CE1' ' A' ' 58' ' ' PHE . 2.5 pt? 153.99 -19.12 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.991 2 O-C-N 134.88 7.613 . . . . 0.0 106.282 177.026 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.51 ' HA ' ' HB2' ' A' ' 56' ' ' SER . 16.1 m -46.36 -29.46 1.69 Allowed 'General case' 0 N--CA 1.485 1.281 1 O-C-N 132.269 5.981 . . . . 0.0 109.455 175.231 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.557 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.0 OUTLIER 42.57 -171.66 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 118.556 2.798 . . . . 0.0 118.556 179.313 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.557 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 57.5 m -20.13 90.99 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 131.575 3.95 . . . . 0.0 115.522 178.243 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.534 ' HE3' ' CD1' ' A' ' 9' ' ' TRP 0.262 0.0 OUTLIER -75.33 161.28 29.42 Favored 'General case' 0 N--CA 1.492 1.631 1 O-C-N 129.414 4.196 . . . . 0.0 101.889 178.94 . . . . . . . . 5 4 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.728 ' CG1' HG23 ' A' ' 8' ' ' THR . 11.6 mt -137.72 164.34 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.282 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.482 ' N ' HG22 ' A' ' 42' ' ' ILE . 5.8 tt -140.02 150.02 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.485 0 O-C-N 127.489 2.993 . . . . 0.0 108.932 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.3 t -130.62 -46.67 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 C-N-CA 115.014 -2.674 . . . . 0.0 115.973 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.428 ' HB3' ' CD2' ' A' ' 50' ' ' PHE . 2.5 pp0? 32.47 101.53 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 126.052 2.834 . . . . 0.0 115.205 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.18 51.88 1.75 Allowed 'General case' 0 CA--C 1.494 -1.179 0 CA-C-N 110.465 -3.061 . . . . 0.0 114.021 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.06 98.28 0.01 OUTLIER Glycine 0 N--CA 1.475 1.267 0 CA-C-N 115.349 -0.841 . . . . 0.0 115.028 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.518 ' O ' HG23 ' A' ' 67' ' ' VAL . 0.2 OUTLIER 84.16 -60.49 0.11 Allowed 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 127.645 2.615 . . . . 0.0 110.935 -179.649 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.37 124.45 33.4 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 128.541 3.651 . . . . 0.0 107.755 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.654 ' CD1' ' CZ ' ' A' ' 65' ' ' PHE . 3.3 t80 -125.12 138.37 54.17 Favored 'General case' 0 CA--C 1.484 -1.583 1 O-C-N 131.059 5.224 . . . . 0.0 117.796 -178.56 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.408 ' HD3' ' HB3' ' A' ' 64' ' ' ASP . 54.0 mttt -145.15 100.32 3.45 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 178.137 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.577 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -84.52 160.66 20.46 Favored 'General case' 0 N--CA 1.473 0.694 1 O-C-N 129.568 4.292 . . . . 0.0 106.251 177.176 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.551 ' HG2' HD12 ' A' ' 42' ' ' ILE . 20.1 tttt -158.91 137.72 11.1 Favored 'General case' 0 CA--C 1.481 -1.696 0 C-N-CA 114.119 -3.032 . . . . 0.0 112.327 -177.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.569 HG22 ' HB3' ' A' ' 56' ' ' SER . 0.9 OUTLIER -86.94 123.39 32.0 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 110.343 -3.117 . . . . 0.0 108.877 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.436 ' O ' ' NE2' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -102.41 11.59 37.79 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 113.849 -2.977 . . . . 0.0 114.883 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.569 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.6 p -39.6 173.31 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.695 1 O-C-N 133.288 6.617 . . . . 0.0 112.385 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.72 6.08 25.37 Favored 'General case' 0 N--CA 1.48 1.031 1 CA-C-N 107.16 -4.564 . . . . 0.0 102.801 178.886 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 1.112 ' CE1' HD11 ' A' ' 37' ' ' LEU . 2.6 m-30 -121.57 -78.81 0.6 Allowed 'General case' 0 C--N 1.357 0.905 0 O-C-N 126.831 2.582 . . . . 0.0 116.659 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.459 ' NH1' HD22 ' A' ' 78' ' ' LEU . 5.2 mtt180 -106.85 123.55 48.32 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 109.073 -3.694 . . . . 0.0 116.143 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.37 62.35 1.52 Allowed 'General case' 0 C--O 1.198 -1.62 1 O-C-N 129.76 4.412 . . . . 0.0 105.792 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -95.75 16.29 17.87 Favored 'General case' 0 N--CA 1.448 -0.553 2 O-C-N 131.458 5.474 . . . . 0.0 111.271 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 1.89 126.42 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.131 1 O-C-N 133.076 6.485 . . . . 0.0 117.156 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.806 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 4.2 tp -78.17 61.81 2.76 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.751 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.408 ' HB3' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -101.37 101.12 11.7 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 126.354 2.284 . . . . 0.0 111.112 -179.788 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.785 ' CD2' HG21 ' A' ' 87' ' ' VAL . 17.2 p90 -133.29 -152.38 0.49 Allowed 'General case' 0 CA--C 1.486 -1.5 0 CA-C-O 124.991 2.329 . . . . 0.0 107.527 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.625 HG22 ' HB ' ' A' ' 69' ' ' VAL . 0.9 OUTLIER -159.08 141.47 13.95 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 118.408 -2.683 . . . . 0.0 104.582 -179.759 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.838 HG11 ' CD1' ' A' ' 89' ' ' TRP . 2.5 t -65.25 131.24 31.05 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.836 0 O-C-N 128.771 3.794 . . . . 0.0 115.823 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 61.92 24.73 65.09 Favored Glycine 0 N--CA 1.474 1.18 0 CA-C-N 112.188 -2.278 . . . . 0.0 116.398 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.625 ' HB ' HG22 ' A' ' 66' ' ' THR 0.316 1.8 p -93.77 -16.5 7.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 O-C-N 126.013 1.655 . . . . 0.0 110.918 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 72.88 107.37 0.07 Allowed 'General case' 0 C--N 1.355 0.814 1 O-C-N 129.405 4.19 . . . . 0.0 108.195 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.595 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.7 t80 -97.71 31.63 2.56 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 128.11 3.382 . . . . 0.0 113.649 -178.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -16.8 103.08 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.3 0 C-N-CA 127.245 2.218 . . . . 0.0 116.416 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.409 ' HG3' ' CB ' ' A' ' 82' ' ' ASN . 2.7 tt0 69.92 -168.58 0.17 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-O 124.533 2.111 . . . . 0.0 112.254 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 82.39 85.83 0.04 OUTLIER 'General case' 0 C--O 1.21 -1.002 0 CA-C-O 125.6 2.619 . . . . 0.0 116.798 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.252 0.6 OUTLIER -114.96 -52.11 2.71 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 110.525 -3.034 . . . . 0.0 111.99 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.8 pttt -27.18 111.72 0.05 OUTLIER 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 128.633 3.708 . . . . 0.0 115.302 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 155.41 -33.97 0.64 Allowed Glycine 0 C--O 1.212 -1.223 0 CA-C-N 110.993 -2.821 . . . . 0.0 112.624 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.722 HD12 HD12 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -115.02 -52.04 2.7 Favored 'General case' 0 N--CA 1.474 0.747 1 CA-C-N 106.896 -4.652 . . . . 0.0 115.587 -179.866 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.601 ' HB2' HD13 ' A' ' 24' ' ' LEU . 58.6 t0 -109.84 -60.33 1.8 Allowed 'General case' 0 C--O 1.215 -0.756 0 O-C-N 120.035 -1.666 . . . . 0.0 112.85 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.02 75.05 1.22 Allowed Glycine 0 N--CA 1.477 1.403 0 CA-C-O 126.336 3.187 . . . . 0.0 110.7 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -142.0 -130.2 0.1 Allowed 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 108.807 -3.697 . . . . 0.0 113.2 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.409 ' CB ' ' HG3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -176.3 111.39 0.1 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 120.006 1.276 . . . . 0.0 110.931 -179.865 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.492 HG22 ' HA3' ' A' ' 100' ' ' GLY . 58.8 t -137.59 144.58 31.01 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.174 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -35.77 -75.94 0.03 OUTLIER 'General case' 0 CA--C 1.507 -0.703 1 O-C-N 130.108 4.63 . . . . 0.0 110.69 -179.589 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.595 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 7.7 m 71.23 61.56 0.17 Allowed 'General case' 0 CA--C 1.497 -1.067 0 C-N-CA 128.758 2.823 . . . . 0.0 112.878 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 1.4 tp -82.23 136.38 35.1 Favored 'General case' 0 N--CA 1.43 -1.459 1 CA-C-N 107.723 -4.308 . . . . 0.0 110.44 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.785 HG21 ' CD2' ' A' ' 65' ' ' PHE . 47.8 t -108.83 147.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 125.244 1.418 . . . . 0.0 108.449 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.259 53.3 m -161.12 152.35 18.85 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 111.419 -2.628 . . . . 0.0 112.07 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.838 ' CD1' HG11 ' A' ' 67' ' ' VAL 0.268 19.1 m95 -92.47 121.97 34.45 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 127.341 2.256 . . . . 0.0 105.043 179.738 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HB2' HG23 ' A' ' 95' ' ' VAL . 3.4 tt0 -88.22 -148.75 0.16 Allowed 'General case' 0 CA--C 1.477 -1.864 0 CA-C-O 126.381 2.991 . . . . 0.0 112.189 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -42.22 95.86 Favored Glycine 0 N--CA 1.488 2.119 0 N-CA-C 103.342 -3.903 . . . . 0.0 103.342 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -169.8 67.35 0.05 Allowed 'General case' 0 C--O 1.21 -1.008 1 O-C-N 130.04 4.023 . . . . 0.0 110.809 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.42 ' O ' ' CE3' ' A' ' 89' ' ' TRP . 1.7 t 176.15 169.9 0.42 Allowed 'General case' 0 C--O 1.2 -1.549 0 N-CA-C 117.19 2.293 . . . . 0.0 117.19 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.589 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -96.8 94.22 7.14 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 129.103 2.961 . . . . 0.0 113.921 179.364 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.408 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.319 50.5 t -103.75 141.28 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.898 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 179.776 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.1 OUTLIER -143.81 127.77 17.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 125.433 1.708 . . . . 0.0 107.705 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.425 HG22 ' H ' ' A' ' 97' ' ' VAL . 35.4 m -104.63 98.8 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.442 0 CA-C-O 127.234 3.397 . . . . 0.0 118.437 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.47 ' CB ' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -73.75 92.24 1.99 Allowed 'General case' 0 C--N 1.355 0.826 0 O-C-N 117.594 -3.191 . . . . 0.0 109.045 179.683 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.424 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.5 OUTLIER -97.41 87.29 4.09 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 108.649 -3.887 . . . . 0.0 111.403 -179.761 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.492 ' HA3' HG22 ' A' ' 83' ' ' VAL . . . -145.59 91.83 0.16 Allowed Glycine 0 C--O 1.211 -1.306 0 C-N-CA 117.16 -2.448 . . . . 0.0 113.571 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 49.63 -70.78 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 110.712 -2.744 . . . . 0.0 115.401 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.431 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -100.45 -73.44 0.64 Allowed 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -179.004 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -48.78 160.21 0.2 Allowed 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -128.84 76.91 1.75 Allowed 'General case' 0 N--CA 1.491 1.599 2 O-C-N 131.759 5.662 . . . . 0.0 102.344 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.406 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 13.7 mmm-85 -87.13 -3.7 59.08 Favored 'General case' 0 C--O 1.212 -0.901 0 O-C-N 127.637 3.086 . . . . 0.0 114.383 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -34.86 86.21 0.01 OUTLIER Glycine 0 CA--C 1.535 1.322 2 CA-C-N 105.796 -5.184 . . . . 0.0 117.24 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.806 ' CZ2' HD21 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -84.66 132.44 34.47 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 127.275 2.397 . . . . 0.0 110.289 178.892 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.422 ' C ' ' NE2' ' A' ' 109' ' ' GLN . 0.3 OUTLIER -159.78 168.87 24.87 Favored 'General case' 0 C--O 1.2 -1.511 1 O-C-N 129.403 4.189 . . . . 0.0 118.458 -179.558 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.55 ' HB3' HD21 ' A' ' 116' ' ' LEU . 8.8 mm-40 -128.78 169.61 14.33 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 110.152 -3.204 . . . . 0.0 110.125 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.445 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.2 OUTLIER -166.46 14.39 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.074 1 O-C-N 129.351 4.157 . . . . 0.0 118.565 179.263 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.752 HG21 ' HA ' ' A' ' 4' ' ' ASP . 25.4 t 29.86 105.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.475 -1.912 0 CA-C-O 127.72 3.628 . . . . 0.0 119.673 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -123.05 49.64 1.63 Allowed 'General case' 0 N--CA 1.484 1.271 0 O-C-N 118.479 -2.638 . . . . 0.0 114.033 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.33 -132.82 6.38 Favored Glycine 0 C--O 1.202 -1.854 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.429 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.94 38.59 1.61 Allowed 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 127.677 2.391 . . . . 0.0 114.113 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.451 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 54.9 pttt -168.2 162.17 12.7 Favored 'General case' 0 CA--C 1.515 -0.384 1 O-C-N 130.747 5.029 . . . . 0.0 110.129 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.59 HD12 HG22 ' A' ' 111' ' ' VAL . 1.4 tt -118.8 104.59 10.71 Favored 'General case' 0 C--O 1.207 -1.165 0 O-C-N 126.285 2.241 . . . . 0.0 114.371 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -57.94 110.35 0.9 Allowed 'General case' 0 C--O 1.201 -1.491 1 O-C-N 129.554 4.283 . . . . 0.0 115.343 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -98.37 71.52 2.05 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 127.803 3.19 . . . . 0.0 106.533 179.89 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.445 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.3 mt-10 -83.5 105.58 14.55 Favored 'General case' 0 CA--C 1.484 -1.564 1 O-C-N 130.294 4.746 . . . . 0.0 112.277 -179.883 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.772 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -109.15 155.57 20.87 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 114.151 -1.386 . . . . 0.0 108.376 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.772 ' O ' HD12 ' A' ' 120' ' ' LEU . 1.9 m -109.9 161.48 15.44 Favored 'General case' 0 CA--C 1.489 -1.391 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.661 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -161.45 72.39 0.41 Allowed 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 121.259 1.845 . . . . 0.0 115.008 -179.957 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 34.6 67.1 0.28 Allowed Glycine 0 N--CA 1.435 -1.374 0 C-N-CA 126.397 1.951 . . . . 0.0 114.557 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 119.43 -56.15 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.342 0 O-C-N 128.888 3.346 . . . . 0.0 109.85 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.429 ' C ' HG23 ' A' ' 126' ' ' VAL . 32.2 mm-40 -75.44 162.13 28.61 Favored 'General case' 0 C--N 1.352 0.683 0 O-C-N 127.972 3.295 . . . . 0.0 107.627 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.429 HG23 ' C ' ' A' ' 125' ' ' GLN . 7.7 t -146.18 82.7 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 CA-C-N 109.214 -3.63 . . . . 0.0 113.335 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 38.8 t -51.26 144.53 9.46 Favored 'General case' 0 CA--C 1.504 -0.805 0 O-C-N 124.644 1.215 . . . . 0.0 109.614 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -135.39 63.79 1.6 Allowed 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 116.953 -1.498 . . . . 0.0 113.215 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -48.18 168.07 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.727 1 O-C-N 129.767 4.417 . . . . 0.0 115.484 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.35 120.73 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 102.71 -3.071 . . . . 0.0 102.71 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 30.8 m-85 -102.12 178.87 4.48 Favored 'General case' 0 CA--C 1.475 -1.934 0 CA-C-O 127.098 3.332 . . . . 0.0 118.538 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.451 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.1 OUTLIER -168.85 117.78 0.69 Allowed 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 110.593 -3.003 . . . . 0.0 108.947 -179.55 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.465 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 28.2 ttpt -59.38 108.07 0.66 Allowed 'General case' 0 CA--C 1.488 -1.421 0 O-C-N 128.104 3.377 . . . . 0.0 116.156 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.501 -0.91 0 CA-C-O 114.786 -2.53 . . . . 0.0 113.489 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.551 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 0.5 OUTLIER . . . . . 0 CA--C 1.498 -1.056 0 N-CA-C 119.32 3.081 . . . . 0.0 119.32 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.32 122.2 27.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -134.05 31.38 3.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 113.744 -3.026 . . . . 0.0 108.621 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.438 ' HA ' HG23 ' A' ' 43' ' ' ILE . 2.4 m120 -24.41 128.16 0.03 OUTLIER 'General case' 0 C--O 1.236 0.381 1 O-C-N 130.136 4.648 . . . . 0.0 110.63 179.568 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 42' ' ' ILE . . . -175.37 -118.15 0.51 Allowed Glycine 0 C--O 1.221 -0.693 0 C-N-CA 115.746 -3.121 . . . . 0.0 114.511 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.565 ' CG2' HG23 ' A' ' 40' ' ' THR . 98.4 m 177.67 144.54 0.11 Allowed 'General case' 0 N--CA 1.476 0.85 1 O-C-N 132.504 5.473 . . . . 0.0 106.018 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.56 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -144.5 90.07 2.06 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -179.727 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -57.69 100.75 0.06 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 128.493 3.621 . . . . 0.0 106.779 179.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.403 ' O ' ' CB ' ' A' ' 12' ' ' GLU . 32.2 ttm -32.61 -59.89 0.31 Allowed 'General case' 0 N--CA 1.479 0.99 0 O-C-N 129.099 4.0 . . . . 0.0 109.611 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.403 ' CB ' ' O ' ' A' ' 11' ' ' MET . 1.9 tt0 98.58 -44.54 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.012 0 O-C-N 125.946 2.029 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.25 15.7 m -174.62 149.41 1.25 Allowed 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 110.015 -3.266 . . . . 0.0 113.711 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -125.38 139.62 53.51 Favored 'General case' 0 C--O 1.213 -0.867 2 O-C-N 129.816 4.447 . . . . 0.0 110.495 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -71.08 -95.53 0.01 OUTLIER 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 109.375 -3.557 . . . . 0.0 111.31 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 5.1 p30 -83.94 147.18 27.62 Favored 'General case' 0 C--O 1.204 -1.297 0 O-C-N 119.225 -2.172 . . . . 0.0 109.004 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -116.8 -68.39 0.92 Allowed 'General case' 0 C--O 1.204 -1.316 0 O-C-N 127.041 2.713 . . . . 0.0 111.263 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 -46.73 87.01 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 117.747 2.499 . . . . 0.0 117.747 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.495 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.18 -25.36 25.11 Favored Glycine 0 CA--C 1.491 -1.415 0 O-C-N 128.786 3.804 . . . . 0.0 113.308 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.506 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -75.14 -43.18 54.05 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 104.734 -2.321 . . . . 0.0 104.734 179.399 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.407 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -72.12 -21.54 61.46 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 116.487 -2.085 . . . . 0.0 112.302 -179.728 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.495 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 1.3 ttmt -76.87 -40.92 45.86 Favored 'General case' 0 C--O 1.207 -1.135 0 O-C-N 129.023 3.952 . . . . 0.0 113.084 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.405 ' CB ' ' HB2' ' A' ' 122' ' ' CYS . . . -56.3 -44.38 79.83 Favored 'General case' 0 C--O 1.214 -0.815 0 O-C-N 128.905 3.878 . . . . 0.0 115.222 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.064 HD11 ' HB2' ' A' ' 79' ' ' ASP . 0.1 OUTLIER -88.96 1.6 55.21 Favored 'General case' 0 N--CA 1.491 1.576 2 O-C-N 130.76 5.038 . . . . 0.0 109.177 -178.661 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 50.22 82.92 0.05 OUTLIER 'General case' 0 CA--C 1.48 -1.726 0 CA-C-O 127.83 3.681 . . . . 0.0 114.447 178.3 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.413 HG21 HD13 ' A' ' 26' ' ' ILE . 2.2 tt -110.8 -33.56 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.632 0 CA-C-N 110.946 -2.843 . . . . 0.0 111.873 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 179.82 127.59 0.08 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.539 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -79.18 12.88 2.08 Favored 'General case' 0 CA--C 1.5 -0.946 0 C-N-CA 116.162 -2.215 . . . . 0.0 116.485 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -172.61 75.05 0.04 OUTLIER 'General case' 0 C--O 1.208 -1.102 0 CA-C-O 123.09 1.424 . . . . 0.0 110.712 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.66 -31.67 6.1 Favored 'General case' 0 C--N 1.353 0.724 2 CA-C-N 106.348 -4.933 . . . . 0.0 115.872 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.418 ' CG ' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -57.04 -164.57 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.963 1 O-C-N 129.654 4.346 . . . . 0.0 112.514 -179.775 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' A' ' 31' ' ' ARG . 14.5 tttm 67.76 39.61 2.63 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 125.658 1.849 . . . . 0.0 108.58 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.502 HG22 ' N ' ' A' ' 34' ' ' ALA . 0.4 OUTLIER -166.0 -49.78 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.93 2 O-C-N 130.095 4.622 . . . . 0.0 111.534 179.934 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.502 ' N ' HG22 ' A' ' 33' ' ' ILE . . . -93.14 18.55 9.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.657 -1.902 . . . . 0.0 113.912 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.6 t -40.31 -36.35 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.278 0 CA-C-O 124.231 1.967 . . . . 0.0 110.372 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.684 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -154.69 153.86 31.99 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 109.831 -3.349 . . . . 0.0 107.687 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.701 HD13 ' CZ ' ' A' ' 58' ' ' PHE . 2.1 pt? 148.79 -18.21 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 2 O-C-N 135.608 8.068 . . . . 0.0 110.811 178.755 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.695 ' HA ' ' HB3' ' A' ' 56' ' ' SER 0.265 0.5 OUTLIER -77.13 51.32 0.81 Allowed 'General case' 0 CA--C 1.48 -1.728 0 C-N-CA 130.547 3.539 . . . . 0.0 119.063 -176.837 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.431 ' HG2' ' N ' ' A' ' 40' ' ' THR . 26.6 tt0 -122.42 144.25 49.16 Favored 'General case' 0 CA--C 1.493 -1.224 0 O-C-N 119.106 -2.246 . . . . 0.0 116.69 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.566 HG22 ' O ' ' A' ' 40' ' ' THR . 99.6 m 97.85 64.5 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.327 0 C-N-CA 130.352 3.461 . . . . 0.0 111.072 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.499 ' HD3' ' C ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -76.46 150.07 36.73 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 108.406 -3.997 . . . . 0.0 101.93 179.752 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.551 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.3 mt -143.0 158.5 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 125.65 1.844 . . . . 0.0 109.246 179.446 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.551 ' N ' HG22 ' A' ' 42' ' ' ILE 0.292 18.2 tt -132.95 148.17 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 1 O-C-N 129.399 4.187 . . . . 0.0 111.428 -179.685 . . . . . . . . 4 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 44' ' ' VAL . 77.7 t -154.95 85.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.658 0 CA-C-N 111.93 -2.395 . . . . 0.0 110.066 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.74 84.72 6.3 Favored 'General case' 0 CA--C 1.485 -1.519 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.07 -13.7 59.92 Favored 'General case' 0 C--N 1.364 1.198 0 O-C-N 126.933 2.646 . . . . 0.0 117.985 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 146.33 -103.3 0.27 Allowed Glycine 0 C--O 1.212 -1.273 0 N-CA-C 111.432 -0.667 . . . . 0.0 111.432 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.07 40.24 1.36 Allowed 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 124.58 0.812 . . . . 0.0 110.776 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -176.29 86.39 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 O-C-N 127.048 2.717 . . . . 0.0 109.318 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.515 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 1.8 t80 -99.19 135.12 41.06 Favored 'General case' 0 CA--C 1.486 -1.499 1 O-C-N 131.187 5.304 . . . . 0.0 112.105 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -144.48 90.53 2.1 Favored 'General case' 0 CA--C 1.481 -1.71 0 O-C-N 128.63 3.706 . . . . 0.0 117.421 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.584 ' HB ' HD23 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -70.75 120.06 15.8 Favored 'General case' 0 CA--C 1.501 -0.917 0 O-C-N 128.276 3.485 . . . . 0.0 106.907 179.728 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.53 ' HD2' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.83 146.17 49.4 Favored 'General case' 0 CA--C 1.49 -1.344 0 C-N-CA 117.407 -1.717 . . . . 0.0 107.967 -178.605 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.468 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 5.7 t -105.95 175.18 5.58 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.147 1.529 . . . . 0.0 113.22 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -148.96 37.53 0.79 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.695 ' HB3' ' HA ' ' A' ' 38' ' ' THR . 1.1 p -62.54 142.15 58.11 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 128.513 2.725 . . . . 0.0 108.314 179.618 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 37' ' ' LEU 0.254 0.1 OUTLIER -39.45 -50.56 2.13 Favored 'General case' 0 N--CA 1.489 1.518 1 O-C-N 130.608 4.942 . . . . 0.0 106.669 -179.952 . . . . . . . . 5 4 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.701 ' CZ ' HD13 ' A' ' 37' ' ' LEU . 12.2 p90 -166.57 76.38 0.19 Allowed 'General case' 0 C--N 1.366 1.318 0 O-C-N 126.967 2.667 . . . . 0.0 115.203 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.62 51.29 0.0 OUTLIER 'General case' 0 C--N 1.363 1.186 1 CA-C-N 107.298 -4.501 . . . . 0.0 111.235 179.788 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.468 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 15.6 m-80 -86.59 107.17 18.03 Favored 'General case' 0 C--O 1.219 -0.543 2 CA-C-N 107.799 -4.273 . . . . 0.0 112.777 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -124.94 98.3 5.63 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 127.943 3.277 . . . . 0.0 106.816 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.63 152.68 41.56 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.495 2.997 . . . . 0.0 115.552 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.584 HD23 ' HB ' ' A' ' 52' ' ' THR . 11.9 tp -117.8 47.17 1.6 Allowed 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 112.95 -1.932 . . . . 0.0 111.456 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -87.1 94.37 9.62 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 124.479 2.085 . . . . 0.0 112.544 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -140.05 -153.01 0.44 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 126.103 1.761 . . . . 0.0 106.528 179.447 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.417 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -151.03 -178.63 6.72 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-O 116.873 -1.537 . . . . 0.0 108.017 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.417 ' N ' ' OG1' ' A' ' 66' ' ' THR . 63.4 t -80.64 119.24 29.81 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.642 1 O-C-N 133.74 6.9 . . . . 0.0 112.597 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.52 9.48 55.42 Favored Glycine 0 N--CA 1.484 1.885 0 CA-C-N 109.451 -3.522 . . . . 0.0 117.447 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.608 HG13 ' N ' ' A' ' 71' ' ' PHE 0.285 14.0 p -59.78 -17.79 13.91 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 O-C-N 124.902 1.001 . . . . 0.0 111.312 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.445 ' HG2' HD12 ' A' ' 86' ' ' LEU . 0.0 OUTLIER 61.61 63.17 1.2 Allowed 'General case' 0 CA--C 1.543 0.681 0 O-C-N 128.546 3.654 . . . . 0.0 107.433 -179.013 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.608 ' N ' HG13 ' A' ' 69' ' ' VAL . 12.0 t80 -64.85 141.46 58.77 Favored 'General case' 0 CA--C 1.494 -1.211 2 CA-C-N 106.33 -4.941 . . . . 0.0 118.954 -178.164 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -100.32 104.15 15.59 Favored 'General case' 0 C--O 1.21 -1.026 0 O-C-N 119.347 -2.096 . . . . 0.0 110.225 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -72.11 74.32 0.93 Allowed 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 125.336 2.493 . . . . 0.0 109.642 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -80.24 116.59 20.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 109.509 -3.496 . . . . 0.0 112.008 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.469 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.2 OUTLIER -157.66 -179.47 8.19 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 114.013 -1.449 . . . . 0.0 113.04 -179.62 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.469 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -150.54 -52.2 0.14 Allowed 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 127.185 3.374 . . . . 0.0 110.43 179.51 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -44.65 -32.88 3.1 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 108.793 -3.821 . . . . 0.0 108.261 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.0 tp -124.05 79.89 1.77 Allowed 'General case' 0 CA--C 1.529 0.165 0 O-C-N 129.22 3.541 . . . . 0.0 115.536 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 1.064 ' HB2' HD11 ' A' ' 24' ' ' LEU . 17.7 t70 85.82 -63.81 0.05 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.807 3.192 . . . . 0.0 110.333 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.83 119.58 2.46 Favored Glycine 0 C--O 1.213 -1.177 0 CA-C-N 109.02 -3.718 . . . . 0.0 115.868 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.02 -123.55 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 O-C-N 126.818 2.128 . . . . 0.0 113.413 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.0 p30 168.8 63.44 0.0 OUTLIER 'General case' 0 C--O 1.197 -1.698 0 CA-C-N 119.923 1.238 . . . . 0.0 112.417 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.782 HG12 ' O ' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -90.84 158.93 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.027 0 CA-C-O 116.418 -1.753 . . . . 0.0 112.717 179.948 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 99' ' ' LYS . 7.8 mmpt? -68.28 169.0 11.29 Favored 'General case' 0 C--N 1.326 -0.44 1 O-C-N 129.392 4.183 . . . . 0.0 107.053 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 85' ' ' THR . 1.2 m -171.32 77.3 0.06 Allowed 'General case' 0 C--O 1.194 -1.823 1 O-C-N 131.11 5.256 . . . . 0.0 111.107 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.445 HD12 ' HG2' ' A' ' 70' ' ' GLU . 2.1 tt -68.38 141.52 55.7 Favored 'General case' 0 N--CA 1.431 -1.398 1 CA-C-N 105.975 -5.102 . . . . 0.0 109.886 179.647 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.1 t -129.91 144.43 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.069 1.347 . . . . 0.0 108.446 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.674 HG23 ' HB ' ' A' ' 95' ' ' VAL . 2.9 t -163.49 177.26 9.0 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 126.378 2.99 . . . . 0.0 110.482 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.658 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 65.3 m95 -102.12 133.99 46.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 128.484 2.714 . . . . 0.0 110.236 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.435 ' HG2' HG21 ' A' ' 95' ' ' VAL . 1.0 OUTLIER -88.1 -37.82 15.91 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-O 131.651 5.501 . . . . 0.0 111.605 179.871 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.08 65.32 0.32 Allowed Glycine 0 N--CA 1.481 1.655 2 CA-C-N 106.429 -4.896 . . . . 0.0 102.226 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 149.26 -36.2 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 132.888 5.699 . . . . 0.0 111.007 -179.87 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.46 174.55 10.5 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 119.19 3.033 . . . . 0.0 119.19 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.87 82.6 2.27 Favored 'General case' 0 CA--C 1.485 -1.548 0 C-N-CA 129.596 3.159 . . . . 0.0 115.766 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.674 ' HB ' HG23 ' A' ' 88' ' ' THR 0.339 97.9 t -77.19 131.53 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-N 108.888 -3.778 . . . . 0.0 113.188 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.546 ' CB ' ' CZ2' ' A' ' 107' ' ' TRP . 0.5 OUTLIER -141.39 134.17 28.77 Favored 'General case' 0 C--O 1.201 -1.449 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -131.63 123.2 51.7 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.107 0 CA-C-N 109.58 -3.463 . . . . 0.0 116.035 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.582 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 1.4 tt0 -85.37 98.67 10.69 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 126.747 3.165 . . . . 0.0 110.382 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.782 ' O ' HG12 ' A' ' 83' ' ' VAL . 7.4 mttm -81.65 158.79 24.17 Favored 'General case' 0 C--O 1.205 -1.251 1 CA-C-N 108.11 -4.132 . . . . 0.0 106.846 -179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.4 138.93 5.85 Favored Glycine 0 C--O 1.211 -1.306 0 O-C-N 126.947 2.654 . . . . 0.0 107.212 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.471 ' HG2' ' N ' ' A' ' 102' ' ' LYS . 71.2 tt0 63.24 163.26 0.11 Allowed 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 109.48 -3.36 . . . . 0.0 108.718 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.471 ' N ' ' HG2' ' A' ' 101' ' ' GLU . 0.1 OUTLIER -39.96 -58.48 1.4 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 112.114 -2.312 . . . . 0.0 111.548 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.17 146.22 0.93 Allowed 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 111.128 -2.76 . . . . 0.0 113.192 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -127.17 64.55 1.32 Allowed 'General case' 0 N--CA 1.483 1.22 2 O-C-N 130.141 4.65 . . . . 0.0 103.576 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.582 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 3.6 mmm180 -67.33 69.73 0.1 Allowed 'General case' 0 N--CA 1.478 0.972 0 O-C-N 128.127 3.392 . . . . 0.0 113.853 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -114.08 95.92 0.76 Allowed Glycine 0 C--O 1.205 -1.67 0 CA-C-O 113.689 -3.84 . . . . 0.0 111.769 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.546 ' CZ2' ' CB ' ' A' ' 96' ' ' CYS . 9.3 p90 -88.71 1.8 54.48 Favored 'General case' 0 C--O 1.195 -1.791 2 O-C-N 134.226 6.486 . . . . 0.0 115.656 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.47 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 7.0 ptpt -24.5 141.63 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.359 2 O-C-N 130.482 4.864 . . . . 0.0 113.819 -179.338 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.511 ' HG3' ' CD2' ' A' ' 118' ' ' LEU 0.287 1.5 mp0 -102.96 169.98 8.25 Favored 'General case' 0 C--N 1.362 1.147 0 CA-C-N 112.539 -2.119 . . . . 0.0 109.793 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.489 ' C ' HG23 ' A' ' 111' ' ' VAL . 19.0 m95 -127.11 -57.93 1.3 Allowed 'General case' 0 C--O 1.208 -1.11 1 O-C-N 129.587 4.304 . . . . 0.0 116.968 179.47 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.489 HG23 ' C ' ' A' ' 110' ' ' TRP . 21.2 t 93.05 68.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-O 127.635 3.588 . . . . 0.0 108.654 -175.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.21 120.27 40.19 Favored 'General case' 0 CA--C 1.478 -1.818 1 CA-C-N 108.069 -4.15 . . . . 0.0 118.302 -176.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 14.79 83.73 0.01 OUTLIER Glycine 0 C--O 1.215 -1.073 0 C-N-CA 127.289 2.376 . . . . 0.0 116.183 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 49.38 81.11 0.06 Allowed 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 115.81 -2.043 . . . . 0.0 116.239 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.467 ' HB2' ' HB3' ' A' ' 131' ' ' PHE . 0.4 OUTLIER 148.13 -167.77 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.132 1 O-C-N 133.79 6.931 . . . . 0.0 110.46 -179.855 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.472 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -145.99 71.26 1.26 Allowed 'General case' 0 CA--C 1.493 -1.245 0 O-C-N 128.938 3.899 . . . . 0.0 115.589 -179.936 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -44.67 126.23 5.42 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 126.727 2.517 . . . . 0.0 116.255 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.511 ' CD2' ' HG3' ' A' ' 109' ' ' GLN . 28.4 mt -110.24 117.7 34.37 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 111.396 -2.638 . . . . 0.0 106.578 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.37 105.22 13.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 115.728 -2.082 . . . . 0.0 106.198 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.13 118.96 34.83 Favored 'General case' 0 N--CA 1.489 1.487 1 O-C-N 131.328 5.392 . . . . 0.0 114.023 -179.739 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.2 m -96.72 145.81 25.46 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 110.643 -2.981 . . . . 0.0 103.758 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.505 ' HB3' ' HD3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -133.62 39.68 3.18 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 125.382 2.515 . . . . 0.0 111.295 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 114.06 -80.97 0.29 Allowed Glycine 0 C--O 1.218 -0.851 0 CA-C-N 113.428 -1.715 . . . . 0.0 109.96 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.24 -18.77 13.52 Favored 'General case' 0 CA--C 1.494 -1.202 0 C-N-CA 125.547 1.539 . . . . 0.0 111.876 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -103.55 159.93 15.17 Favored 'General case' 0 C--O 1.198 -1.643 0 O-C-N 125.855 1.972 . . . . 0.0 107.611 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.45 ' O ' HG23 ' A' ' 126' ' ' VAL . 11.0 m -134.01 131.53 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 CA-C-N 109.215 -3.629 . . . . 0.0 112.542 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.7 m -117.86 119.64 35.49 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 116.297 -1.811 . . . . 0.0 110.006 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.24 102.95 12.64 Favored 'General case' 0 N--CA 1.484 1.269 1 O-C-N 129.258 4.099 . . . . 0.0 110.885 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -68.4 167.17 15.19 Favored 'General case' 0 CA--C 1.491 -1.309 0 C-N-CA 114.121 -3.032 . . . . 0.0 116.049 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.3 t -141.8 81.07 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.605 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.467 ' HB3' ' HB2' ' A' ' 115' ' ' LYS . 16.2 m-85 -66.92 175.58 2.42 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 109.968 -3.287 . . . . 0.0 117.976 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.258 4.3 tptt -159.93 99.7 1.39 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 109.036 -3.711 . . . . 0.0 107.872 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.529 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 28.1 ttpt -57.56 110.03 0.8 Allowed 'General case' 0 C--O 1.218 -0.585 0 CA-C-O 115.539 -2.172 . . . . 0.0 109.904 178.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.492 -1.262 0 N-CA-C 118.756 2.873 . . . . 0.0 118.756 -178.65 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.539 ' HE2' ' CE3' ' A' ' 89' ' ' TRP . 1.4 mtmt . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 29.2 t0 44.9 71.37 0.27 Allowed 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 124.501 2.096 . . . . 0.0 107.759 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -97.57 -75.88 0.53 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.205 -179.498 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.424 ' OD1' ' N ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 47.26 135.05 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.629 1 O-C-N 131.897 5.748 . . . . 0.0 114.473 -176.677 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.3 -133.87 1.63 Allowed Glycine 0 C--O 1.206 -1.603 0 CA-C-N 109.874 -3.33 . . . . 0.0 114.431 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.9 t -174.47 62.36 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.321 1 O-C-N 131.476 4.868 . . . . 0.0 108.129 -179.023 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.621 ' CZ2' HD13 ' A' ' 116' ' ' LEU 0.253 0.0 OUTLIER -51.82 106.77 0.16 Allowed 'General case' 0 CA--C 1.507 -0.675 1 O-C-N 130.677 4.986 . . . . 0.0 115.595 -179.495 . . . . . . . . 5 4 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -48.8 -25.81 2.05 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 116.966 -1.493 . . . . 0.0 114.162 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.5 ttp 83.65 -74.39 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.9 1 O-C-N 129.609 4.318 . . . . 0.0 105.744 -179.855 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 102.1 -48.08 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.527 0 O-C-N 128.028 3.33 . . . . 0.0 111.773 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.6 137.13 28.12 Favored 'General case' 0 C--N 1.361 1.087 0 CA-C-N 110.143 -3.208 . . . . 0.0 110.006 -179.803 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -121.01 100.23 6.95 Favored 'General case' 0 C--O 1.197 -1.686 0 N-CA-C 117.942 2.571 . . . . 0.0 117.942 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.518 ' HB3' ' C ' ' A' ' 128' ' ' ARG . 15.9 pt-20 5.37 -133.5 0.0 OUTLIER 'General case' 0 CA--C 1.473 -1.987 2 O-C-N 136.34 8.525 . . . . 0.0 117.005 178.402 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 0.3 OUTLIER -112.64 137.25 51.18 Favored 'General case' 0 C--O 1.203 -1.354 1 O-C-N 114.651 -5.031 . . . . 0.0 106.755 -179.519 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.515 ' CE2' HG22 ' A' ' 35' ' ' VAL . 1.9 p90 -118.19 -30.15 5.37 Favored 'General case' 0 CA--C 1.487 -1.469 0 O-C-N 127.565 3.041 . . . . 0.0 114.908 -178.563 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 22' ' ' LYS . 12.3 tt0 -74.78 -53.84 8.44 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 115.778 -2.058 . . . . 0.0 110.551 179.757 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.52 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -59.3 -24.35 58.9 Favored Glycine 0 N--CA 1.474 1.217 1 O-C-N 132.869 6.356 . . . . 0.0 111.479 178.741 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -70.77 -46.74 62.38 Favored 'General case' 0 C--O 1.195 -1.767 0 CA-C-O 125.752 2.692 . . . . 0.0 106.047 179.676 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.9 mmt -73.35 -23.71 60.25 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.495 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.52 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -78.99 -28.06 43.41 Favored 'General case' 0 C--O 1.206 -1.231 0 O-C-N 127.901 3.251 . . . . 0.0 110.124 -179.862 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -63.9 -37.62 88.06 Favored 'General case' 0 C--O 1.208 -1.097 1 O-C-N 129.517 4.26 . . . . 0.0 111.734 -179.778 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.862 HD12 ' HB2' ' A' ' 79' ' ' ASP 0.361 1.5 mm? -81.45 -56.23 4.17 Favored 'General case' 0 C--O 1.208 -1.128 2 CA-C-N 105.517 -5.31 . . . . 0.0 108.501 179.98 . . . . . . . . 4 3 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.291 19.3 t0 83.71 79.01 0.02 OUTLIER 'General case' 0 CA--C 1.484 -1.577 3 O-C-N 133.48 6.738 . . . . 0.0 107.258 -179.523 . . . . . . . . 3 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.645 HD12 ' O ' ' A' ' 78' ' ' LEU . 14.0 tt -102.29 41.13 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 128.397 3.951 . . . . 0.0 110.052 179.926 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.04 164.35 0.28 Allowed 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 109.701 -3.409 . . . . 0.0 111.641 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -87.45 84.69 7.13 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 118.812 0.733 . . . . 0.0 112.422 179.759 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 169.53 156.61 0.05 Allowed 'General case' 0 C--N 1.364 1.231 0 O-C-N 126.382 2.301 . . . . 0.0 106.07 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.274 0.4 OUTLIER 101.06 -19.22 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.847 1 O-C-N 130.876 5.11 . . . . 0.0 113.935 179.669 . . . . . . . . 4 3 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.6 162.16 15.99 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 130.562 3.545 . . . . 0.0 108.865 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 84.36 3.14 0.79 Allowed 'General case' 0 C--N 1.31 -1.139 0 O-C-N 128.431 3.582 . . . . 0.0 111.827 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 mp -128.87 -33.82 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.137 1 O-C-N 130.191 4.682 . . . . 0.0 111.404 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.48 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -99.52 16.05 24.54 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.914 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.515 HG22 ' CE2' ' A' ' 17' ' ' PHE . 12.1 t -26.78 -52.23 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.2 -1.547 0 O-C-N 127.167 2.792 . . . . 0.0 111.0 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.99 117.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 2 O-C-N 131.132 5.27 . . . . 0.0 109.144 179.674 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.92 HD12 ' N ' ' A' ' 38' ' ' THR . 2.5 pp -87.3 -45.01 10.99 Favored 'General case' 0 N--CA 1.433 -1.288 1 O-C-N 129.406 4.191 . . . . 0.0 110.664 -179.923 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.92 ' N ' HD12 ' A' ' 37' ' ' LEU . 1.3 m 145.64 117.31 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.206 1 O-C-N 134.569 7.418 . . . . 0.0 116.915 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.588 ' HG2' ' N ' ' A' ' 56' ' ' SER . 5.4 tp60 -158.12 -98.94 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 115.677 -2.409 . . . . 0.0 116.456 179.148 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.53 ' N ' ' HG3' ' A' ' 39' ' ' GLN . 1.9 m 157.72 151.55 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.597 1 O-C-N 132.633 6.208 . . . . 0.0 111.768 -175.359 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.554 ' HE3' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -110.27 131.93 54.62 Favored 'General case' 0 N--CA 1.492 1.649 1 O-C-N 129.791 4.432 . . . . 0.0 101.656 177.979 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.516 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.2 mp -107.8 164.43 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 126.333 2.271 . . . . 0.0 111.19 179.511 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.516 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -141.94 143.59 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.407 0 CA-C-N 112.386 -2.188 . . . . 0.0 106.855 179.789 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 45' ' ' GLN . 4.9 t -117.15 -66.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.223 0 C-N-CA 115.735 -2.386 . . . . 0.0 109.844 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.442 ' N ' HG12 ' A' ' 44' ' ' VAL . 1.0 OUTLIER 57.84 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 117.156 2.28 . . . . 0.0 117.156 -179.88 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -121.43 29.11 7.39 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 127.209 2.818 . . . . 0.0 116.685 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 117.57 -74.52 0.28 Allowed Glycine 0 C--O 1.213 -1.17 0 CA-C-O 118.698 -1.056 . . . . 0.0 111.914 -179.799 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.683 ' O ' HG12 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -111.23 -37.62 5.25 Favored 'General case' 0 N--CA 1.438 -1.037 0 O-C-N 126.463 1.92 . . . . 0.0 112.753 -179.828 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -83.75 85.43 7.29 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.519 1.928 . . . . 0.0 111.915 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.863 ' CD2' HD22 ' A' ' 94' ' ' LEU . 76.7 t80 -86.96 79.89 8.61 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 127.293 2.871 . . . . 0.0 112.315 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -95.96 77.13 3.15 Favored 'General case' 0 CA--C 1.481 -1.7 1 O-C-N 129.678 4.361 . . . . 0.0 118.807 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.534 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -65.37 168.92 6.45 Favored 'General case' 0 C--N 1.367 1.332 0 O-C-N 128.221 3.451 . . . . 0.0 107.319 179.812 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.521 ' N ' ' CG2' ' A' ' 52' ' ' THR 0.279 13.1 ttpt -160.3 164.99 32.14 Favored 'General case' 0 N--CA 1.488 1.473 1 O-C-N 129.125 4.016 . . . . 0.0 111.369 -175.856 . . . . . . . . 4 3 . 1 . 021 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.426 HG22 ' O ' ' A' ' 59' ' ' ARG . 1.4 m -140.45 103.31 4.53 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 110.386 -3.097 . . . . 0.0 107.233 178.882 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -78.01 -20.17 53.01 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 111.374 -2.648 . . . . 0.0 116.187 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.588 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 2.6 t -31.17 117.96 0.19 Allowed 'General case' 0 N--CA 1.469 0.505 1 O-C-N 132.649 6.218 . . . . 0.0 106.156 -179.838 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.651 HG22 ' CD2' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -52.85 -27.16 17.13 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 129.085 3.991 . . . . 0.0 108.396 -179.775 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.86 ' CD1' HD23 ' A' ' 37' ' ' LEU . 0.4 OUTLIER -61.49 -80.88 0.02 OUTLIER 'General case' 0 C--N 1.355 0.813 0 O-C-N 126.298 2.249 . . . . 0.0 111.297 179.907 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' O ' HG22 ' A' ' 54' ' ' THR . 0.0 OUTLIER -124.48 110.01 13.96 Favored 'General case' 0 C--N 1.368 1.373 0 O-C-N 126.842 2.589 . . . . 0.0 112.534 -179.849 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.18 83.82 1.98 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 128.421 3.576 . . . . 0.0 108.599 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.23 -27.95 29.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.812 3.195 . . . . 0.0 111.427 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 155.35 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 127.665 3.103 . . . . 0.0 115.257 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.989 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 8.6 tp -121.16 45.28 2.31 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.371 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -81.44 99.51 8.77 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 126.28 2.238 . . . . 0.0 110.736 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.542 ' CZ ' HG11 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -149.34 173.76 13.17 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 112.831 -1.986 . . . . 0.0 107.367 179.657 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.532 ' N ' ' CG ' ' A' ' 65' ' ' PHE . 2.1 m -132.13 135.07 46.14 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-O 117.099 -1.429 . . . . 0.0 107.683 179.65 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 48' ' ' ASP . 2.1 p -49.22 146.65 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.674 0 O-C-N 126.947 2.655 . . . . 0.0 114.705 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 65.79 16.01 63.07 Favored Glycine 0 N--CA 1.485 1.904 0 O-C-N 128.688 3.742 . . . . 0.0 115.952 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.305 1.2 t -86.06 -23.44 6.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.71 -179.642 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 72.97 72.1 0.13 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 128.559 3.662 . . . . 0.0 108.204 -178.832 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.551 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -58.28 94.8 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.723 1 CA-C-N 107.107 -4.588 . . . . 0.0 116.014 -179.662 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.25 96.22 2.76 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.894 -179.854 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.26 107.93 15.32 Favored 'General case' 0 CA--C 1.498 -1.028 0 CA-C-O 122.535 1.16 . . . . 0.0 111.827 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -75.11 -24.07 58.01 Favored 'General case' 0 C--O 1.215 -0.741 0 C-N-CA 117.539 -1.664 . . . . 0.0 110.985 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.5 m 47.75 62.9 2.24 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 112.56 -2.109 . . . . 0.0 114.501 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.58 -34.54 10.54 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 128.014 3.769 . . . . 0.0 114.318 -179.961 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.81 -20.84 76.3 Favored Glycine 0 C--O 1.209 -1.416 0 CA-C-N 109.903 -3.317 . . . . 0.0 113.175 -179.76 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.645 ' O ' HD12 ' A' ' 26' ' ' ILE . 5.2 tp -112.81 -11.02 13.53 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 128.103 2.884 . . . . 0.0 115.33 -179.939 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.862 ' HB2' HD12 ' A' ' 24' ' ' LEU . 2.7 t70 -173.78 -73.82 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.856 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.613 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.61 76.35 0.26 Allowed Glycine 0 N--CA 1.472 1.047 0 C-N-CA 128.17 2.795 . . . . 0.0 110.681 -179.596 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -116.1 -127.86 0.29 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 109.768 -3.216 . . . . 0.0 109.977 -179.648 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 165.55 61.14 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.24 1.382 . . . . 0.0 110.887 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.464 HG12 ' H ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -93.27 179.41 0.52 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-N 111.909 -2.405 . . . . 0.0 114.628 -179.812 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.464 ' H ' HG12 ' A' ' 83' ' ' VAL . 0.6 OUTLIER -126.2 151.71 47.01 Favored 'General case' 0 C--N 1.314 -0.949 1 O-C-N 133.682 6.864 . . . . 0.0 107.521 179.525 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.698 HG21 ' CZ3' ' A' ' 107' ' ' TRP . 24.2 m -149.01 74.16 1.24 Allowed 'General case' 0 C--O 1.203 -1.353 1 O-C-N 129.171 4.044 . . . . 0.0 113.603 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 132.64 54.43 Favored 'General case' 0 N--CA 1.428 -1.529 2 CA-C-N 106.524 -4.853 . . . . 0.0 109.691 -179.614 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.542 HG11 ' CZ ' ' A' ' 65' ' ' PHE . 2.0 t -122.77 155.35 28.17 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.139 0 CA-C-O 123.705 1.717 . . . . 0.0 110.606 -179.734 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.471 HG23 ' HB ' ' A' ' 95' ' ' VAL . 1.7 t -162.68 157.86 22.35 Favored 'General case' 0 CA--C 1.493 -1.247 0 CA-C-N 109.188 -3.642 . . . . 0.0 111.742 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.673 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.266 26.4 m95 -83.38 128.09 34.21 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-O 114.743 -2.551 . . . . 0.0 105.295 179.863 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.663 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.2 OUTLIER -81.59 -5.74 58.33 Favored 'General case' 0 CA--C 1.474 -1.955 1 CA-C-O 130.227 4.822 . . . . 0.0 114.223 -179.644 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 105.86 -3.63 38.88 Favored Glycine 0 C--O 1.197 -2.184 1 N-CA-C 103.098 -4.001 . . . . 0.0 103.098 -179.758 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 179.17 78.68 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.46 0 O-C-N 127.026 2.251 . . . . 0.0 107.568 179.831 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.561 HG22 ' HB2' ' A' ' 90' ' ' GLU . 4.3 t 124.46 163.86 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.361 0 C-N-CA 129.612 3.165 . . . . 0.0 116.944 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.863 HD22 ' CD2' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -103.32 78.15 1.59 Allowed 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 127.641 3.088 . . . . 0.0 116.913 179.989 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.663 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.4 98.7 t -71.55 128.83 35.07 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.254 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.455 ' SG ' HG13 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -125.7 134.61 51.75 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 120.764 1.62 . . . . 0.0 106.668 -179.943 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.9 t -117.64 119.15 60.78 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.475 0 CA-C-O 127.783 3.658 . . . . 0.0 115.413 -179.755 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.503 ' HG3' ' N ' ' A' ' 106' ' ' GLY 0.301 16.7 mm100 -78.43 98.67 6.11 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 111.49 -2.595 . . . . 0.0 115.736 179.929 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.6 ttmm -85.95 66.98 9.86 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 115.045 -2.662 . . . . 0.0 109.826 179.741 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -108.82 -156.4 17.81 Favored Glycine 0 C--O 1.203 -1.806 0 CA-C-O 126.051 3.028 . . . . 0.0 113.71 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.1 tm-20 -159.0 140.24 13.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 108.266 -3.967 . . . . 0.0 107.752 179.879 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 95.0 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 128.352 2.661 . . . . 0.0 111.737 -179.469 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -157.42 170.31 22.74 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 125.156 2.408 . . . . 0.0 113.401 179.839 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -120.02 95.48 4.78 Favored 'General case' 0 CA--C 1.515 -0.389 1 CA-C-N 106.277 -4.965 . . . . 0.0 104.469 179.973 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.492 ' CA ' ' HG3' ' A' ' 98' ' ' GLN . 5.7 mmm-85 -72.66 -8.48 55.5 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 128.276 3.485 . . . . 0.0 113.969 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.538 ' O ' HG22 ' A' ' 121' ' ' THR . . . -10.7 95.79 0.01 OUTLIER Glycine 0 N--CA 1.431 -1.687 1 O-C-N 133.467 6.729 . . . . 0.0 114.591 179.436 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.989 ' CZ2' HD21 ' A' ' 63' ' ' LEU 0.278 0.0 OUTLIER -116.03 116.15 27.39 Favored 'General case' 0 C--O 1.194 -1.825 0 O-C-N 128.308 3.005 . . . . 0.0 109.235 179.317 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -149.72 170.28 19.09 Favored 'General case' 0 C--O 1.211 -0.957 1 O-C-N 130.353 4.783 . . . . 0.0 112.238 -179.198 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.404 ' HG3' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -132.82 171.82 13.4 Favored 'General case' 0 C--N 1.366 1.285 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.771 179.974 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -176.27 93.83 0.05 Allowed 'General case' 0 C--N 1.311 -1.077 1 O-C-N 131.332 5.395 . . . . 0.0 117.24 179.32 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 49.0 t -39.07 107.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 C-N-CA 126.969 2.108 . . . . 0.0 113.029 179.473 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.23 88.88 3.01 Favored 'General case' 0 CA--C 1.488 -1.433 0 CA-C-N 109.981 -3.281 . . . . 0.0 114.208 -179.966 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.48 -112.97 3.75 Favored Glycine 0 C--O 1.2 -2.023 0 N-CA-C 117.524 1.769 . . . . 0.0 117.524 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -122.57 39.85 3.82 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 125.241 1.417 . . . . 0.0 113.74 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.49 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -178.44 162.53 1.48 Allowed 'General case' 0 C--N 1.313 -1.015 1 O-C-N 130.091 4.619 . . . . 0.0 109.407 -179.767 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.621 HD13 ' CZ2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -92.96 173.21 7.86 Favored 'General case' 0 CA--C 1.482 -1.669 0 O-C-N 128.656 3.722 . . . . 0.0 115.607 -179.617 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -142.42 80.72 1.71 Allowed 'General case' 0 C--N 1.366 1.292 1 CA-C-N 107.74 -4.3 . . . . 0.0 114.27 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.88 87.56 4.72 Favored 'General case' 0 CA--C 1.516 -0.346 1 CA-C-N 107.648 -4.342 . . . . 0.0 108.342 -179.851 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -94.7 124.96 39.04 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 127.955 3.284 . . . . 0.0 106.689 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.673 HD12 ' N ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -136.72 145.55 44.8 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 125.001 1.438 . . . . 0.0 108.875 -179.749 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.673 ' N ' HD12 ' A' ' 120' ' ' LEU . 1.5 t -127.55 174.27 9.19 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 125.227 1.579 . . . . 0.0 108.703 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 36.5 t -169.01 84.57 0.15 Allowed 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 125.052 1.47 . . . . 0.0 112.345 -179.818 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.49 -83.37 1.23 Allowed Glycine 0 N--CA 1.442 -0.934 0 O-C-N 127.993 3.308 . . . . 0.0 112.809 179.885 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -113.04 -20.04 11.66 Favored 'General case' 0 CA--C 1.497 -1.064 0 O-C-N 126.736 2.08 . . . . 0.0 112.082 179.887 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 54.8 mm-40 -91.73 163.65 14.0 Favored 'General case' 0 C--O 1.201 -1.488 0 O-C-N 126.995 2.684 . . . . 0.0 110.435 179.721 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.523 HG13 ' O ' ' A' ' 126' ' ' VAL . 4.6 p -142.8 94.86 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.794 0 CA-C-N 110.006 -3.27 . . . . 0.0 112.077 179.923 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 32.0 m -82.67 135.06 35.13 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-O 117.201 -1.38 . . . . 0.0 112.064 -179.763 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 128' ' ' ARG . . . . . 0.518 ' C ' ' HB3' ' A' ' 15' ' ' GLU . 1.5 ttp180 -117.93 113.49 21.79 Favored 'General case' 0 CA--C 1.486 -1.492 0 O-C-N 128.276 3.485 . . . . 0.0 115.902 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -88.25 157.52 18.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 115.977 -2.289 . . . . 0.0 112.037 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.5 t -140.13 131.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 N-CA-C 103.01 -2.959 . . . . 0.0 103.01 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.577 ' CD2' ' CB ' ' A' ' 9' ' ' TRP 0.25 4.3 m-30 -119.73 -178.3 3.6 Favored 'General case' 0 CA--C 1.502 -0.89 1 O-C-N 129.247 4.092 . . . . 0.0 113.418 -179.981 . . . . . . . . 4 3 . 1 . 021 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.43 ' HE3' ' HB2' ' A' ' 132' ' ' LYS 0.274 0.0 OUTLIER -167.21 41.56 0.05 OUTLIER 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 114.558 -2.639 . . . . 0.0 104.479 179.516 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.597 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 44.59 -151.87 0.04 OUTLIER 'General case' 0 CA--C 1.49 -1.33 1 O-C-N 131.071 5.232 . . . . 0.0 112.881 -179.387 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.513 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.853 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.673 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.108 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 56.63 77.53 0.25 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.97 98.61 3.2 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 116.17 -2.212 . . . . 0.0 109.426 179.895 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -65.77 153.66 41.2 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 130.242 3.417 . . . . 0.0 110.606 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 169.02 -148.46 12.27 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-O 114.41 -3.439 . . . . 0.0 109.796 -179.904 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.415 HG23 HG21 ' A' ' 40' ' ' THR . 0.4 OUTLIER -158.8 136.8 10.49 Favored 'General case' 0 C--N 1.315 -0.927 1 O-C-N 130.773 4.455 . . . . 0.0 103.695 179.919 . . . . . . . . 4 4 . 1 . 022 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.515 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.8 OUTLIER -120.99 124.84 45.84 Favored 'General case' 0 CA--C 1.495 -1.158 1 O-C-N 131.88 5.738 . . . . 0.0 117.854 -179.765 . . . . . . . . 4 4 . 1 . 022 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 132' ' ' LYS . 9.3 mt-10 -83.0 109.76 17.38 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 116.546 -2.062 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.278 8.4 ttm -67.69 81.62 0.18 Allowed 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 125.131 1.52 . . . . 0.0 108.266 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -37.42 -48.67 0.96 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.989 2.915 . . . . 0.0 110.187 179.802 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.276 4.0 m -165.8 153.84 10.89 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 108.663 -3.88 . . . . 0.0 110.532 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -105.62 137.93 42.65 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-N 110.31 -3.132 . . . . 0.0 114.293 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.41 -62.48 1.6 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 128.446 3.591 . . . . 0.0 111.562 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.433 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -135.71 138.69 43.0 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 125.623 1.569 . . . . 0.0 108.735 179.803 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 37.0 p90 -123.52 -41.88 2.25 Favored 'General case' 0 C--O 1.207 -1.148 0 CA-C-O 124.502 2.096 . . . . 0.0 112.002 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.574 ' N ' ' CD1' ' A' ' 17' ' ' PHE . 1.8 tm-20 -75.55 -34.06 60.7 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-O 115.065 -2.398 . . . . 0.0 112.216 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.551 ' HA2' ' CG ' ' A' ' 22' ' ' LYS . . . -63.96 -29.65 75.45 Favored Glycine 0 N--CA 1.48 1.578 1 O-C-N 133.469 6.73 . . . . 0.0 111.968 -179.941 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.447 ' CD1' HD21 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -80.05 -43.25 22.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-O 125.935 2.779 . . . . 0.0 109.945 179.716 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.568 ' C ' HG22 ' A' ' 26' ' ' ILE . 19.5 mtt -55.66 -42.95 75.8 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 113.812 -1.54 . . . . 0.0 113.685 -179.579 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.551 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.36 -20.38 59.02 Favored 'General case' 0 C--O 1.213 -0.827 1 O-C-N 129.828 4.455 . . . . 0.0 114.768 179.131 . . . . . . . . 4 4 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -65.44 -42.46 92.4 Favored 'General case' 0 C--O 1.212 -0.897 1 O-C-N 132.304 6.003 . . . . 0.0 113.314 -179.979 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.744 HD12 ' O ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -89.12 -10.62 46.62 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 108.897 -3.774 . . . . 0.0 106.656 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 66.52 72.71 0.37 Allowed 'General case' 0 N--CA 1.436 -1.14 0 C-N-CA 129.805 3.242 . . . . 0.0 112.973 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.568 HG22 ' C ' ' A' ' 21' ' ' MET . 8.2 tp -107.48 13.62 8.32 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-O 128.475 3.988 . . . . 0.0 109.456 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -50.25 100.38 0.02 OUTLIER 'General case' 0 C--N 1.357 0.915 0 CA-C-N 109.696 -3.411 . . . . 0.0 111.148 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -144.12 24.67 1.62 Allowed 'General case' 0 CA--C 1.501 -0.907 0 O-C-N 126.604 2.44 . . . . 0.0 112.263 179.71 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.38 49.88 8.31 Favored 'General case' 0 C--O 1.201 -1.481 0 O-C-N 126.966 2.666 . . . . 0.0 110.018 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.57 -26.77 13.72 Favored 'General case' 0 N--CA 1.48 1.032 2 CA-C-N 105.782 -5.19 . . . . 0.0 110.307 -179.855 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -166.99 0.46 Allowed 'General case' 0 C--N 1.315 -0.918 1 O-C-N 129.83 4.456 . . . . 0.0 109.695 -179.763 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 90.06 -28.06 0.04 OUTLIER 'General case' 0 C--O 1.202 -1.431 1 O-C-N 130.084 4.615 . . . . 0.0 113.676 179.815 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -131.37 8.1 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 O-C-N 127.629 3.081 . . . . 0.0 110.317 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.72 37.08 2.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.102 179.657 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 66.9 t -50.04 -48.75 22.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 126.257 2.223 . . . . 0.0 109.57 179.665 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.561 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 6.8 tpp85 -141.89 144.09 33.64 Favored 'General case' 0 C--O 1.211 -0.938 2 O-C-N 129.908 4.505 . . . . 0.0 108.29 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.637 ' O ' ' N ' ' A' ' 39' ' ' GLN . 1.2 mp -89.02 96.08 10.58 Favored 'General case' 0 C--O 1.209 -1.046 2 O-C-N 132.892 6.37 . . . . 0.0 103.736 177.06 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.689 HG21 ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER 5.23 -51.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 1 O-C-N 137.34 9.15 . . . . 0.0 109.865 -177.879 . . . . . . . . 4 4 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.637 ' N ' ' O ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.72 -166.42 2.52 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 118.96 2.948 . . . . 0.0 118.96 179.658 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.579 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 17.6 m -42.26 149.08 0.17 Allowed 'General case' 0 N--CA 1.426 -1.659 1 C-N-CA 132.782 4.433 . . . . 0.0 115.359 179.293 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.499 ' HD3' ' C ' ' A' ' 41' ' ' LYS 0.289 0.1 OUTLIER -109.28 149.86 28.81 Favored 'General case' 0 N--CA 1.49 1.529 2 O-C-N 131.27 5.356 . . . . 0.0 101.421 178.185 . . . . . . . . 5 4 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.527 ' HB ' ' O ' ' A' ' 53' ' ' LYS . 2.3 mp -127.02 163.14 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 125.102 1.501 . . . . 0.0 111.534 179.342 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.496 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -132.77 143.16 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 CA-C-N 111.181 -2.736 . . . . 0.0 109.568 179.615 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.265 86.9 t -151.77 118.12 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 116.612 -2.035 . . . . 0.0 111.286 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.504 ' HG2' ' CD1' ' A' ' 50' ' ' PHE . 36.9 mt-30 -118.62 111.56 18.71 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -100.32 26.53 6.49 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 128.856 3.847 . . . . 0.0 111.37 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 109.51 -121.59 6.15 Favored Glycine 0 C--O 1.213 -1.156 0 O-C-N 120.844 -1.16 . . . . 0.0 115.345 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -59.69 -27.25 66.27 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 117.469 -1.692 . . . . 0.0 113.883 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -100.79 109.99 22.03 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 128.855 3.847 . . . . 0.0 110.593 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.541 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 0.5 OUTLIER -113.61 111.95 22.7 Favored 'General case' 0 C--N 1.311 -1.088 1 O-C-N 129.119 4.012 . . . . 0.0 110.78 179.9 . . . . . . . . 4 4 . 1 . 022 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -123.48 102.28 7.79 Favored 'General case' 0 C--O 1.196 -1.754 1 O-C-N 129.473 4.233 . . . . 0.0 117.8 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.518 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.3 160.71 28.64 Favored 'General case' 0 N--CA 1.473 0.676 1 O-C-N 130.256 4.722 . . . . 0.0 106.176 179.172 . . . . . . . . 4 4 . 1 . 022 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.527 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -166.16 146.56 6.38 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 179.738 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.488 ' HA ' HD12 ' A' ' 42' ' ' ILE . 9.8 t -111.64 162.91 14.68 Favored 'General case' 0 C--N 1.31 -1.131 0 O-C-N 126.707 2.504 . . . . 0.0 113.406 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.515 ' HB2' HD11 ' A' ' 42' ' ' ILE . 1.7 t-20 -106.8 -12.42 15.51 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 115.622 -2.132 . . . . 0.0 112.287 -179.764 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.484 ' HB2' HD23 ' A' ' 37' ' ' LEU . 98.8 p -23.61 120.36 0.04 OUTLIER 'General case' 0 CA--C 1.509 -0.63 1 O-C-N 131.634 5.584 . . . . 0.0 107.687 178.409 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.689 ' HB ' HG21 ' A' ' 38' ' ' THR . 0.6 OUTLIER -51.31 -31.3 21.09 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 128.031 3.332 . . . . 0.0 107.472 179.816 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.5 ' CG ' ' HG ' ' A' ' 37' ' ' LEU . 13.6 m-85 -57.09 -73.45 0.07 Allowed 'General case' 0 C--N 1.351 0.658 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 179.931 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.406 ' NH1' HD21 ' A' ' 37' ' ' LEU . 0.6 OUTLIER -155.78 129.93 8.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 113.415 -1.721 . . . . 0.0 111.084 -179.655 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -105.53 54.75 0.7 Allowed 'General case' 0 C--O 1.211 -0.942 0 O-C-N 127.82 3.2 . . . . 0.0 111.992 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -75.02 73.93 2.2 Favored 'General case' 0 N--CA 1.47 0.556 1 O-C-N 129.766 4.416 . . . . 0.0 106.85 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.435 ' HA ' ' HA ' ' A' ' 53' ' ' LYS . 5.0 p30 -45.54 114.22 0.72 Allowed 'General case' 0 C--O 1.202 -1.412 0 O-C-N 128.379 3.549 . . . . 0.0 116.05 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.568 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 4.0 tp -65.86 79.69 0.08 Allowed 'General case' 0 C--O 1.214 -0.791 1 O-C-N 129.65 4.344 . . . . 0.0 110.579 179.32 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.413 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 5.7 m-20 -111.01 96.95 6.46 Favored 'General case' 0 CA--C 1.486 -1.483 0 C-N-CA 115.917 -2.313 . . . . 0.0 113.568 -178.348 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.568 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -130.12 -176.05 3.82 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 125.875 2.75 . . . . 0.0 106.5 178.665 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.645 HG22 HG23 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -137.33 156.01 48.74 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.421 ' HA ' ' CG1' ' A' ' 87' ' ' VAL . 20.5 t -64.5 149.26 11.24 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.203 0 O-C-N 128.923 3.889 . . . . 0.0 115.515 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 32.53 31.93 0.01 OUTLIER Glycine 0 N--CA 1.468 0.803 1 O-C-N 130.445 4.841 . . . . 0.0 117.359 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.645 HG23 HG22 ' A' ' 66' ' ' THR . 0.9 OUTLIER -91.14 -16.38 8.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.609 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 68.03 90.91 0.09 Allowed 'General case' 0 C--N 1.355 0.816 1 O-C-N 129.121 4.013 . . . . 0.0 109.787 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.522 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.1 OUTLIER -80.46 82.22 6.54 Favored 'General case' 0 CA--C 1.494 -1.194 0 O-C-N 127.13 2.769 . . . . 0.0 114.882 179.834 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.04 88.58 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 113.618 -1.628 . . . . 0.0 111.33 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.467 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 60.8 161.76 0.06 Allowed 'General case' 0 C--O 1.209 -1.055 0 C-N-CA 126.638 1.975 . . . . 0.0 112.821 179.994 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 149.8 73.58 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 128.387 3.554 . . . . 0.0 113.983 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.295 0.8 OUTLIER -132.3 97.27 4.07 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 116.072 -1.918 . . . . 0.0 109.504 179.931 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -151.01 124.62 9.03 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 128.684 3.74 . . . . 0.0 111.776 179.396 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.44 -41.09 1.89 Allowed Glycine 0 C--O 1.216 -1.027 0 CA-C-N 109.717 -3.401 . . . . 0.0 112.889 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.744 ' O ' HD12 ' A' ' 24' ' ' LEU . 6.1 tp -106.01 -9.45 17.05 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 129.619 3.776 . . . . 0.0 114.629 -179.851 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.527 ' OD2' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -149.18 -62.74 0.23 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.824 -179.85 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.75 52.18 3.59 Favored Glycine 0 C--O 1.214 -1.132 0 CA-C-O 126.442 3.246 . . . . 0.0 112.611 -179.91 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.98 -156.86 0.71 Allowed 'General case' 0 C--N 1.354 0.792 0 CA-C-N 110.616 -2.792 . . . . 0.0 113.847 -179.773 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.467 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -151.92 109.58 3.63 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.805 1.288 . . . . 0.0 107.88 178.265 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.859 HG11 ' HB3' ' A' ' 98' ' ' GLN . 72.6 t -140.48 127.78 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.524 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -176.811 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -59.79 88.28 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 112.467 -2.152 . . . . 0.0 109.608 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.522 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 52.5 m -85.88 67.22 9.95 Favored 'General case' 0 C--O 1.196 -1.711 0 O-C-N 128.504 3.628 . . . . 0.0 116.214 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.476 HD21 ' OG1' ' A' ' 88' ' ' THR . 1.2 tt -58.59 146.97 34.01 Favored 'General case' 0 C--O 1.211 -0.925 1 CA-C-N 107.713 -4.312 . . . . 0.0 115.73 -179.744 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.464 ' N ' ' HG ' ' A' ' 86' ' ' LEU . 59.7 t -130.54 132.4 64.55 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.29 0 C-N-CA 127.499 2.32 . . . . 0.0 107.268 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.672 HG22 ' H ' ' A' ' 89' ' ' TRP 0.358 27.8 m -142.57 -156.62 0.7 Allowed 'General case' 0 CA--C 1.48 -1.729 0 CA-C-N 112.698 -2.046 . . . . 0.0 105.698 -179.554 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.705 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.279 10.9 m95 -154.18 143.51 21.38 Favored 'General case' 0 CA--C 1.51 -0.595 0 O-C-N 118.349 -2.72 . . . . 0.0 105.492 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -111.21 -146.38 0.41 Allowed 'General case' 0 CA--C 1.483 -1.605 0 O-C-N 126.583 2.427 . . . . 0.0 111.268 179.39 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -74.28 -30.93 59.92 Favored Glycine 0 N--CA 1.487 2.072 1 N-CA-C 101.144 -4.782 . . . . 0.0 101.144 179.741 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.29 69.3 0.18 Allowed 'General case' 0 C--O 1.197 -1.695 1 O-C-N 133.2 5.883 . . . . 0.0 111.625 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.645 ' O ' ' N ' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.94 133.09 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 119.395 3.109 . . . . 0.0 119.395 178.049 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.954 HD21 ' HG2' ' A' ' 109' ' ' GLN . 0.5 OUTLIER -61.06 10.84 0.02 OUTLIER 'General case' 0 CA--C 1.478 -1.807 0 N-CA-C 120.246 3.424 . . . . 0.0 120.246 -178.293 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.0 t 3.92 114.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.482 -1.656 0 N-CA-C 119.318 3.081 . . . . 0.0 119.318 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.432 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 7.0 p -132.94 140.39 47.81 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 124.847 2.26 . . . . 0.0 108.313 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.421 ' O ' ' N ' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -135.32 80.75 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 CA-C-N 110.013 -3.267 . . . . 0.0 116.533 179.794 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.859 ' HB3' HG11 ' A' ' 83' ' ' VAL . 10.8 mt-30 -50.21 93.8 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 123.937 1.827 . . . . 0.0 108.358 -179.942 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.574 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -88.98 106.7 18.6 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 109.258 -3.61 . . . . 0.0 111.395 -179.767 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.434 ' CA ' HG22 ' A' ' 83' ' ' VAL . . . -105.57 -83.98 1.7 Allowed Glycine 0 C--O 1.197 -2.188 1 CA-C-O 127.9 4.056 . . . . 0.0 110.141 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -176.4 -54.2 0.01 OUTLIER 'General case' 0 C--N 1.355 0.819 1 CA-C-N 107.051 -4.575 . . . . 0.0 112.765 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -87.25 -52.62 5.29 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 125.971 2.796 . . . . 0.0 115.666 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -102.28 158.76 15.96 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 110.362 -3.108 . . . . 0.0 116.424 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -117.2 85.08 2.26 Favored 'General case' 0 N--CA 1.49 1.565 1 CA-C-N 107.309 -4.496 . . . . 0.0 102.158 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.488 ' HB3' ' CZ ' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -79.13 7.4 7.57 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 126.366 2.291 . . . . 0.0 115.921 -179.188 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 120' ' ' LEU . . . -49.75 131.62 27.27 Favored Glycine 0 C--O 1.204 -1.756 1 O-C-N 129.372 4.17 . . . . 0.0 110.582 179.25 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.551 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE . 6.5 p90 -117.17 8.78 13.34 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 129.723 3.837 . . . . 0.0 119.387 -179.593 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -28.47 142.81 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 1 CA-C-N 108.26 -4.064 . . . . 0.0 112.757 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.954 ' HG2' HD21 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -123.16 148.65 45.52 Favored 'General case' 0 C--N 1.362 1.127 0 CA-C-O 113.709 -3.043 . . . . 0.0 108.954 179.876 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -145.64 84.6 1.68 Allowed 'General case' 0 C--N 1.303 -1.44 1 O-C-N 132.097 5.873 . . . . 0.0 115.066 179.59 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.468 ' O ' HG12 ' A' ' 111' ' ' VAL . 18.5 t -22.75 104.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.491 -1.311 0 C-N-CA 126.671 1.988 . . . . 0.0 115.802 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -134.85 153.77 51.91 Favored 'General case' 0 CA--C 1.481 -1.678 0 CA-C-N 111.137 -2.756 . . . . 0.0 118.183 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 50.29 -93.14 0.01 OUTLIER Glycine 0 C--O 1.198 -2.1 0 CA-C-O 123.599 1.666 . . . . 0.0 113.813 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -147.63 31.86 0.88 Allowed 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.18 -169.23 2.86 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 128.164 3.415 . . . . 0.0 111.189 -179.611 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' A' ' 116' ' ' LEU . 37.1 tp -128.62 88.06 2.68 Favored 'General case' 0 C--O 1.201 -1.493 0 CA-C-O 127.226 3.393 . . . . 0.0 111.435 179.795 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -44.86 97.11 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.731 1 CA-C-N 107.823 -4.262 . . . . 0.0 117.383 -179.177 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.408 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -78.87 120.63 23.76 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 113.545 -3.121 . . . . 0.0 105.403 178.26 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -134.13 85.63 2.21 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 126.923 2.639 . . . . 0.0 106.682 -178.825 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 106' ' ' GLY . 0.1 OUTLIER -98.48 148.04 24.14 Favored 'General case' 0 CA--C 1.483 -1.61 1 O-C-N 129.757 4.41 . . . . 0.0 108.857 -179.956 . . . . . . . . 4 4 . 1 . 022 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -110.09 160.54 16.37 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 111.429 -2.623 . . . . 0.0 105.135 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.603 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -159.96 47.24 0.26 Allowed 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 125.899 2.761 . . . . 0.0 112.275 179.845 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.13 -98.33 1.96 Allowed Glycine 0 N--CA 1.438 -1.195 0 CA-C-N 111.739 -2.482 . . . . 0.0 110.709 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -83.61 -29.61 27.6 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 109.305 -3.448 . . . . 0.0 111.026 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -103.15 160.45 14.64 Favored 'General case' 0 C--O 1.207 -1.174 0 O-C-N 127.531 3.02 . . . . 0.0 109.75 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.57 101.14 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.5 -0.97 1 CA-C-N 108.303 -4.044 . . . . 0.0 112.327 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.2 m -79.67 149.7 31.16 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 113.307 -1.769 . . . . 0.0 109.726 179.789 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -140.58 76.14 1.54 Allowed 'General case' 0 N--CA 1.476 0.866 0 O-C-N 127.74 3.15 . . . . 0.0 110.491 179.953 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.86 176.1 0.58 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 117.747 -1.581 . . . . 0.0 114.501 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.259 83.9 t -149.64 87.55 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.563 0 CA-C-O 125.037 2.351 . . . . 0.0 105.624 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 3.4 m-85 -70.57 -178.67 1.86 Allowed 'General case' 0 CA--C 1.486 -1.496 0 CA-C-N 109.015 -3.72 . . . . 0.0 117.625 -179.991 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 10' ' ' GLU . 0.8 OUTLIER -163.96 117.01 1.43 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 111.461 -2.609 . . . . 0.0 108.067 -179.907 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.648 ' HD3' ' C ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -56.14 49.85 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 119.918 3.303 . . . . 0.0 119.918 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.424 ' CB ' ' O ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.788 0 CA-C-O 113.062 -3.351 . . . . 0.0 118.352 -178.697 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm . . . . . 0 N--CA 1.441 -0.879 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -96.82 84.45 3.6 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 116.577 -1.678 . . . . 0.0 107.284 -179.853 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.438 ' HG3' HG11 ' A' ' 111' ' ' VAL . 1.3 tm0? -117.79 145.85 44.24 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 103.85 -2.648 . . . . 0.0 103.85 -179.893 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -154.54 149.35 26.61 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 129.43 3.092 . . . . 0.0 110.933 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.64 -173.56 44.09 Favored Glycine 0 C--O 1.21 -1.349 0 CA-C-O 116.15 -2.472 . . . . 0.0 110.722 179.788 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.687 HG22 ' HG2' ' A' ' 134' ' ' LYS . 5.6 t -139.29 22.2 2.57 Favored 'General case' 0 C--O 1.208 -1.114 0 O-C-N 129.859 3.917 . . . . 0.0 109.83 179.858 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.628 ' HB2' ' CD1' ' A' ' 131' ' ' PHE 0.291 0.0 OUTLIER -23.66 124.45 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.443 1 O-C-N 133.768 6.917 . . . . 0.0 112.081 179.552 . . . . . . . . 5 4 . 1 . 023 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -74.09 -3.21 28.11 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -179.172 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.516 ' HG3' HG21 ' A' ' 130' ' ' VAL 0.313 1.0 OUTLIER 49.59 35.97 9.56 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 114.074 -2.87 . . . . 0.0 103.269 179.707 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.484 ' HB2' ' HB2' ' A' ' 132' ' ' LYS . 4.8 tt0 -26.77 -46.92 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.256 2 O-C-N 132.542 6.152 . . . . 0.0 113.919 -178.876 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.689 ' O ' HG12 ' A' ' 130' ' ' VAL . 3.2 t -121.72 -152.22 0.5 Allowed 'General case' 0 C--O 1.245 0.817 0 C-N-CA 117.894 -1.522 . . . . 0.0 112.312 -178.522 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.802 ' HB2' HG12 ' A' ' 130' ' ' VAL . 2.4 t-20 157.34 136.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 O-C-N 125.371 1.669 . . . . 0.0 111.797 179.437 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.573 ' HB2' ' HB3' ' A' ' 128' ' ' ARG . 8.5 mm-40 -91.71 -70.16 0.7 Allowed 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 127.795 3.184 . . . . 0.0 108.16 179.505 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -96.15 157.74 15.76 Favored 'General case' 0 C--O 1.202 -1.413 0 O-C-N 120.812 -1.18 . . . . 0.0 112.872 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -149.01 -48.39 0.15 Allowed 'General case' 0 C--O 1.22 -0.49 0 O-C-N 125.257 1.598 . . . . 0.0 111.284 -179.942 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.474 ' CG ' ' HB2' ' A' ' 31' ' ' ARG . 1.3 mt-10 -67.58 -45.69 74.83 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 111.924 -2.398 . . . . 0.0 115.848 179.782 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.23 -22.92 65.76 Favored Glycine 0 N--CA 1.483 1.77 0 O-C-N 129.1 4.0 . . . . 0.0 111.345 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.524 ' CD1' HD21 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -78.78 -43.67 24.96 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-O 124.962 2.315 . . . . 0.0 107.666 179.992 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 17.8 mtt -66.42 -33.08 74.9 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.69 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -73.4 -25.54 60.59 Favored 'General case' 0 C--O 1.214 -0.773 0 O-C-N 128.053 3.346 . . . . 0.0 114.436 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.34 -52.49 32.77 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.968 3.918 . . . . 0.0 111.029 179.923 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.524 HD21 ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -86.18 -6.39 59.0 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 110.056 -3.247 . . . . 0.0 108.633 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 39.64 73.91 0.11 Allowed 'General case' 0 CA--C 1.484 -1.566 0 O-C-N 127.653 3.095 . . . . 0.0 108.115 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.643 ' CD1' HD12 ' A' ' 78' ' ' LEU . 10.8 tt -65.68 -26.34 38.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.029 1 CA-C-N 108.191 -4.095 . . . . 0.0 109.069 -179.964 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.447 ' OD1' HG23 ' A' ' 26' ' ' ILE . 21.9 p-10 145.97 134.58 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 111.277 -2.692 . . . . 0.0 109.208 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.442 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.3 OUTLIER -94.45 87.61 5.22 Favored 'General case' 0 N--CA 1.483 1.182 1 O-C-N 129.913 4.508 . . . . 0.0 108.477 179.358 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 28' ' ' PHE . . . 150.31 65.84 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 1 O-C-N 129.493 4.246 . . . . 0.0 104.229 -179.363 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.557 ' O ' HG22 ' A' ' 30' ' ' THR . 2.8 m 142.28 66.58 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.247 2 O-C-N 132.815 6.322 . . . . 0.0 109.009 -179.894 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HB2' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -138.08 -56.24 0.66 Allowed 'General case' 0 N--CA 1.447 -0.61 2 O-C-N 130.254 4.721 . . . . 0.0 108.987 -179.711 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.567 ' C ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -88.44 1.27 55.11 Favored 'General case' 0 C--O 1.205 -1.255 0 O-C-N 127.156 2.785 . . . . 0.0 113.715 179.886 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.657 ' N ' HD12 ' A' ' 33' ' ' ILE . 1.7 mp -108.23 -47.63 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 2 O-C-N 129.394 4.184 . . . . 0.0 114.681 -179.621 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.476 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -54.73 -44.42 73.53 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 122.491 1.139 . . . . 0.0 113.214 179.807 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.421 HG12 ' N ' ' A' ' 36' ' ' ARG . 78.4 t 25.81 -74.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.204 -1.342 0 CA-C-N 110.388 -3.096 . . . . 0.0 115.123 -179.806 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 34' ' ' ALA . 2.8 tmm_? -176.3 100.56 0.06 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.683 -1.599 . . . . 0.0 111.012 179.856 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.646 HD23 ' CE2' ' A' ' 58' ' ' PHE . 0.8 OUTLIER -94.84 -0.6 53.94 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 129.05 3.969 . . . . 0.0 110.59 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.524 ' N ' HD12 ' A' ' 37' ' ' LEU . 16.6 m 133.84 88.33 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.752 1 O-C-N 132.964 6.415 . . . . 0.0 111.503 -179.662 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.468 ' HG3' ' HG2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -88.25 -179.05 6.06 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 116.288 -2.165 . . . . 0.0 115.581 -179.584 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.6 m -178.6 137.39 0.16 Allowed 'General case' 0 N--CA 1.431 -1.384 1 O-C-N 129.913 4.508 . . . . 0.0 112.498 179.583 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.586 ' HD2' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -122.54 157.13 32.73 Favored 'General case' 0 N--CA 1.489 1.494 1 O-C-N 129.321 4.138 . . . . 0.0 102.523 179.694 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.51 ' N ' ' O ' ' A' ' 53' ' ' LYS . 6.7 mt -149.82 104.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.433 0 O-C-N 127.547 3.03 . . . . 0.0 112.287 -178.76 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.403 ' CD1' ' CE1' ' A' ' 50' ' ' PHE 0.258 0.1 OUTLIER -83.39 135.4 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 2 CA-C-N 106.444 -4.889 . . . . 0.0 110.525 -179.855 . . . . . . . . 5 4 . 1 . 023 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -143.95 96.58 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 CA-C-N 111.77 -2.468 . . . . 0.0 116.419 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.479 ' HG2' ' HB2' ' A' ' 50' ' ' PHE . 36.5 mt-30 -94.84 126.73 40.35 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.154 179.211 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -132.83 31.85 3.88 Favored 'General case' 0 CA--C 1.49 -1.328 1 O-C-N 130.373 4.795 . . . . 0.0 111.99 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.85 120.36 0.66 Allowed Glycine 0 C--O 1.204 -1.764 0 O-C-N 126.061 2.101 . . . . 0.0 112.685 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 70.43 -69.69 0.17 Allowed 'General case' 0 C--O 1.212 -0.869 0 CA-C-O 116.683 -1.627 . . . . 0.0 112.015 179.854 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.2 m-20 -95.91 114.14 25.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 128.074 3.359 . . . . 0.0 111.493 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.622 ' CD2' HD13 ' A' ' 94' ' ' LEU . 3.0 t80 -115.39 139.98 49.53 Favored 'General case' 0 CA--C 1.489 -1.385 1 O-C-N 129.52 4.262 . . . . 0.0 114.968 -179.806 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.522 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 67.5 mttt -144.86 102.19 3.75 Favored 'General case' 0 CA--C 1.489 -1.378 0 N-CA-C 118.952 2.945 . . . . 0.0 118.952 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.775 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.29 160.96 28.35 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 128.652 3.72 . . . . 0.0 105.67 178.449 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 42' ' ' ILE 0.25 0.0 OUTLIER -158.03 127.4 5.82 Favored 'General case' 0 CA--C 1.482 -1.669 1 O-C-N 130.449 4.843 . . . . 0.0 112.08 -175.681 . . . . . . . . 5 4 . 1 . 023 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.408 HG22 ' N ' ' A' ' 61' ' ' TYR 0.283 0.4 OUTLIER -94.88 147.65 23.14 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 124.277 1.989 . . . . 0.0 112.853 179.708 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -132.36 59.33 1.72 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 110.282 -3.145 . . . . 0.0 116.958 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 m -93.85 -176.39 4.02 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 130.695 3.598 . . . . 0.0 106.214 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.501 ' HB ' HD21 ' A' ' 37' ' ' LEU . 92.2 m -113.27 -50.39 2.87 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 128.902 3.876 . . . . 0.0 107.659 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.646 ' CE2' HD23 ' A' ' 37' ' ' LEU . 9.0 m-85 -50.06 -57.36 7.79 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 128.579 3.675 . . . . 0.0 110.368 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -154.34 105.82 2.71 Favored 'General case' 0 C--O 1.213 -0.836 1 O-C-N 130.812 5.07 . . . . 0.0 114.112 -179.729 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -86.63 80.84 8.45 Favored 'General case' 0 C--O 1.205 -1.276 1 O-C-N 130.563 4.915 . . . . 0.0 112.066 -179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.408 ' N ' HG22 ' A' ' 54' ' ' THR . 5.5 t80 -68.06 166.86 15.11 Favored 'General case' 0 C--O 1.219 -0.521 0 O-C-N 128.79 3.806 . . . . 0.0 107.174 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -140.2 89.37 2.29 Favored 'General case' 0 C--O 1.207 -1.145 1 O-C-N 129.819 4.45 . . . . 0.0 113.014 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.775 ' HB2' HG22 ' A' ' 52' ' ' THR . 4.6 tp -72.85 64.35 0.67 Allowed 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.62 -1.627 . . . . 0.0 112.4 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.516 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 2.9 t0 -95.5 104.9 16.82 Favored 'General case' 0 C--O 1.21 -0.983 0 CA-C-N 112.636 -2.075 . . . . 0.0 105.551 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.506 ' HB3' HG21 ' A' ' 87' ' ' VAL . 9.6 m-85 -123.03 -178.48 3.97 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.354 2.262 . . . . 0.0 110.716 179.824 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.458 ' CG2' HG23 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -150.68 133.3 15.73 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 179.34 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.56 HG21 ' HE1' ' A' ' 89' ' ' TRP . 54.8 t -52.75 137.77 12.36 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 O-C-N 126.994 2.684 . . . . 0.0 114.973 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 33.12 45.23 0.26 Allowed Glycine 0 N--CA 1.468 0.831 1 O-C-N 130.969 5.168 . . . . 0.0 117.363 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.458 HG23 ' CG2' ' A' ' 66' ' ' THR 0.319 0.4 OUTLIER -88.72 -14.04 9.58 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.62 179.928 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 65.41 71.33 0.44 Allowed 'General case' 0 C--N 1.364 1.235 1 O-C-N 129.568 4.293 . . . . 0.0 109.547 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -65.46 72.22 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.86 2 O-C-N 130.835 5.085 . . . . 0.0 112.763 -179.805 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.43 101.72 0.05 OUTLIER 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 113.127 -1.851 . . . . 0.0 115.427 179.784 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.488 ' HG3' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 63.07 -164.26 0.26 Allowed 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 123.694 1.712 . . . . 0.0 113.224 179.328 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 75.28 88.23 0.09 Allowed 'General case' 0 C--O 1.203 -1.378 0 CA-C-N 109.086 -3.688 . . . . 0.0 113.411 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.26 72.8 p -116.67 -8.38 11.45 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 111.132 -2.758 . . . . 0.0 116.1 -179.74 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.36 151.67 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.925 1 O-C-N 129.214 4.071 . . . . 0.0 116.411 -179.684 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.19 -55.04 4.93 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 110.165 -3.198 . . . . 0.0 113.565 179.712 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.643 HD12 ' CD1' ' A' ' 26' ' ' ILE . 12.9 tp -80.93 -47.88 13.09 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.017 2.834 . . . . 0.0 113.158 179.911 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -112.56 -58.97 2.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 125.772 2.701 . . . . 0.0 112.142 179.847 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.59 49.6 5.69 Favored Glycine 0 C--O 1.207 -1.593 0 CA-C-N 111.748 -2.478 . . . . 0.0 111.968 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.44 ' CG ' ' N ' ' A' ' 82' ' ' ASN . 2.0 ttm-85 -121.04 -104.58 0.39 Allowed 'General case' 0 C--N 1.366 1.315 0 CA-C-N 109.968 -3.116 . . . . 0.0 114.644 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.488 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 6.5 m-20 156.02 103.31 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.836 0 O-C-N 125.729 1.893 . . . . 0.0 108.341 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.579 HG13 ' HA3' ' A' ' 100' ' ' GLY . 1.5 t -153.72 145.31 14.47 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.372 0 O-C-N 126.852 2.595 . . . . 0.0 117.267 -179.332 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -56.17 161.24 2.53 Favored 'General case' 0 C--O 1.235 0.335 1 O-C-N 129.455 4.222 . . . . 0.0 106.87 178.791 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.2 m -161.28 95.23 1.02 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-O 126.389 2.995 . . . . 0.0 110.77 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tp -101.7 111.76 24.12 Favored 'General case' 0 N--CA 1.429 -1.483 1 CA-C-N 108.106 -4.134 . . . . 0.0 116.993 -179.176 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.506 HG21 ' HB3' ' A' ' 65' ' ' PHE . 81.0 t -82.5 144.48 10.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 179.272 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.423 ' CG2' ' N ' ' A' ' 89' ' ' TRP 0.315 1.1 m -162.17 168.75 21.97 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-O 126.734 3.159 . . . . 0.0 110.732 -179.774 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.729 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 56.4 m95 -98.17 139.4 34.02 Favored 'General case' 0 C--N 1.361 1.078 0 CA-C-O 114.755 -2.545 . . . . 0.0 106.658 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.667 ' HB2' HG22 ' A' ' 93' ' ' THR . 0.0 OUTLIER -85.53 -49.49 8.01 Favored 'General case' 0 CA--C 1.483 -1.609 1 CA-C-O 132.231 5.777 . . . . 0.0 112.41 179.797 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -170.56 -56.4 0.04 OUTLIER Glycine 0 C--O 1.213 -1.189 1 CA-C-N 108.119 -4.128 . . . . 0.0 103.285 -179.763 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -141.38 49.37 1.63 Allowed 'General case' 0 N--CA 1.444 -0.731 1 O-C-N 131.949 5.147 . . . . 0.0 109.694 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.667 HG22 ' HB2' ' A' ' 90' ' ' GLU . 1.1 t -176.45 155.99 1.48 Allowed 'General case' 0 C--O 1.203 -1.385 0 N-CA-C 118.063 2.616 . . . . 0.0 118.063 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.622 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -85.6 98.83 10.87 Favored 'General case' 0 CA--C 1.487 -1.47 0 O-C-N 127.907 3.254 . . . . 0.0 115.168 -179.798 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.497 HG13 ' HE2' ' A' ' 108' ' ' LYS . 49.9 t -99.68 120.96 49.78 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.377 0 CA-C-N 110.897 -2.865 . . . . 0.0 114.017 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.588 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 12.1 m -132.5 134.26 44.8 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 103.373 -2.825 . . . . 0.0 103.373 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -120.1 116.3 49.96 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 108.715 -3.857 . . . . 0.0 119.268 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.99 109.26 19.69 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-N 112.459 -2.155 . . . . 0.0 107.436 179.556 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.12 116.18 27.98 Favored 'General case' 0 C--O 1.195 -1.773 0 O-C-N 128.05 3.344 . . . . 0.0 113.619 -179.017 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.579 ' HA3' HG13 ' A' ' 83' ' ' VAL . . . 172.41 176.5 41.19 Favored Glycine 0 C--O 1.199 -2.062 0 CA-C-N 113.172 -1.831 . . . . 0.0 112.402 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.404 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 4.5 tt0 3.45 -61.15 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.275 2 O-C-N 130.996 4.586 . . . . 0.0 114.537 179.645 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER -149.51 -37.21 0.16 Allowed 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 179.474 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -52.19 124.39 12.98 Favored 'General case' 0 N--CA 1.441 -0.918 0 O-C-N 126.544 2.403 . . . . 0.0 116.349 -179.771 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -112.02 67.97 0.66 Allowed 'General case' 0 N--CA 1.484 1.268 2 O-C-N 130.039 4.587 . . . . 0.0 102.148 179.781 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.461 ' HD2' ' HA ' ' A' ' 105' ' ' ARG . 23.5 mmm-85 -94.84 36.73 1.17 Allowed 'General case' 0 C--O 1.203 -1.364 1 O-C-N 129.321 4.138 . . . . 0.0 110.167 179.772 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -77.58 67.82 2.81 Favored Glycine 0 N--CA 1.445 -0.759 0 O-C-N 128.297 3.498 . . . . 0.0 111.445 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.588 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -80.98 141.65 34.22 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 129.699 3.823 . . . . 0.0 110.553 179.397 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.497 ' HE2' HG13 ' A' ' 95' ' ' VAL . 3.0 ptpt -164.61 165.78 20.76 Favored 'General case' 0 N--CA 1.443 -0.786 1 O-C-N 129.265 4.103 . . . . 0.0 114.159 -178.728 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -116.28 175.27 5.63 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 109.729 -3.396 . . . . 0.0 106.415 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.471 ' C ' HG23 ' A' ' 111' ' ' VAL . 15.0 m95 -125.78 -56.24 1.48 Allowed 'General case' 0 C--N 1.306 -1.311 1 O-C-N 130.659 4.974 . . . . 0.0 116.242 179.713 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.506 ' HA ' ' HB3' ' A' ' 116' ' ' LEU . 4.9 t 78.31 44.27 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-O 127.453 3.501 . . . . 0.0 108.485 -176.06 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.603 ' HG3' ' CZ ' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -103.07 129.88 50.03 Favored 'General case' 0 CA--C 1.477 -1.841 1 CA-C-N 107.081 -4.6 . . . . 0.0 110.823 -178.388 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 113' ' ' GLY . . . . . 0.423 ' O ' ' NZ ' ' A' ' 115' ' ' LYS . . . 48.14 67.42 1.61 Allowed Glycine 0 C--O 1.194 -2.352 0 C-N-CA 125.026 1.298 . . . . 0.0 115.711 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 72.67 -43.4 0.56 Allowed 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 129.027 2.931 . . . . 0.0 118.679 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.513 ' HG3' ' CD1' ' A' ' 117' ' ' TYR . 4.6 ptpp? -100.78 -174.91 2.74 Favored 'General case' 0 C--N 1.312 -1.062 0 O-C-N 128.831 3.832 . . . . 0.0 108.064 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.638 HD12 ' CG ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -138.09 62.24 1.57 Allowed 'General case' 0 C--O 1.194 -1.838 0 O-C-N 126.914 2.634 . . . . 0.0 108.672 178.928 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.776 ' HB3' ' HB3' ' A' ' 129' ' ' GLN . 0.0 OUTLIER -32.27 131.81 0.14 Allowed 'General case' 0 C--N 1.365 1.258 1 O-C-N 130.521 4.888 . . . . 0.0 116.005 -177.093 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.631 ' HB2' ' CE2' ' A' ' 131' ' ' PHE . 0.7 OUTLIER -87.83 65.84 8.53 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 128.661 3.726 . . . . 0.0 111.628 -178.87 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -77.8 122.5 25.5 Favored 'General case' 0 CA--C 1.485 -1.541 0 O-C-N 127.692 3.12 . . . . 0.0 108.014 -179.629 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 121' ' ' THR . 0.9 OUTLIER -146.15 -179.79 6.97 Favored 'General case' 0 CA--C 1.486 -1.512 0 C-N-CA 117.213 -1.795 . . . . 0.0 114.092 -179.791 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.479 ' O ' HD12 ' A' ' 120' ' ' LEU . 44.8 m -128.36 160.89 30.8 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . 0.263 0.3 OUTLIER -173.6 107.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.953 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 12.12 76.9 0.01 OUTLIER Glycine 0 C--O 1.218 -0.849 1 O-C-N 129.896 4.498 . . . . 0.0 114.725 179.593 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 38.9 m-20 101.15 -53.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.391 0 O-C-N 129.048 3.44 . . . . 0.0 111.032 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -77.35 171.06 15.45 Favored 'General case' 0 C--O 1.2 -1.543 1 O-C-N 130.611 4.944 . . . . 0.0 110.323 -179.8 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.1 m -145.17 102.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 1 CA-C-N 107.28 -4.509 . . . . 0.0 111.31 179.454 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.45 175.18 1.43 Allowed 'General case' 0 CA--C 1.494 -1.208 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 -179.625 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 128' ' ' ARG . . . . . 0.573 ' HB3' ' HB2' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -142.04 64.63 1.38 Allowed 'General case' 0 C--N 1.346 0.446 0 C-N-CA 114.165 -3.014 . . . . 0.0 116.679 179.647 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.776 ' HB3' ' HB3' ' A' ' 117' ' ' TYR . 8.9 mt-30 57.24 -169.09 0.11 Allowed 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 120.815 3.635 . . . . 0.0 120.815 175.616 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 14' ' ' ASN 0.256 1.5 m -173.5 -46.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 O-C-N 126.568 2.418 . . . . 0.0 113.448 -178.775 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.638 ' CG ' HD12 ' A' ' 116' ' ' LEU . 43.7 m-85 -29.94 158.94 0.0 OUTLIER 'General case' 0 CA--C 1.477 -1.853 0 N-CA-C 120.929 3.677 . . . . 0.0 120.929 -174.913 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 12' ' ' GLU 0.338 0.0 OUTLIER -169.46 108.67 0.42 Allowed 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 108.729 -3.85 . . . . 0.0 104.964 -178.86 . . . . . . . . 4 4 . 1 . 023 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.497 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 31.6 ttpt -64.93 73.01 0.04 OUTLIER 'General case' 0 CA--C 1.478 -1.79 0 C-N-CA 117.717 -1.593 . . . . 0.0 113.7 -179.331 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.687 ' HG2' HG22 ' A' ' 8' ' ' THR . 14.9 mttt . . . . . 0 CA--C 1.496 -1.119 0 O-C-N 119.981 -1.699 . . . . 0.0 114.782 179.812 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.493 -1.22 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.68 -173.73 0.8 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.87 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -122.39 -144.2 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 104.368 -2.456 . . . . 0.0 104.368 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.47 131.72 12.8 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 128.317 2.647 . . . . 0.0 110.713 179.713 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 178.16 -119.43 0.67 Allowed Glycine 0 C--O 1.22 -0.758 0 C-N-CA 115.832 -3.08 . . . . 0.0 115.864 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.446 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -179.75 151.07 0.42 Allowed 'General case' 0 C--O 1.211 -0.926 1 O-C-N 133.457 6.034 . . . . 0.0 105.441 -178.85 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.553 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -145.12 114.14 6.94 Favored 'General case' 0 CA--C 1.495 -1.153 1 O-C-N 129.298 4.124 . . . . 0.0 116.117 -179.446 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.413 ' HA ' ' HA ' ' A' ' 40' ' ' THR . 0.8 OUTLIER -82.61 95.08 7.67 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 114.846 -2.742 . . . . 0.0 106.94 179.643 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.509 ' HB3' ' HG2' ' A' ' 39' ' ' GLN . 32.5 ttm -28.28 -46.54 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 O-C-N 128.351 3.532 . . . . 0.0 107.148 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 93.35 -63.34 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.728 1 O-C-N 129.301 4.125 . . . . 0.0 111.729 179.291 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.98 -178.53 4.93 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 108.901 -3.772 . . . . 0.0 111.416 -179.568 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.475 ' ND2' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -165.5 154.94 12.43 Favored 'General case' 0 C--O 1.2 -1.51 0 O-C-N 126.289 2.243 . . . . 0.0 115.799 179.975 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.501 ' HG3' ' N ' ' A' ' 16' ' ' ASN . 3.1 tt0 -125.7 145.48 50.16 Favored 'General case' 0 N--CA 1.476 0.854 2 O-C-N 132.825 6.328 . . . . 0.0 110.738 -179.986 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.501 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 53.3 t30 36.82 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.138 0 CA-C-O 124.252 1.977 . . . . 0.0 115.744 -179.713 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -112.43 -39.5 4.37 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 111.636 -2.529 . . . . 0.0 109.562 -179.933 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -75.17 -35.02 61.62 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.956 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.02 -27.15 58.81 Favored Glycine 0 C--N 1.351 1.379 0 O-C-N 128.909 3.881 . . . . 0.0 107.028 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.497 ' CE1' HD11 ' A' ' 120' ' ' LEU . 2.1 t80 -72.31 -29.6 64.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 123.483 1.611 . . . . 0.0 108.576 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.432 ' HG2' HG21 ' A' ' 26' ' ' ILE . 9.8 mtt -77.76 -25.31 49.06 Favored 'General case' 0 CA--C 1.494 -1.208 0 C-N-CA 116.594 -2.042 . . . . 0.0 111.004 179.901 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -75.5 -27.01 58.6 Favored 'General case' 0 C--O 1.204 -1.304 0 O-C-N 127.799 3.187 . . . . 0.0 115.02 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.905 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -71.48 -44.93 63.82 Favored 'General case' 0 C--O 1.215 -0.718 1 O-C-N 134.461 7.351 . . . . 0.0 112.807 -179.859 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.859 HD11 ' HB ' ' A' ' 26' ' ' ILE . 2.6 pp -90.46 -6.05 55.33 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 110.24 -3.164 . . . . 0.0 108.202 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.6 t0 32.12 91.28 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 127.606 3.574 . . . . 0.0 113.01 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.859 ' HB ' HD11 ' A' ' 24' ' ' LEU . 9.9 tt -106.03 41.11 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.959 1 CA-C-N 107.472 -4.422 . . . . 0.0 111.17 179.69 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 80.47 134.54 0.06 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 109.887 -3.324 . . . . 0.0 113.323 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.454 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 43.0 m-85 -67.59 137.03 55.36 Favored 'General case' 0 CA--C 1.505 -0.751 0 O-C-N 125.626 1.829 . . . . 0.0 111.795 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 73.99 74.29 0.12 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 125.811 2.72 . . . . 0.0 109.155 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.429 ' O ' HG22 ' A' ' 30' ' ' THR . 34.1 m -140.76 40.73 1.84 Allowed 'General case' 0 N--CA 1.478 0.974 1 CA-C-N 106.85 -4.704 . . . . 0.0 110.794 179.939 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.79 -170.21 3.47 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 111.231 -2.713 . . . . 0.0 109.329 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.495 ' C ' ' CG1' ' A' ' 33' ' ' ILE . 4.6 tttp 76.38 30.69 0.65 Allowed 'General case' 0 C--N 1.314 -0.96 1 O-C-N 129.498 4.249 . . . . 0.0 112.425 -179.62 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.495 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -162.11 -55.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 2 O-C-N 129.834 4.459 . . . . 0.0 111.539 -179.959 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -87.62 50.3 1.97 Allowed 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 124.887 2.28 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.0 t -71.76 -44.21 68.78 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.578 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.186 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.907 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 160.04 132.51 0.0 OUTLIER 'General case' 0 N--CA 1.433 -1.299 1 O-C-N 130.684 4.99 . . . . 0.0 111.664 179.706 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.928 HD12 ' CG2' ' A' ' 57' ' ' THR . 0.1 OUTLIER -150.11 117.35 6.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 108.738 -3.847 . . . . 0.0 106.351 -179.981 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.426 ' HB ' ' HB ' ' A' ' 57' ' ' THR . 7.8 m 47.32 46.57 16.93 Favored 'General case' 0 CA--C 1.506 -0.742 1 O-C-N 131.096 5.247 . . . . 0.0 112.755 179.872 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.509 ' HG2' ' HB3' ' A' ' 11' ' ' MET . 0.4 OUTLIER -56.84 123.23 14.32 Favored 'General case' 0 CA--C 1.494 -1.174 0 O-C-N 125.135 1.522 . . . . 0.0 113.555 179.873 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.502 HG22 ' O ' ' A' ' 40' ' ' THR . 45.3 m -147.95 67.85 1.1 Allowed 'General case' 0 C--N 1.313 -0.994 1 O-C-N 130.114 4.634 . . . . 0.0 117.457 -179.114 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.648 ' HA ' ' CB ' ' A' ' 55' ' ' ASN . 0.1 OUTLIER -66.47 144.82 56.26 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 115.29 -2.29 . . . . 0.0 104.921 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.661 HD13 ' HB ' ' A' ' 54' ' ' THR . 2.6 mt -125.83 166.17 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 1 O-C-N 131.806 5.692 . . . . 0.0 113.263 -177.343 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.532 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.274 0.5 OUTLIER -149.85 143.37 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-N 110.829 -2.896 . . . . 0.0 112.484 179.405 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.501 HG12 ' N ' ' A' ' 45' ' ' GLN . 41.1 t -111.68 -71.1 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.322 0 CA-C-N 111.799 -2.455 . . . . 0.0 114.445 -179.786 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.501 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.4 OUTLIER 60.8 116.5 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 124.099 1.905 . . . . 0.0 113.206 -179.899 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -137.98 -4.12 1.76 Allowed 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 110.365 -3.107 . . . . 0.0 116.326 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.72 114.24 3.39 Favored Glycine 0 CA--C 1.493 -1.343 0 CA-C-N 121.16 1.8 . . . . 0.0 112.2 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 52.46 30.6 8.54 Favored 'General case' 0 C--O 1.212 -0.876 0 O-C-N 125.39 1.288 . . . . 0.0 111.693 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.5 t30 177.79 90.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.504 2.322 . . . . 0.0 109.218 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.689 ' CD2' HD13 ' A' ' 94' ' ' LEU . 32.9 t80 -103.3 95.4 6.07 Favored 'General case' 0 CA--C 1.482 -1.657 1 O-C-N 130.25 4.719 . . . . 0.0 116.648 -179.551 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -106.9 173.29 6.39 Favored 'General case' 0 C--O 1.197 -1.66 0 C-N-CA 114.899 -2.72 . . . . 0.0 111.438 178.094 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -138.28 136.79 36.82 Favored 'General case' 0 N--CA 1.472 0.647 2 O-C-N 132.542 6.151 . . . . 0.0 104.921 177.592 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.603 ' CE ' ' O ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -156.42 115.38 3.43 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 127.722 3.139 . . . . 0.0 113.887 -176.704 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.705 ' HA ' ' HB3' ' A' ' 60' ' ' ASN . 3.0 m 96.93 147.08 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 130.033 3.333 . . . . 0.0 105.276 177.393 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.648 ' CB ' ' HA ' ' A' ' 41' ' ' LYS . 1.2 p-10 -171.76 47.2 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.378 1 O-C-N 129.667 4.354 . . . . 0.0 116.513 -176.832 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 m 148.5 168.46 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 O-C-N 128.867 3.855 . . . . 0.0 107.884 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.928 ' CG2' HD12 ' A' ' 37' ' ' LEU . 5.1 t -83.1 -36.97 24.42 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 111.853 -2.431 . . . . 0.0 106.204 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.912 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -61.15 -29.83 70.02 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 125.682 1.864 . . . . 0.0 110.622 -179.937 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.1 OUTLIER -178.2 162.4 1.56 Allowed 'General case' 0 CA--C 1.504 -0.818 1 O-C-N 131.375 5.422 . . . . 0.0 116.392 -179.938 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.705 ' HB3' ' HA ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -138.47 86.58 2.17 Favored 'General case' 0 CA--C 1.503 -0.853 2 O-C-N 130.778 5.049 . . . . 0.0 114.078 -177.546 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -81.53 93.03 6.6 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 127.186 2.804 . . . . 0.0 110.186 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -43.42 148.25 0.33 Allowed 'General case' 0 C--O 1.206 -1.206 1 O-C-N 129.877 4.486 . . . . 0.0 111.406 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.557 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 4.7 tp -128.9 62.25 1.5 Allowed 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.321 4.138 . . . . 0.0 110.791 179.903 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -79.97 94.24 5.86 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 127.748 3.155 . . . . 0.0 110.363 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.634 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 6.9 m-85 -129.59 137.75 50.89 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 127.103 3.335 . . . . 0.0 109.854 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.635 ' O ' HG23 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -125.4 108.8 12.03 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 109.039 -3.71 . . . . 0.0 103.027 179.594 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.909 HG21 ' CD1' ' A' ' 89' ' ' TRP . 12.5 t -41.77 129.79 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.419 1 O-C-N 130.854 5.096 . . . . 0.0 114.716 -179.771 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.18 12.81 69.9 Favored Glycine 0 N--CA 1.48 1.583 1 O-C-N 129.277 4.111 . . . . 0.0 116.287 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 66' ' ' THR 0.275 1.7 t -73.82 -34.01 39.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.864 -179.792 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 72' ' ' ASP . 27.2 tt0 65.43 73.81 0.39 Allowed 'General case' 0 C--N 1.366 1.306 0 C-N-CA 112.489 -3.685 . . . . 0.0 108.442 -179.374 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.678 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.2 OUTLIER -63.16 77.92 0.02 OUTLIER 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 126.905 3.24 . . . . 0.0 112.569 -179.488 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 70' ' ' GLU . 77.8 m-20 -61.72 78.21 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -179.82 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.531 ' HG2' ' CA ' ' A' ' 83' ' ' VAL . 21.4 mt-10 56.35 108.98 0.01 OUTLIER 'General case' 0 CA--C 1.49 -1.352 1 CA-C-O 129.061 4.267 . . . . 0.0 114.642 179.679 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.62 97.84 0.05 Allowed 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 109.772 -3.376 . . . . 0.0 115.641 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.92 130.8 5.75 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 111.391 -2.641 . . . . 0.0 111.336 -179.932 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.93 148.79 20.95 Favored 'General case' 0 CA--C 1.508 -0.656 0 O-C-N 128.448 3.592 . . . . 0.0 111.899 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.54 -3.99 72.41 Favored Glycine 0 C--O 1.21 -1.369 0 CA-C-N 109.405 -3.543 . . . . 0.0 113.067 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.498 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 0.9 OUTLIER -146.93 19.87 1.27 Allowed 'General case' 0 C--N 1.347 0.494 0 O-C-N 127.868 2.746 . . . . 0.0 116.982 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.7 t0 174.66 -59.5 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.53 0.519 . . . . 0.0 110.96 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.51 72.95 0.97 Allowed Glycine 0 CA--C 1.503 -0.668 0 CA-C-O 126.545 3.303 . . . . 0.0 111.989 -179.797 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.54 -177.63 3.87 Favored 'General case' 0 C--N 1.363 1.194 1 CA-C-N 107.965 -4.118 . . . . 0.0 111.239 179.954 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.444 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.11 82.68 1.2 Allowed 'General case' 0 C--O 1.202 -1.407 0 O-C-N 127.533 3.021 . . . . 0.0 108.145 179.643 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 83' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 99' ' ' LYS . 2.3 t -134.19 143.79 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 CA-C-N 111.194 -2.73 . . . . 0.0 117.926 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -50.89 155.3 1.22 Allowed 'General case' 0 N--CA 1.465 0.291 1 O-C-N 130.139 4.649 . . . . 0.0 106.999 179.299 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.678 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.1 m -158.47 78.46 0.79 Allowed 'General case' 0 C--O 1.194 -1.848 0 CA-C-O 127.764 3.65 . . . . 0.0 111.823 -179.452 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 7.5 tt -68.9 139.13 55.12 Favored 'General case' 0 N--CA 1.431 -1.381 1 CA-C-N 107.412 -4.449 . . . . 0.0 111.864 -179.953 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.427 HG13 ' HA ' ' A' ' 67' ' ' VAL . 14.8 p -132.73 132.45 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 C-N-CA 126.085 1.754 . . . . 0.0 110.759 179.883 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.728 ' HA ' HG13 ' A' ' 67' ' ' VAL . 1.4 t -155.21 175.13 14.24 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 126.886 3.231 . . . . 0.0 110.92 179.847 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 89' ' ' TRP . . . . . 0.909 ' CD1' HG21 ' A' ' 67' ' ' VAL . 42.0 m95 -96.22 144.25 26.6 Favored 'General case' 0 CA--C 1.506 -0.732 0 C-N-CA 127.569 2.347 . . . . 0.0 107.874 180.0 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.549 ' HB2' HG23 ' A' ' 95' ' ' VAL . 6.6 tp10 -91.98 -45.46 8.32 Favored 'General case' 0 C--O 1.21 -1.016 1 CA-C-O 131.706 5.527 . . . . 0.0 111.324 179.878 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -178.95 -49.21 0.08 OUTLIER Glycine 0 C--N 1.359 1.85 1 CA-C-N 105.586 -5.279 . . . . 0.0 105.405 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.64 30.42 1.7 Allowed 'General case' 0 C--O 1.212 -0.9 1 O-C-N 131.678 4.987 . . . . 0.0 111.225 179.912 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.433 HG22 ' CB ' ' A' ' 90' ' ' GLU . 2.6 t -161.54 154.05 20.16 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -179.964 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.689 HD13 ' CD2' ' A' ' 50' ' ' PHE . 2.0 tp -89.61 88.14 7.3 Favored 'General case' 0 CA--C 1.486 -1.496 0 O-C-N 129.048 3.968 . . . . 0.0 118.101 179.742 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.549 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.359 40.9 t -86.29 114.97 26.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.251 0 CA-C-N 110.403 -3.09 . . . . 0.0 112.556 179.681 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -138.55 137.4 37.0 Favored 'General case' 0 C--O 1.2 -1.532 0 CA-C-O 122.227 1.013 . . . . 0.0 108.362 -179.491 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.6 t -122.92 137.28 56.92 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 179.76 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.554 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -94.06 94.21 8.28 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 125.369 2.509 . . . . 0.0 107.921 179.399 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.546 ' O ' HG12 ' A' ' 83' ' ' VAL . 71.4 tttt -91.19 128.73 37.12 Favored 'General case' 0 C--O 1.201 -1.467 1 CA-C-N 107.501 -4.409 . . . . 0.0 113.236 -179.9 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 102' ' ' LYS . . . 157.4 171.26 23.2 Favored Glycine 0 C--O 1.203 -1.836 0 CA-C-N 112.964 -1.925 . . . . 0.0 108.538 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 14.09 -70.23 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.959 2 O-C-N 130.254 4.149 . . . . 0.0 114.414 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.496 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -153.1 -43.01 0.1 Allowed 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 127.37 2.268 . . . . 0.0 115.028 179.636 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.496 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 2.8 mp0 -35.91 105.96 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.221 3.045 . . . . 0.0 119.221 -179.527 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.49 ' O ' ' HB ' ' A' ' 121' ' ' THR . 5.9 m120 -94.52 71.57 3.68 Favored 'General case' 0 N--CA 1.492 1.671 3 CA-C-N 106.96 -4.655 . . . . 0.0 99.436 177.415 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 105' ' ' ARG . 14.5 tpt85 -107.17 12.64 28.16 Favored 'General case' 0 C--N 1.31 -1.136 1 O-C-N 134.314 7.259 . . . . 0.0 111.623 -176.908 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.554 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -75.52 141.71 28.02 Favored Glycine 0 C--O 1.203 -1.783 2 O-C-N 130.98 5.175 . . . . 0.0 111.42 179.949 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 107' ' ' TRP . . . . . 0.634 ' CH2' ' CE2' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -123.93 145.47 49.12 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 129.832 3.901 . . . . 0.0 111.112 179.532 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.404 ' HD2' ' CZ3' ' A' ' 110' ' ' TRP . 6.4 ptpp? -156.11 172.58 18.18 Favored 'General case' 0 C--O 1.202 -1.411 0 O-C-N 128.283 3.489 . . . . 0.0 111.975 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.53 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -133.54 175.47 9.39 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 110.279 -3.146 . . . . 0.0 109.565 -179.627 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 110' ' ' TRP . . . . . 0.498 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -172.27 84.29 0.07 Allowed 'General case' 0 CA--C 1.502 -0.891 1 O-C-N 130.05 4.594 . . . . 0.0 115.208 179.73 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.5 t -37.32 90.8 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.83 0 CA-C-O 124.654 2.168 . . . . 0.0 111.859 179.399 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -91.87 47.49 1.35 Allowed 'General case' 0 CA--C 1.486 -1.492 0 CA-C-N 110.079 -3.237 . . . . 0.0 116.662 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.23 -103.36 1.22 Allowed Glycine 0 C--O 1.212 -1.239 0 O-C-N 121.034 -1.041 . . . . 0.0 115.483 179.752 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -100.08 -8.09 24.16 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.21 177.84 7.5 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 128.898 3.874 . . . . 0.0 108.345 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.614 HD23 ' O ' ' A' ' 116' ' ' LEU . 0.2 OUTLIER -138.12 117.99 13.28 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 126.734 2.521 . . . . 0.0 113.146 179.723 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.498 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.3 m-85 -71.06 151.36 44.62 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 111.514 -2.584 . . . . 0.0 114.432 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.491 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -121.18 52.53 1.2 Allowed 'General case' 0 CA--C 1.5 -0.946 2 O-C-N 131.729 5.643 . . . . 0.0 108.733 -179.991 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.91 146.29 32.62 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 127.876 2.47 . . . . 0.0 108.43 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.701 HD12 ' O ' ' A' ' 121' ' ' THR . 0.1 OUTLIER -156.5 162.14 39.97 Favored 'General case' 0 CA--C 1.486 -1.517 0 O-C-N 126.263 2.227 . . . . 0.0 111.231 -179.755 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.701 ' O ' HD12 ' A' ' 120' ' ' LEU . 1.2 m -118.15 162.98 17.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 127.52 3.012 . . . . 0.0 105.134 -179.661 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.475 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.6 OUTLIER -166.32 47.72 0.07 Allowed 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 126.245 2.926 . . . . 0.0 110.918 179.52 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.19 61.48 2.64 Favored Glycine 0 C--O 1.238 0.38 0 CA-C-N 110.269 -3.15 . . . . 0.0 110.952 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 66.36 41.83 3.19 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 128.112 2.89 . . . . 0.0 111.774 179.69 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.905 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 5.4 mm-40 -131.58 31.53 4.28 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.569 3.043 . . . . 0.0 104.586 179.828 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.587 HG13 ' NH1' ' A' ' 128' ' ' ARG . 9.7 p -22.44 75.32 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 O-C-N 127.739 3.149 . . . . 0.0 114.764 179.819 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 13.1 t -68.31 139.77 55.92 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 119.51 -1.994 . . . . 0.0 111.19 -179.847 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 128' ' ' ARG . . . . . 0.587 ' NH1' HG13 ' A' ' 126' ' ' VAL . 0.3 OUTLIER -119.28 147.5 44.21 Favored 'General case' 0 N--CA 1.47 0.542 1 O-C-N 129.266 4.104 . . . . 0.0 110.667 179.657 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -132.48 178.87 6.5 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 128.267 3.479 . . . . 0.0 110.92 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.27 141.52 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 103.282 -2.858 . . . . 0.0 103.282 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.491 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 42.6 m-85 -127.18 171.04 11.78 Favored 'General case' 0 CA--C 1.486 -1.511 0 O-C-N 128.399 3.562 . . . . 0.0 114.861 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 132' ' ' LYS . . . . . 0.42 ' HD2' ' N ' ' A' ' 133' ' ' LYS 0.322 0.1 OUTLIER -157.27 117.97 3.56 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 112.723 -3.513 . . . . 0.0 103.296 179.997 . . . . . . . . 4 4 . 1 . 024 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.553 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 10.9 pttt -52.94 130.61 34.05 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 130.292 4.745 . . . . 0.0 110.268 179.373 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.413 ' HG2' ' C ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.799 0 O-C-N 126.212 2.195 . . . . 0.0 115.902 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.103 0 CA-C-O 123.323 1.535 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -150.74 151.01 31.76 Favored 'General case' 0 C--O 1.211 -0.972 0 O-C-N 120.995 -1.066 . . . . 0.0 109.978 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 65.27 0.01 OUTLIER 'General case' 0 C--N 1.358 0.937 0 O-C-N 127.768 3.167 . . . . 0.0 117.851 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -157.75 76.66 0.81 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -108.43 12.25 26.37 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 116.031 -1.938 . . . . 0.0 107.607 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -9.52 119.09 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.954 1 O-C-N 132.835 6.334 . . . . 0.0 115.382 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.494 ' O ' HG23 ' A' ' 8' ' ' THR . . . -170.26 -135.12 1.85 Allowed Glycine 0 C--O 1.21 -1.386 0 CA-C-O 116.693 -2.17 . . . . 0.0 110.259 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.494 HG23 ' O ' ' A' ' 7' ' ' GLY . 1.3 p -155.56 163.75 39.56 Favored 'General case' 0 C--O 1.208 -1.093 1 O-C-N 132.168 5.275 . . . . 0.0 107.201 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.514 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.254 0.0 OUTLIER -156.92 101.59 1.95 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 128.063 3.352 . . . . 0.0 111.391 179.965 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -56.48 -18.25 10.85 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.422 ' HG3' ' CE2' ' A' ' 131' ' ' PHE . 27.7 ttm 68.28 84.98 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 103.364 -2.828 . . . . 0.0 103.364 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.01 -29.67 0.62 Allowed 'General case' 0 C--N 1.312 -1.029 0 O-C-N 128.802 3.814 . . . . 0.0 111.698 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.265 1.5 m -176.15 162.9 2.55 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-N 113.718 -1.583 . . . . 0.0 112.052 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -128.96 121.25 27.61 Favored 'General case' 0 CA--C 1.501 -0.94 0 CA-C-N 111.194 -2.73 . . . . 0.0 114.354 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -70.74 -63.45 1.09 Allowed 'General case' 0 CA--C 1.491 -1.325 1 O-C-N 129.654 4.346 . . . . 0.0 109.288 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -115.13 135.21 54.44 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -128.44 -56.42 1.23 Allowed 'General case' 0 CA--C 1.495 -1.173 0 CA-C-O 124.183 1.944 . . . . 0.0 110.936 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.578 ' HB2' ' CB ' ' A' ' 31' ' ' ARG . 5.3 tp10 -76.71 -37.02 56.81 Favored 'General case' 0 CA--C 1.499 -0.992 0 O-C-N 120.391 -1.443 . . . . 0.0 113.204 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.522 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.15 -25.01 46.03 Favored Glycine 0 CA--C 1.5 -0.882 0 O-C-N 128.537 3.648 . . . . 0.0 112.609 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -75.0 -37.79 61.76 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 119.136 1.468 . . . . 0.0 107.934 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 mtm -77.23 -20.95 54.54 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 112.368 -2.196 . . . . 0.0 107.628 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.522 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 3.0 ttmt -75.09 -38.42 61.23 Favored 'General case' 0 C--O 1.199 -1.572 0 C-N-CA 128.845 2.858 . . . . 0.0 114.595 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.0 -36.39 83.41 Favored 'General case' 0 C--O 1.203 -1.379 1 O-C-N 130.971 5.169 . . . . 0.0 114.163 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.69 HD11 ' HB ' ' A' ' 26' ' ' ILE . 3.7 pp -94.58 -2.48 51.41 Favored 'General case' 0 C--O 1.215 -0.763 1 O-C-N 129.364 4.165 . . . . 0.0 107.969 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.7 t0 45.7 79.53 0.05 Allowed 'General case' 0 CA--C 1.483 -1.631 0 CA-C-O 128.159 3.838 . . . . 0.0 111.093 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.69 ' HB ' HD11 ' A' ' 24' ' ' LEU . 15.6 tt -84.0 -50.15 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.685 0 CA-C-N 109.452 -3.522 . . . . 0.0 108.274 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.452 ' N ' HG23 ' A' ' 26' ' ' ILE . 3.8 t0 -175.94 26.23 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 115.016 -2.421 . . . . 0.0 112.678 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 31.79 37.47 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.303 0 O-C-N 126.308 2.255 . . . . 0.0 117.039 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.0 172.82 17.48 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 112.363 -2.199 . . . . 0.0 106.729 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.287 0.6 OUTLIER 97.71 -7.01 0.06 Allowed 'General case' 0 N--CA 1.484 1.235 1 O-C-N 131.126 5.266 . . . . 0.0 112.667 -179.749 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.578 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -75.51 -16.82 60.25 Favored 'General case' 0 C--O 1.238 0.451 1 O-C-N 131.594 5.559 . . . . 0.0 107.524 179.475 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.8 -11.85 17.31 Favored 'General case' 0 C--O 1.213 -0.854 0 O-C-N 127.534 3.021 . . . . 0.0 111.476 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.3 mp -116.1 -53.36 4.55 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.194 1 O-C-N 130.349 4.781 . . . . 0.0 114.121 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.432 ' HB1' ' CE2' ' A' ' 58' ' ' PHE . . . -67.78 -10.38 52.26 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.9 t -15.82 -48.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.557 0 N-CA-C 116.866 2.173 . . . . 0.0 116.866 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.664 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.1 OUTLIER 162.2 115.38 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.604 2 O-C-N 129.814 4.446 . . . . 0.0 115.311 179.762 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.664 HD23 ' C ' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -142.42 68.79 1.31 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 110.825 -2.898 . . . . 0.0 106.906 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.4 m 93.49 -17.96 0.11 Allowed 'General case' 0 C--O 1.24 0.557 0 O-C-N 128.357 3.535 . . . . 0.0 117.42 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -12.7 89.16 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.007 0 O-C-N 127.678 3.111 . . . . 0.0 117.695 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -111.21 102.16 10.61 Favored 'General case' 0 N--CA 1.434 -1.273 1 O-C-N 132.169 5.918 . . . . 0.0 111.815 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.476 ' CD ' ' CD1' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -75.18 141.98 43.55 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 128.196 3.435 . . . . 0.0 107.425 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.534 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.7 mt -140.01 160.17 26.39 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 CA-C-O 123.291 1.519 . . . . 0.0 111.779 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.534 ' N ' HG22 ' A' ' 42' ' ' ILE 0.316 9.1 tt -132.3 142.99 41.28 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.476 0 CA-C-N 110.989 -2.823 . . . . 0.0 107.652 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.676 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.1 t -115.98 -68.16 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 CA-C-N 113.888 -1.506 . . . . 0.0 114.661 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.676 ' N ' HG12 ' A' ' 44' ' ' VAL . 2.1 mt-30 69.12 133.19 0.03 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 O-C-N 124.832 1.332 . . . . 0.0 113.317 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -132.58 -24.51 1.99 Allowed 'General case' 0 C--N 1.359 0.98 1 O-C-N 130.213 4.696 . . . . 0.0 117.124 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.11 -69.85 0.4 Allowed Glycine 0 C--O 1.218 -0.905 0 CA-C-O 122.958 1.31 . . . . 0.0 111.243 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -102.61 -8.25 21.11 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-N 111.227 -2.487 . . . . 0.0 112.037 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -118.48 177.77 4.7 Favored 'General case' 0 C--N 1.354 0.793 0 CA-C-O 114.45 -2.69 . . . . 0.0 111.316 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.744 ' CD2' HD22 ' A' ' 94' ' ' LEU . 5.9 t80 -172.22 113.68 0.31 Allowed 'General case' 0 C--N 1.313 -1.01 1 O-C-N 132.062 5.851 . . . . 0.0 115.828 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.448 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -133.72 79.92 1.85 Allowed 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 118.594 2.813 . . . . 0.0 118.594 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 43' ' ' ILE . 0.7 OUTLIER -60.41 149.71 33.16 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 112.458 -2.155 . . . . 0.0 107.153 179.712 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -146.06 162.6 37.53 Favored 'General case' 0 CA--C 1.49 -1.365 0 O-C-N 127.259 2.849 . . . . 0.0 111.516 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.02 123.03 49.36 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 127.602 3.064 . . . . 0.0 107.647 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.441 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -91.68 29.35 1.55 Allowed 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.511 ' HB3' ' CD1' ' A' ' 58' ' ' PHE . 0.6 OUTLIER -53.08 157.74 1.7 Allowed 'General case' 0 C--O 1.209 -1.051 0 O-C-N 128.853 3.845 . . . . 0.0 105.792 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.411 ' HB ' HD12 ' A' ' 37' ' ' LEU . 46.2 m -84.54 -7.6 59.21 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 109.212 -3.631 . . . . 0.0 109.163 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.584 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -101.75 -39.12 7.57 Favored 'General case' 0 C--N 1.366 1.296 0 CA-C-O 125.095 2.379 . . . . 0.0 110.466 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.79 149.56 27.55 Favored 'General case' 0 C--N 1.361 1.083 1 CA-C-N 107.794 -4.276 . . . . 0.0 117.93 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 79.71 1.62 Allowed 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 109.185 -3.643 . . . . 0.0 109.295 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -170.95 71.49 0.05 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 108.932 -3.758 . . . . 0.0 107.477 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.443 ' HB3' ' HA ' ' A' ' 53' ' ' LYS . 2.8 t0 -106.57 -127.13 0.25 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.6 2.438 . . . . 0.0 115.648 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.741 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -56.07 101.52 0.06 Allowed 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.368 -179.873 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -132.2 88.91 2.6 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 127.086 2.741 . . . . 0.0 112.369 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.576 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -166.52 179.62 5.41 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 124.088 1.899 . . . . 0.0 112.785 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.59 152.23 30.6 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.808 HG21 ' CD1' ' A' ' 89' ' ' TRP . 0.3 OUTLIER -71.76 144.01 13.68 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.866 0 O-C-N 128.915 3.884 . . . . 0.0 115.202 -179.744 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.71 7.54 22.24 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 128.607 3.692 . . . . 0.0 116.936 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 1.1 t -72.84 -26.46 23.49 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.575 0 O-C-N 125.312 1.242 . . . . 0.0 109.136 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 65.68 89.86 0.09 Allowed 'General case' 0 C--O 1.212 -0.896 2 O-C-N 131.028 5.205 . . . . 0.0 109.383 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 3.4 t80 -74.89 67.35 1.65 Allowed 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 127.265 2.853 . . . . 0.0 112.258 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -50.01 79.12 0.0 OUTLIER 'General case' 0 CA--C 1.484 -1.591 0 CA-C-N 113.593 -1.64 . . . . 0.0 113.625 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.47 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 11.1 mt-10 52.89 -165.76 0.07 Allowed 'General case' 0 C--O 1.212 -0.89 0 C-N-CA 125.311 1.444 . . . . 0.0 111.848 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.5 t60 72.49 78.8 0.15 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 125.449 2.547 . . . . 0.0 115.843 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.41 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -122.82 170.28 10.25 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 111.925 -2.398 . . . . 0.0 112.945 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.41 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.15 138.22 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 O-C-N 128.34 3.525 . . . . 0.0 113.68 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 125.94 -17.41 6.76 Favored Glycine 0 C--O 1.213 -1.181 0 CA-C-N 112.165 -2.288 . . . . 0.0 110.067 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.482 ' O ' HD12 ' A' ' 26' ' ' ILE . 3.7 tp -122.75 -67.85 0.92 Allowed 'General case' 0 N--CA 1.469 0.503 2 CA-C-N 106.734 -4.733 . . . . 0.0 112.869 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.486 ' HA ' HD13 ' A' ' 24' ' ' LEU . 2.3 t70 -104.51 -72.62 0.7 Allowed 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.2 76.2 1.18 Allowed Glycine 0 C--O 1.217 -0.96 0 CA-C-O 124.676 2.265 . . . . 0.0 111.439 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.452 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 11.6 tpp180 -150.22 -117.77 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.228 1 CA-C-N 107.195 -4.503 . . . . 0.0 113.112 179.682 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.47 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.3 OUTLIER -172.57 97.37 0.14 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.828 1.194 . . . . 0.0 112.256 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 87.8 t -135.77 126.91 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 N-CA-C 117.959 2.577 . . . . 0.0 117.959 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.456 ' CB ' ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -51.8 122.25 7.93 Favored 'General case' 0 C--O 1.218 -0.601 0 O-C-N 128.782 3.801 . . . . 0.0 106.837 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.561 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 21.5 m -133.33 83.27 2.04 Favored 'General case' 0 C--O 1.196 -1.735 0 O-C-N 128.417 3.573 . . . . 0.0 112.952 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.451 ' HG ' ' N ' ' A' ' 87' ' ' VAL . 1.1 tp -82.73 138.66 33.98 Favored 'General case' 0 N--CA 1.438 -1.047 1 CA-C-N 107.033 -4.621 . . . . 0.0 111.595 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.545 HG12 HG23 ' A' ' 67' ' ' VAL . 97.3 t -123.31 140.22 47.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 124.888 1.275 . . . . 0.0 110.602 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.9 m -154.68 152.08 29.52 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 112.647 -2.069 . . . . 0.0 110.625 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.808 ' CD1' HG21 ' A' ' 67' ' ' VAL . 38.8 m95 -89.9 139.23 30.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 129.082 2.953 . . . . 0.0 106.847 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.452 ' CB ' HG22 ' A' ' 93' ' ' THR . 0.4 OUTLIER -91.29 -16.18 27.94 Favored 'General case' 0 CA--C 1.478 -1.811 1 CA-C-O 130.146 4.784 . . . . 0.0 114.925 179.893 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.68 -30.88 3.5 Favored Glycine 0 C--N 1.362 1.98 1 CA-C-N 107.542 -4.39 . . . . 0.0 103.411 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -156.16 91.0 1.23 Allowed 'General case' 0 N--CA 1.428 -1.569 1 O-C-N 132.906 5.709 . . . . 0.0 106.296 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.452 HG22 ' CB ' ' A' ' 90' ' ' GLU . 1.2 t 116.59 160.47 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 128.852 2.861 . . . . 0.0 118.029 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.744 HD22 ' CD2' ' A' ' 50' ' ' PHE . 6.1 tp -102.81 99.07 8.99 Favored 'General case' 0 CA--C 1.49 -1.339 0 CA-C-O 125.216 2.436 . . . . 0.0 117.326 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.462 HG13 ' NZ ' ' A' ' 108' ' ' LYS 0.357 66.9 t -92.66 121.55 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 114.83 -2.509 . . . . 0.0 112.547 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -136.39 140.9 43.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 124.189 1.947 . . . . 0.0 109.387 -179.445 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.4 t -107.83 102.94 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.967 0 CA-C-N 109.267 -3.606 . . . . 0.0 118.08 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.489 ' HG3' ' C ' ' A' ' 105' ' ' ARG . 5.0 mm100 -83.09 86.34 7.03 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.128 -1.608 . . . . 0.0 107.959 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.456 ' HB3' ' CB ' ' A' ' 84' ' ' LYS . 0.6 OUTLIER -76.16 100.25 4.95 Favored 'General case' 0 C--O 1.2 -1.526 0 CA-C-N 109.498 -3.501 . . . . 0.0 107.769 -179.321 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -98.68 177.47 30.59 Favored Glycine 0 C--O 1.214 -1.1 0 O-C-N 127.597 3.061 . . . . 0.0 112.271 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -107.96 -39.91 5.39 Favored 'General case' 0 CA--C 1.494 -1.2 1 CA-C-N 106.675 -4.762 . . . . 0.0 111.989 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.43 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -117.06 -41.85 2.98 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 125.067 2.365 . . . . 0.0 115.433 179.68 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' A' ' 105' ' ' ARG . 2.0 pp20? -113.78 167.24 10.79 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 126.582 3.087 . . . . 0.0 112.561 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -126.65 90.11 3.11 Favored 'General case' 0 N--CA 1.489 1.514 1 CA-C-N 107.346 -4.479 . . . . 0.0 102.415 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.489 ' C ' ' HG3' ' A' ' 98' ' ' GLN . 5.8 mmm180 -79.74 -7.76 58.82 Favored 'General case' 0 C--N 1.317 -0.806 1 O-C-N 129.448 4.218 . . . . 0.0 113.011 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.493 ' O ' HG22 ' A' ' 121' ' ' THR . . . -22.51 98.59 0.01 OUTLIER Glycine 0 N--CA 1.442 -0.936 1 O-C-N 133.71 6.881 . . . . 0.0 112.333 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.741 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.333 0.0 OUTLIER -116.79 125.27 51.35 Favored 'General case' 0 C--O 1.219 -0.536 1 O-C-N 132.415 5.42 . . . . 0.0 111.34 -179.197 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.479 ' HB2' ' CZ3' ' A' ' 110' ' ' TRP . 0.1 OUTLIER -151.19 153.61 35.28 Favored 'General case' 0 CA--C 1.507 -0.707 0 O-C-N 128.552 3.657 . . . . 0.0 116.318 -178.518 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.789 ' HG2' HD22 ' A' ' 118' ' ' LEU . 0.1 OUTLIER -116.53 167.51 10.99 Favored 'General case' 0 C--N 1.36 1.055 0 CA-C-N 109.725 -3.398 . . . . 0.0 110.248 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.479 ' CZ3' ' HB2' ' A' ' 108' ' ' LYS . 0.5 OUTLIER -177.36 99.34 0.05 OUTLIER 'General case' 0 C--O 1.211 -0.929 0 O-C-N 128.309 3.505 . . . . 0.0 114.87 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.0 t -47.23 97.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.825 0 CA-C-O 124.948 2.308 . . . . 0.0 112.988 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.475 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 9.2 mm-40 -94.21 50.91 1.42 Allowed 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 109.09 -3.687 . . . . 0.0 112.604 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.19 -130.14 9.14 Favored Glycine 0 C--O 1.201 -1.934 0 O-C-N 119.465 -2.022 . . . . 0.0 113.057 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -90.77 16.26 9.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 127.405 2.282 . . . . 0.0 117.093 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -142.97 -176.52 4.94 Favored 'General case' 0 C--O 1.223 -0.303 0 O-C-N 128.529 3.643 . . . . 0.0 108.305 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.452 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -140.75 108.17 5.56 Favored 'General case' 0 CA--C 1.485 -1.54 1 O-C-N 130.283 4.739 . . . . 0.0 117.598 -179.904 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.755 ' O ' HD23 ' A' ' 118' ' ' LEU . 17.4 m-30 -72.36 142.72 48.76 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 111.23 -2.714 . . . . 0.0 116.809 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.789 HD22 ' HG2' ' A' ' 109' ' ' GLN . 3.1 mt -130.48 86.37 2.38 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 109.141 -3.663 . . . . 0.0 107.542 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -96.98 92.41 6.07 Favored 'General case' 0 CA--C 1.495 -1.164 0 C-N-CA 128.278 2.631 . . . . 0.0 111.829 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.456 ' CD2' ' HB3' ' A' ' 127' ' ' CYS . 0.3 OUTLIER -110.64 -177.07 3.13 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 128.119 3.387 . . . . 0.0 108.645 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 106' ' ' GLY . 9.2 t -150.44 178.32 9.16 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.978 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.5 p -173.09 60.23 0.02 OUTLIER 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 126.066 2.841 . . . . 0.0 113.078 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.97 -74.77 1.09 Allowed Glycine 0 CA--C 1.521 0.439 0 CA-C-N 111.166 -2.743 . . . . 0.0 112.79 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.91 -50.47 3.05 Favored 'General case' 0 CA--C 1.493 -1.214 0 O-C-N 126.19 1.759 . . . . 0.0 110.966 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.28 174.94 1.06 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 128.466 3.604 . . . . 0.0 109.815 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.459 HG13 ' O ' ' A' ' 126' ' ' VAL . 3.6 p -153.81 88.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 CA-C-N 109.425 -3.534 . . . . 0.0 111.007 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.456 ' HB3' ' CD2' ' A' ' 120' ' ' LEU . 52.0 t -73.35 118.53 16.41 Favored 'General case' 0 CA--C 1.49 -1.349 0 CA-C-N 112.161 -2.29 . . . . 0.0 112.203 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -106.1 135.5 47.45 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 114.524 -2.655 . . . . 0.0 110.46 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -126.34 154.31 43.69 Favored 'General case' 0 CA--C 1.488 -1.422 1 O-C-N 129.671 4.357 . . . . 0.0 116.159 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.22 136.21 53.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.523 ' N ' ' CD1' ' A' ' 131' ' ' PHE . 52.4 m-85 -126.47 -179.43 4.76 Favored 'General case' 0 CA--C 1.477 -1.853 0 CA-C-N 111.709 -2.496 . . . . 0.0 113.916 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.483 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.318 0.0 OUTLIER -157.69 45.86 0.36 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 112.369 -3.681 . . . . 0.0 108.825 -179.759 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.509 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 35.6 ttpt 15.18 102.2 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.933 1 O-C-N 130.186 4.679 . . . . 0.0 118.294 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt . . . . . 0 CA--C 1.494 -1.189 0 CA-C-O 114.383 -2.722 . . . . 0.0 112.02 -179.581 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 mmt . . . . . 0 N--CA 1.505 2.317 0 CA-C-O 123.572 1.653 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.37 -56.12 3.05 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-N 114.105 -1.407 . . . . 0.0 110.251 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.455 ' HG2' ' CH2' ' A' ' 89' ' ' TRP . 0.6 OUTLIER -105.21 -50.36 3.25 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 128.157 3.411 . . . . 0.0 118.583 -179.875 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.28 105.27 0.07 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 125.898 1.679 . . . . 0.0 109.602 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -116.43 -143.57 0.38 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 112.743 -3.503 . . . . 0.0 102.073 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.9 m120 125.42 122.45 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 1 O-C-N 131.026 5.204 . . . . 0.0 115.337 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.02 -169.96 33.16 Favored Glycine 0 C--O 1.204 -1.722 0 CA-C-N 112.108 -2.315 . . . . 0.0 111.885 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.526 HG23 HG23 ' A' ' 40' ' ' THR . 0.3 OUTLIER -119.01 152.11 37.0 Favored 'General case' 0 C--O 1.202 -1.412 1 O-C-N 132.15 5.265 . . . . 0.0 104.216 179.735 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.563 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -149.11 108.05 3.88 Favored 'General case' 0 CA--C 1.486 -1.506 1 O-C-N 132.426 6.079 . . . . 0.0 112.517 -179.976 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -76.52 100.73 5.37 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 116.213 -2.195 . . . . 0.0 108.156 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.452 ' HB3' ' CD ' ' A' ' 39' ' ' GLN . 4.9 ttm -32.53 -42.42 0.07 Allowed 'General case' 0 N--CA 1.474 0.759 0 O-C-N 127.409 2.943 . . . . 0.0 108.78 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 85.25 -55.84 0.09 Allowed 'General case' 0 CA--C 1.51 -0.569 1 O-C-N 131.461 5.475 . . . . 0.0 112.224 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -157.44 -175.67 5.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 124.815 2.245 . . . . 0.0 111.419 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -155.26 168.0 28.51 Favored 'General case' 0 CA--C 1.483 -1.617 0 CA-C-N 111.513 -2.585 . . . . 0.0 114.109 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -89.9 -80.61 0.31 Allowed 'General case' 0 CA--C 1.503 -0.859 0 O-C-N 128.781 3.801 . . . . 0.0 110.01 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -114.14 126.84 55.53 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 123.216 1.484 . . . . 0.0 112.31 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.64 ' CZ ' HG22 ' A' ' 35' ' ' VAL . 5.7 p90 -109.74 -44.81 3.76 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-O 124.095 1.902 . . . . 0.0 107.883 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.438 ' HG3' ' CB ' ' A' ' 31' ' ' ARG . 5.2 tt0 -66.8 -37.22 84.12 Favored 'General case' 0 C--O 1.215 -0.721 0 O-C-N 120.685 -1.259 . . . . 0.0 113.732 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.18 -33.01 81.67 Favored Glycine 0 N--CA 1.475 1.24 1 O-C-N 129.36 4.163 . . . . 0.0 109.73 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.525 ' CE1' HD21 ' A' ' 24' ' ' LEU . 0.9 OUTLIER -73.69 -44.18 57.29 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-O 124.878 2.275 . . . . 0.0 107.447 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.673 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -61.28 -23.47 65.7 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 124.389 2.042 . . . . 0.0 113.282 -179.692 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -76.58 -27.3 55.77 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 108.441 -3.982 . . . . 0.0 112.684 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.26 -42.24 79.92 Favored 'General case' 0 N--CA 1.477 0.915 1 O-C-N 129.883 4.489 . . . . 0.0 111.679 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.721 HD22 ' NE ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -84.73 -16.33 42.04 Favored 'General case' 0 N--CA 1.483 1.184 1 O-C-N 130.194 4.684 . . . . 0.0 103.966 -179.698 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.4 t0 55.33 84.0 0.08 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 128.561 3.663 . . . . 0.0 110.587 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.673 HG22 ' O ' ' A' ' 21' ' ' MET . 20.2 tt -124.39 53.59 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 1 CA-C-N 107.988 -4.187 . . . . 0.0 107.237 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.55 -171.74 0.85 Allowed 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 113.239 -1.8 . . . . 0.0 113.584 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.444 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.5 m-85 65.75 46.92 2.22 Favored 'General case' 0 CA--C 1.501 -0.924 0 O-C-N 126.288 2.242 . . . . 0.0 116.518 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 88.86 163.04 0.06 Allowed 'General case' 0 C--O 1.2 -1.506 0 O-C-N 127.387 2.929 . . . . 0.0 107.858 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 t 122.38 -31.64 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.016 2 O-C-N 133.214 6.571 . . . . 0.0 109.142 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.438 ' CB ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -105.56 163.96 12.26 Favored 'General case' 0 C--O 1.243 0.725 1 O-C-N 132.357 6.036 . . . . 0.0 108.103 179.34 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 mttt 82.68 10.02 0.65 Allowed 'General case' 0 C--O 1.2 -1.53 0 O-C-N 127.63 3.081 . . . . 0.0 109.922 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.8 mp -145.36 -57.81 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.58 2 O-C-N 132.009 5.818 . . . . 0.0 107.357 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.486 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -82.92 62.15 6.33 Favored 'General case' 0 C--O 1.203 -1.377 0 CA-C-N 112.235 -2.257 . . . . 0.0 113.797 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.64 HG22 ' CZ ' ' A' ' 17' ' ' PHE . 3.2 t -83.81 -45.48 18.38 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.322 0 CA-C-N 111.032 -2.804 . . . . 0.0 109.589 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.447 ' CD ' ' HB2' ' A' ' 39' ' ' GLN . 1.0 OUTLIER 168.0 113.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.664 2 O-C-N 131.416 5.448 . . . . 0.0 109.475 179.793 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.689 HD12 ' N ' ' A' ' 38' ' ' THR . 0.4 OUTLIER -90.11 -9.08 49.7 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 127.496 2.997 . . . . 0.0 111.449 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.689 ' N ' HD12 ' A' ' 37' ' ' LEU . 0.8 OUTLIER 164.31 -65.19 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.135 0 O-C-N 128.158 3.411 . . . . 0.0 112.289 179.886 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.647 ' N ' HG22 ' A' ' 38' ' ' THR . 14.0 tm0? 66.58 146.5 0.04 OUTLIER 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.526 HG23 HG23 ' A' ' 8' ' ' THR . 20.1 m -162.01 104.77 1.17 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 130.837 3.655 . . . . 0.0 112.004 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.482 ' HZ3' ' HG ' ' A' ' 116' ' ' LEU . 0.8 OUTLIER -86.98 146.37 26.16 Favored 'General case' 0 N--CA 1.488 1.425 1 O-C-N 129.662 4.351 . . . . 0.0 109.054 -179.433 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.566 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.0 mt -134.84 154.91 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-N 114.506 -1.225 . . . . 0.0 110.574 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.568 HG13 ' CE1' ' A' ' 50' ' ' PHE . 13.7 tt -130.27 124.75 58.41 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 O-C-N 128.37 3.544 . . . . 0.0 107.463 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.2 t -98.36 -32.54 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.173 0 CA-C-N 113.303 -1.771 . . . . 0.0 111.501 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 8.16 91.03 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.02 0 O-C-N 127.38 2.925 . . . . 0.0 118.111 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.82 -35.05 15.03 Favored 'General case' 0 CA--C 1.477 -1.84 2 CA-C-N 106.678 -4.783 . . . . 0.0 114.857 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.17 -111.81 0.5 Allowed Glycine 0 C--O 1.204 -1.774 0 O-C-N 120.457 -1.402 . . . . 0.0 112.493 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -52.51 -28.11 19.2 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 125.964 1.626 . . . . 0.0 111.854 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -117.46 138.75 51.65 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 128.487 2.715 . . . . 0.0 109.279 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.621 ' CE2' HD22 ' A' ' 94' ' ' LEU . 1.7 t80 -149.73 113.54 5.07 Favored 'General case' 0 CA--C 1.483 -1.631 0 O-C-N 127.501 3.001 . . . . 0.0 113.014 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.4 mttm -119.19 82.81 1.93 Allowed 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.416 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -58.8 133.16 55.73 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 128.491 3.62 . . . . 0.0 106.719 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 62' ' ' ASP . 0.5 OUTLIER -144.43 154.3 42.81 Favored 'General case' 0 CA--C 1.488 -1.427 0 C-N-CA 115.087 -2.645 . . . . 0.0 111.453 -179.509 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 59' ' ' ARG . 0.9 OUTLIER -102.77 155.38 18.36 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 127.57 3.044 . . . . 0.0 111.658 -179.573 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -138.09 49.27 1.95 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.985 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -88.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 1 O-C-N 130.971 5.169 . . . . 0.0 107.93 179.796 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 155.88 -33.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.18 1 O-C-N 131.577 5.548 . . . . 0.0 104.313 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.486 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 8.6 m-85 -69.03 -49.37 58.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 125.955 2.035 . . . . 0.0 108.098 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.459 ' O ' HG22 ' A' ' 54' ' ' THR . 0.2 OUTLIER -155.23 120.18 4.85 Favored 'General case' 0 C--N 1.364 1.227 2 CA-C-N 106.869 -4.696 . . . . 0.0 112.845 179.378 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 m-20 -104.85 21.94 16.08 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 111.232 -2.713 . . . . 0.0 111.724 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -117.29 98.52 6.48 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 128.586 3.679 . . . . 0.0 109.622 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.465 ' HB2' ' HA ' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -108.95 -79.7 0.58 Allowed 'General case' 0 C--O 1.205 -1.25 1 O-C-N 129.298 4.124 . . . . 0.0 113.361 -179.994 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.586 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 1.1 tp -125.54 119.53 28.4 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -144.75 88.85 1.93 Allowed 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.568 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -150.12 -163.61 1.82 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 123.451 1.595 . . . . 0.0 110.23 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -145.59 152.24 39.38 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.415 HG21 ' CD1' ' A' ' 89' ' ' TRP . 3.1 t -61.55 130.94 26.35 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.586 0 C-N-CA 116.724 -1.991 . . . . 0.0 113.544 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.14 -0.73 89.33 Favored Glycine 0 N--CA 1.486 1.998 0 CA-C-N 110.763 -2.926 . . . . 0.0 116.461 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.579 HG12 ' N ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -49.85 -39.13 14.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 125.208 1.181 . . . . 0.0 109.66 -179.654 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.435 ' N ' HG12 ' A' ' 69' ' ' VAL . 4.3 tt0 57.17 65.14 1.44 Allowed 'General case' 0 C--O 1.211 -0.946 1 O-C-N 130.67 4.981 . . . . 0.0 108.546 -179.262 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.691 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.1 t80 -49.16 92.65 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.68 2 O-C-N 133.421 6.701 . . . . 0.0 110.866 -179.384 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.428 ' C ' ' HG3' ' A' ' 73' ' ' GLU . 39.6 t0 -57.29 63.84 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.997 0 O-C-N 126.403 2.314 . . . . 0.0 113.93 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.482 ' HB3' ' CB ' ' A' ' 82' ' ' ASN 0.258 5.3 mt-10 56.36 -170.59 0.08 Allowed 'General case' 0 CA--C 1.484 -1.574 0 CA-C-O 125.373 2.511 . . . . 0.0 110.05 179.743 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.75 93.11 0.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 109.225 -3.625 . . . . 0.0 109.004 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.43 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 2.0 p -96.07 -55.86 2.83 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 111.301 -2.681 . . . . 0.0 116.91 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.43 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 48.1 165.31 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.933 1 O-C-N 129.348 4.155 . . . . 0.0 115.562 -179.515 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.18 -51.39 3.42 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 112.36 -2.2 . . . . 0.0 112.497 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.647 ' O ' HD12 ' A' ' 26' ' ' ILE 0.267 2.5 tp -119.8 -0.79 10.63 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 127.975 2.809 . . . . 0.0 117.417 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -154.99 -74.08 0.11 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 116.545 -2.062 . . . . 0.0 113.199 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.93 72.88 1.28 Allowed Glycine 0 C--O 1.212 -1.219 0 CA-C-O 122.578 1.099 . . . . 0.0 111.825 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.423 ' CG ' ' H ' ' A' ' 82' ' ' ASN . 0.8 OUTLIER -136.89 -148.45 0.28 Allowed 'General case' 0 C--N 1.351 0.651 0 CA-C-N 110.185 -3.007 . . . . 0.0 109.107 -179.769 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.482 ' CB ' ' HB3' ' A' ' 73' ' ' GLU . 40.6 m-20 -161.69 100.15 1.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 125.637 1.835 . . . . 0.0 109.516 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 40.4 t -129.13 146.81 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 O-C-N 127.265 2.853 . . . . 0.0 118.534 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -79.87 88.23 5.29 Favored 'General case' 0 C--O 1.218 -0.595 1 O-C-N 130.423 4.827 . . . . 0.0 108.254 179.436 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.691 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 8.0 m -99.22 85.83 3.29 Favored 'General case' 0 C--O 1.193 -1.882 1 O-C-N 130.258 4.724 . . . . 0.0 114.034 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.644 HD23 ' N ' ' A' ' 87' ' ' VAL . 7.9 tt -89.63 155.71 19.06 Favored 'General case' 0 N--CA 1.442 -0.854 1 CA-C-N 107.509 -4.405 . . . . 0.0 110.238 179.822 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.644 ' N ' HD23 ' A' ' 86' ' ' LEU . 2.4 p -140.14 132.49 33.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 127.087 2.155 . . . . 0.0 109.692 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.473 ' HB ' HD21 ' A' ' 86' ' ' LEU . 6.8 t -155.8 -178.69 7.48 Favored 'General case' 0 CA--C 1.485 -1.55 0 CA-C-O 125.419 2.533 . . . . 0.0 111.584 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.732 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 58.5 m95 -99.25 145.6 27.1 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 118.577 -2.577 . . . . 0.0 108.647 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.648 ' HB2' HG23 ' A' ' 95' ' ' VAL . 7.2 tp10 -93.09 -44.45 8.37 Favored 'General case' 0 C--O 1.201 -1.455 1 CA-C-O 131.529 5.443 . . . . 0.0 112.15 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 174.93 -46.64 0.13 Allowed Glycine 0 N--CA 1.478 1.491 1 CA-C-N 106.634 -4.803 . . . . 0.0 104.464 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -141.48 36.53 1.67 Allowed 'General case' 0 C--O 1.202 -1.438 1 O-C-N 130.305 4.18 . . . . 0.0 110.881 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 90' ' ' GLU . 3.6 t -176.09 158.72 2.02 Favored 'General case' 0 C--O 1.203 -1.354 0 N-CA-C 118.048 2.61 . . . . 0.0 118.048 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.621 HD22 ' CE2' ' A' ' 50' ' ' PHE . 6.4 tp -90.01 94.55 9.84 Favored 'General case' 0 CA--C 1.492 -1.258 0 O-C-N 128.613 3.695 . . . . 0.0 117.244 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.648 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.366 38.2 t -91.91 126.72 44.47 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-N 108.816 -3.811 . . . . 0.0 111.923 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 4.4 m -131.64 123.74 28.47 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 127.077 2.736 . . . . 0.0 103.795 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.1 t -96.31 119.73 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 110.854 -2.884 . . . . 0.0 112.657 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.544 ' HG3' ' CB ' ' A' ' 105' ' ' ARG 0.307 0.0 OUTLIER -94.68 104.24 16.16 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 110.895 -2.866 . . . . 0.0 107.886 179.647 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.9 106.92 12.52 Favored 'General case' 0 C--O 1.206 -1.227 0 O-C-N 127.27 2.856 . . . . 0.0 110.681 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -120.47 -169.12 13.86 Favored Glycine 0 C--O 1.209 -1.415 0 CA-C-O 124.033 1.907 . . . . 0.0 109.57 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -72.69 -13.39 61.34 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 108.376 -3.912 . . . . 0.0 112.459 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -160.63 -43.24 0.05 OUTLIER 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 117.407 2.373 . . . . 0.0 117.407 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.505 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 28.4 mt-10 -56.04 144.78 27.69 Favored 'General case' 0 C--O 1.208 -1.121 0 O-C-N 126.716 2.51 . . . . 0.0 117.668 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.466 ' O ' HG23 ' A' ' 121' ' ' THR . 94.2 m-20 -127.11 60.56 1.38 Allowed 'General case' 0 N--CA 1.491 1.593 1 CA-C-N 107.597 -4.365 . . . . 0.0 102.0 179.651 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.721 ' NE ' HD22 ' A' ' 24' ' ' LEU . 0.7 OUTLIER -69.32 -15.54 63.36 Favored 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.118 5.261 . . . . 0.0 113.792 -179.667 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.518 ' N ' ' HG2' ' A' ' 98' ' ' GLN . . . -21.11 96.08 0.01 OUTLIER Glycine 0 C--O 1.21 -1.346 2 O-C-N 134.041 7.088 . . . . 0.0 115.351 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.586 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.315 0.0 OUTLIER -114.38 129.77 56.66 Favored 'General case' 0 C--O 1.196 -1.727 1 O-C-N 132.259 5.329 . . . . 0.0 110.389 179.762 . . . . . . . . 5 4 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.9 ptpt -158.03 168.02 28.27 Favored 'General case' 0 C--N 1.354 0.774 1 O-C-N 130.681 4.988 . . . . 0.0 117.91 -178.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.457 ' NE2' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -125.26 172.68 9.36 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 115.2 -2.333 . . . . 0.0 110.799 -179.15 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.464 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER 175.41 71.12 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.977 1 O-C-N 130.222 4.702 . . . . 0.0 117.948 -179.586 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 44.9 t -18.45 116.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.484 -1.583 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -127.18 68.99 1.28 Allowed 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.81 100.61 0.06 OUTLIER Glycine 0 C--O 1.207 -1.537 0 CA-C-O 118.129 -1.373 . . . . 0.0 115.647 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 39.58 41.77 0.81 Allowed 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 10.3 pttm 177.2 170.06 0.56 Allowed 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 128.978 3.924 . . . . 0.0 107.769 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.561 HD23 ' CZ2' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -148.85 121.1 8.37 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 115.362 -2.535 . . . . 0.0 113.038 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.464 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 8.9 m-85 -67.15 154.84 40.26 Favored 'General case' 0 C--N 1.362 1.138 0 CA-C-N 111.374 -2.648 . . . . 0.0 112.895 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.464 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -130.21 39.88 3.6 Favored 'General case' 0 N--CA 1.476 0.833 2 O-C-N 131.418 5.449 . . . . 0.0 106.501 179.632 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 120' ' ' LEU . 0.1 OUTLIER -51.9 122.17 7.89 Favored 'General case' 0 CA--C 1.508 -0.651 0 O-C-N 128.853 3.846 . . . . 0.0 110.889 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.573 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -141.15 168.37 19.94 Favored 'General case' 0 CA--C 1.486 -1.51 1 O-C-N 130.33 4.769 . . . . 0.0 109.579 -179.811 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' ' 126' ' ' VAL . 2.1 t -135.16 175.73 9.32 Favored 'General case' 0 C--O 1.198 -1.621 0 O-C-N 127.112 2.758 . . . . 0.0 105.224 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.6 p 174.2 84.87 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.52 0 O-C-N 124.925 1.391 . . . . 0.0 111.115 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 71.91 39.64 58.89 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-O 123.749 1.749 . . . . 0.0 111.223 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.14 37.05 6.83 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 109.53 -3.335 . . . . 0.0 112.482 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -96.3 -13.3 23.43 Favored 'General case' 0 C--O 1.199 -1.586 0 O-C-N 127.125 2.765 . . . . 0.0 107.851 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.538 ' HA ' ' HA ' ' A' ' 121' ' ' THR . 35.6 m 27.57 60.55 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 C-N-CA 127.505 2.322 . . . . 0.0 115.144 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.0 t -55.02 112.09 0.98 Allowed 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 125.344 1.458 . . . . 0.0 111.793 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 53.4 ttm-85 -105.76 100.88 10.43 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -85.01 173.78 10.26 Favored 'General case' 0 CA--C 1.489 -1.389 0 CA-C-N 112.962 -1.926 . . . . 0.0 113.545 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.449 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 2.2 m -135.88 157.12 38.34 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.464 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 63.6 m-85 -140.96 175.83 9.3 Favored 'General case' 0 CA--C 1.493 -1.215 0 O-C-N 128.196 3.435 . . . . 0.0 115.718 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.293 0.0 OUTLIER -163.96 119.81 1.62 Allowed 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 110.731 -2.941 . . . . 0.0 103.606 179.834 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.563 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 9.2 tttt -53.09 126.17 19.79 Favored 'General case' 0 C--O 1.198 -1.614 0 O-C-N 127.176 2.798 . . . . 0.0 110.72 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.124 0 O-C-N 125.712 1.882 . . . . 0.0 115.972 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.9 -151.16 0.34 Allowed 'General case' 0 C--O 1.206 -1.233 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.5 84.06 0.41 Allowed 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -101.31 81.31 2.19 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -101.11 -83.45 0.45 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 113.725 -3.036 . . . . 0.0 108.127 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.9 113.02 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.733 1 O-C-N 129.191 4.057 . . . . 0.0 114.451 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.56 -130.72 1.84 Allowed Glycine 0 C--O 1.207 -1.569 0 O-C-N 126.52 2.388 . . . . 0.0 112.472 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.494 HG23 HG23 ' A' ' 40' ' ' THR . 1.2 m -174.57 144.01 0.84 Allowed 'General case' 0 C--N 1.314 -0.954 1 O-C-N 130.661 4.389 . . . . 0.0 106.398 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.592 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.2 134.8 22.15 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 111.967 -2.379 . . . . 0.0 114.621 -179.539 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -69.54 -14.81 63.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.599 ' HE2' ' HB2' ' A' ' 41' ' ' LYS . 5.2 ttp 55.2 57.74 5.26 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -17.88 -49.6 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.883 0 O-C-N 128.514 3.634 . . . . 0.0 111.903 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.3 165.39 28.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 110.273 -3.148 . . . . 0.0 111.406 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.24 129.91 11.56 Favored 'General case' 0 CA--C 1.482 -1.651 0 CA-C-N 110.42 -3.082 . . . . 0.0 111.466 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' A' ' 17' ' ' PHE . 7.0 mm-40 -88.46 -174.59 4.65 Favored 'General case' 0 CA--C 1.496 -1.125 1 O-C-N 129.471 4.232 . . . . 0.0 112.119 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 33.24 -81.76 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.55 0 C-N-CA 125.855 1.662 . . . . 0.0 113.763 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.424 ' N ' ' O ' ' A' ' 15' ' ' GLU . 1.4 t80 73.81 -59.39 0.56 Allowed 'General case' 0 C--O 1.203 -1.364 0 O-C-N 126.203 2.189 . . . . 0.0 113.165 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.418 ' OE1' ' N ' ' A' ' 19' ' ' GLY . 0.5 OUTLIER -76.4 -48.86 18.35 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.536 -1.665 . . . . 0.0 115.241 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.471 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.47 -19.92 28.36 Favored Glycine 0 CA--C 1.494 -1.222 0 CA-C-O 116.934 -2.037 . . . . 0.0 112.893 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -36.89 38.96 Favored 'General case' 0 C--O 1.21 -0.983 0 O-C-N 128.13 2.9 . . . . 0.0 106.387 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.595 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -75.45 -25.57 57.56 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 111.048 -2.796 . . . . 0.0 107.554 179.53 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.471 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -79.92 -28.76 39.74 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 129.065 2.946 . . . . 0.0 114.238 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.53 -28.67 66.21 Favored 'General case' 0 N--CA 1.477 0.912 2 O-C-N 130.818 5.074 . . . . 0.0 113.344 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.963 HD11 ' HB ' ' A' ' 26' ' ' ILE . 4.1 pp -103.04 -4.39 24.66 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 127.946 3.279 . . . . 0.0 108.999 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 54.25 82.59 0.09 Allowed 'General case' 0 CA--C 1.484 -1.571 0 C-N-CA 131.027 3.731 . . . . 0.0 114.519 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.963 ' HB ' HD11 ' A' ' 24' ' ' LEU . 16.2 tt -111.65 42.76 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-N 111.501 -2.591 . . . . 0.0 106.883 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.531 ' O ' ' CG ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -47.21 151.53 0.69 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 114.247 -2.787 . . . . 0.0 108.957 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.531 ' CG ' ' O ' ' A' ' 27' ' ' ASP . 4.8 m-30 147.12 -27.68 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.783 1 O-C-N 131.276 5.36 . . . . 0.0 111.28 179.169 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 90.52 73.32 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.542 0 O-C-N 127.049 2.718 . . . . 0.0 108.125 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -26.43 27.76 Favored 'General case' 0 C--O 1.212 -0.899 1 CA-C-N 105.708 -5.224 . . . . 0.0 111.816 179.761 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.412 ' HG2' ' CB ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -89.93 -171.24 3.08 Favored 'General case' 0 C--N 1.319 -0.739 1 O-C-N 129.283 4.114 . . . . 0.0 110.874 -179.925 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 96.64 -37.64 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.415 1 O-C-N 130.905 5.128 . . . . 0.0 112.848 -179.663 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.9 OUTLIER -145.06 34.16 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 128.514 3.634 . . . . 0.0 108.675 -179.753 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -129.57 20.9 5.59 Favored 'General case' 0 C--O 1.206 -1.185 1 CA-C-O 128.63 4.062 . . . . 0.0 111.373 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.27 -40.75 57.57 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-N 108.542 -3.936 . . . . 0.0 110.038 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HD2' ' CB ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -177.47 99.0 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.858 0 CA-C-N 110.562 -3.017 . . . . 0.0 115.717 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.746 HD21 ' N ' ' A' ' 58' ' ' PHE . 1.4 pp -100.08 -1.26 37.3 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 105.41 -2.071 . . . . 0.0 105.41 178.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.577 ' N ' HD12 ' A' ' 37' ' ' LEU . 2.9 m 142.72 128.38 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.161 1 O-C-N 131.098 5.249 . . . . 0.0 110.393 -178.71 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.585 ' HG2' ' HE3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -130.81 140.95 50.31 Favored 'General case' 0 CA--C 1.494 -1.178 0 O-C-N 126.3 2.25 . . . . 0.0 113.321 -179.359 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.494 HG23 HG23 ' A' ' 8' ' ' THR . 38.9 m -156.03 104.13 2.26 Favored 'General case' 0 C--O 1.21 -1.02 0 O-C-N 128.62 3.7 . . . . 0.0 114.371 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.621 ' HE3' HD11 ' A' ' 118' ' ' LEU . 0.0 OUTLIER -96.68 118.96 34.27 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.54 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.8 mp -105.92 155.79 6.83 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 1 O-C-N 129.289 4.118 . . . . 0.0 111.1 179.587 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.54 ' N ' HG22 ' A' ' 42' ' ' ILE 0.307 2.4 tt -132.05 141.18 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.41 0 O-C-N 127.555 3.035 . . . . 0.0 106.486 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.7 t -141.08 85.12 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.752 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.53 131.51 37.6 Favored 'General case' 0 CA--C 1.494 -1.182 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.439 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -140.78 -6.87 1.11 Allowed 'General case' 0 CA--C 1.483 -1.626 0 O-C-N 127.777 3.173 . . . . 0.0 118.06 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 115.21 102.88 2.42 Favored Glycine 0 N--CA 1.474 1.209 0 CA-C-N 120.752 1.615 . . . . 0.0 111.177 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 56.42 26.46 10.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 126.314 1.832 . . . . 0.0 112.102 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -173.5 85.57 0.05 Allowed 'General case' 0 C--O 1.22 -0.475 0 O-C-N 128.235 3.459 . . . . 0.0 112.704 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.683 ' CE1' HD22 ' A' ' 94' ' ' LEU . 35.9 t80 -108.36 119.18 38.75 Favored 'General case' 0 CA--C 1.502 -0.899 0 O-C-N 127.623 3.077 . . . . 0.0 113.99 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -128.15 100.72 5.97 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.536 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -78.21 124.1 27.68 Favored 'General case' 0 C--O 1.217 -0.638 0 O-C-N 129.019 3.95 . . . . 0.0 106.203 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.462 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -132.35 138.22 47.68 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 126.519 2.387 . . . . 0.0 111.232 -179.433 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.7 t -100.1 143.74 29.95 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 125.936 2.023 . . . . 0.0 110.11 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -118.16 37.54 3.97 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 112.148 -2.296 . . . . 0.0 115.626 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.464 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 63.3 m -96.51 106.79 19.1 Favored 'General case' 0 N--CA 1.476 0.864 1 O-C-N 131.643 5.589 . . . . 0.0 106.318 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.5 m -43.69 -48.42 7.88 Favored 'General case' 0 CA--C 1.501 -0.919 0 O-C-N 127.942 3.277 . . . . 0.0 110.761 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.746 ' N ' HD21 ' A' ' 37' ' ' LEU . 0.2 OUTLIER -50.89 -37.2 42.21 Favored 'General case' 0 C--N 1.365 1.245 0 O-C-N 126.421 2.325 . . . . 0.0 111.692 -179.714 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -169.31 124.84 0.87 Allowed 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 129.926 4.516 . . . . 0.0 117.941 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -115.56 79.07 1.24 Allowed 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 111.231 -2.713 . . . . 0.0 108.86 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -62.01 -47.31 85.34 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 126.934 2.646 . . . . 0.0 106.69 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 52.83 123.2 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 130.098 4.624 . . . . 0.0 117.154 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.915 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -86.06 95.04 9.4 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 127.173 2.796 . . . . 0.0 109.256 178.841 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -131.39 92.38 3.17 Favored 'General case' 0 C--O 1.208 -1.105 0 C-N-CA 116.409 -2.116 . . . . 0.0 109.597 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.433 ' CE2' ' HB ' ' A' ' 87' ' ' VAL . 0.1 OUTLIER -143.37 -141.78 0.13 Allowed 'General case' 0 CA--C 1.484 -1.582 0 CA-C-N 112.566 -2.106 . . . . 0.0 111.114 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.608 HG22 HG23 ' A' ' 69' ' ' VAL 0.26 0.8 OUTLIER -158.83 159.79 35.48 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 179.819 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.571 ' HA ' HG22 ' A' ' 87' ' ' VAL . 15.4 t -77.42 144.73 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 O-C-N 125.03 1.457 . . . . 0.0 111.732 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 75.21 1.48 64.12 Favored Glycine 0 CA--C 1.491 -1.434 0 CA-C-N 109.916 -3.311 . . . . 0.0 116.397 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.608 HG23 HG22 ' A' ' 66' ' ' THR 0.305 1.4 t -67.54 -45.77 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 CA-C-N 112.374 -1.913 . . . . 0.0 107.527 -179.944 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 72.9 92.3 0.08 Allowed 'General case' 0 C--N 1.353 0.72 0 CA-C-N 109.613 -3.449 . . . . 0.0 109.898 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.537 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.5 m-30 -71.55 82.82 0.83 Allowed 'General case' 0 C--N 1.356 0.879 0 O-C-N 128.085 3.366 . . . . 0.0 111.013 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 12.7 p30 -56.22 79.29 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 113.707 -1.588 . . . . 0.0 111.736 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 1.4 mt-10 56.38 89.71 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 123.182 1.468 . . . . 0.0 109.936 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.4 ' CD2' ' CE2' ' A' ' 71' ' ' PHE . 1.3 t60 -163.68 98.44 0.88 Allowed 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 111.69 -2.505 . . . . 0.0 115.107 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.42 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -127.81 -60.61 1.15 Allowed 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.33 -1.305 . . . . 0.0 111.139 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.437 ' HA ' ' HA2' ' A' ' 80' ' ' GLY . 0.1 OUTLIER 49.27 -178.86 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 128.428 3.966 . . . . 0.0 116.248 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.55 -84.7 0.27 Allowed Glycine 0 C--O 1.211 -1.326 0 CA-C-N 108.833 -3.803 . . . . 0.0 112.747 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.502 ' O ' HD12 ' A' ' 26' ' ' ILE . 5.4 tp -57.72 -60.98 2.87 Favored 'General case' 0 N--CA 1.451 -0.376 1 CA-C-N 107.481 -4.359 . . . . 0.0 114.285 179.874 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.662 ' HB2' HD13 ' A' ' 24' ' ' LEU . 8.1 t0 -115.09 -54.79 2.53 Favored 'General case' 0 CA--C 1.494 -1.187 0 O-C-N 126.928 2.642 . . . . 0.0 110.594 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 76' ' ' LYS . . . 68.64 89.25 0.07 OUTLIER Glycine 0 N--CA 1.473 1.129 0 CA-C-N 112.133 -2.303 . . . . 0.0 111.651 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.402 ' HD3' ' HA ' ' A' ' 81' ' ' ARG . 12.9 tpp85 -129.4 -131.65 0.21 Allowed 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 111.743 -2.228 . . . . 0.0 112.139 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.491 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 6.9 p-10 -164.09 81.05 0.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 117.997 -1.481 . . . . 0.0 107.729 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.466 HG12 ' C ' ' A' ' 99' ' ' LYS . 0.1 OUTLIER -126.31 133.41 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.505 0 N-CA-C 118.754 2.872 . . . . 0.0 118.754 -179.36 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.446 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -61.53 90.36 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.705 0 O-C-N 128.595 3.684 . . . . 0.0 107.421 179.13 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.537 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 94.6 m -86.73 58.14 4.89 Favored 'General case' 0 C--O 1.201 -1.49 0 CA-C-N 109.648 -3.433 . . . . 0.0 113.818 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.595 HD21 ' OG1' ' A' ' 88' ' ' THR . 8.4 tt -62.82 144.6 56.41 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 109.141 -3.663 . . . . 0.0 112.81 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.571 HG22 ' HA ' ' A' ' 67' ' ' VAL . 2.0 p -130.7 132.76 64.08 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 CA-C-N 110.812 -2.904 . . . . 0.0 109.466 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.595 ' OG1' HD21 ' A' ' 86' ' ' LEU 0.256 90.1 m -153.82 169.63 22.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 111.477 -2.601 . . . . 0.0 110.716 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.624 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 23.8 m95 -98.38 138.96 34.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 C-N-CA 128.55 2.74 . . . . 0.0 106.22 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.671 ' HB2' HG23 ' A' ' 95' ' ' VAL . 1.6 tt0 -95.96 -47.08 6.27 Favored 'General case' 0 CA--C 1.479 -1.773 1 CA-C-O 128.776 4.131 . . . . 0.0 116.292 -179.55 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -176.43 -51.65 0.06 OUTLIER Glycine 0 C--O 1.197 -2.196 0 CA-C-N 109.302 -3.59 . . . . 0.0 106.333 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.01 31.49 1.78 Allowed 'General case' 0 C--O 1.209 -1.036 1 O-C-N 131.945 5.144 . . . . 0.0 111.176 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.4 ' O ' ' N ' ' A' ' 90' ' ' GLU . 0.8 OUTLIER -167.83 165.46 13.97 Favored 'General case' 0 C--O 1.202 -1.425 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.683 HD22 ' CE1' ' A' ' 50' ' ' PHE . 2.1 tp -95.12 86.17 4.52 Favored 'General case' 0 C--O 1.204 -1.314 0 CA-C-N 111.138 -2.756 . . . . 0.0 117.477 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.671 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.344 2.5 t -82.25 125.82 39.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.737 0 CA-C-N 109.653 -3.43 . . . . 0.0 111.976 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.429 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 14.3 m -132.49 129.13 38.77 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 125.727 2.679 . . . . 0.0 105.24 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -114.19 77.57 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.58 0 CA-C-N 110.754 -2.93 . . . . 0.0 118.902 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.414 ' HB3' ' HB2' ' A' ' 105' ' ' ARG . 2.3 tt0 -60.62 111.44 1.61 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 119.682 -1.886 . . . . 0.0 108.088 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.466 ' C ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.27 143.5 35.96 Favored 'General case' 0 C--O 1.195 -1.813 0 C-N-CA 113.744 -3.182 . . . . 0.0 113.306 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 146.39 137.87 3.1 Favored Glycine 0 C--O 1.213 -1.159 0 C-N-CA 119.259 -1.448 . . . . 0.0 111.032 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 66.88 -59.92 0.36 Allowed 'General case' 0 C--N 1.353 0.753 0 CA-C-N 110.206 -2.997 . . . . 0.0 112.179 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.19 -31.81 0.05 Allowed 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.29 146.69 54.31 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 125.879 2.752 . . . . 0.0 117.311 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.404 ' O ' ' N ' ' A' ' 122' ' ' CYS . 11.6 m-20 -127.25 78.97 1.85 Allowed 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.224 -4.989 . . . . 0.0 101.683 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.414 ' HB2' ' HB3' ' A' ' 98' ' ' GLN . 6.9 mmm180 -98.42 3.11 48.39 Favored 'General case' 0 C--O 1.199 -1.602 1 O-C-N 131.078 5.237 . . . . 0.0 112.664 -179.634 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -33.56 85.66 0.01 OUTLIER Glycine 0 N--CA 1.428 -1.884 2 O-C-N 133.004 6.44 . . . . 0.0 114.929 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.915 ' CZ2' HD21 ' A' ' 63' ' ' LEU 0.273 0.0 OUTLIER -97.42 129.56 44.63 Favored 'General case' 0 C--O 1.197 -1.669 0 O-C-N 129.934 3.961 . . . . 0.0 109.807 179.308 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.03 156.67 36.33 Favored 'General case' 0 C--O 1.211 -0.942 0 O-C-N 129.011 3.944 . . . . 0.0 115.951 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.431 ' NE2' ' CD1' ' A' ' 107' ' ' TRP 0.299 39.2 mm-40 -114.05 165.97 12.09 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 111.201 -2.727 . . . . 0.0 110.927 -177.936 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -175.76 95.71 0.06 Allowed 'General case' 0 C--O 1.213 -0.858 1 O-C-N 129.986 4.553 . . . . 0.0 116.009 177.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.415 HG23 ' H ' ' A' ' 111' ' ' VAL . 48.3 t -38.85 98.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.91 0 CA-C-O 127.036 3.303 . . . . 0.0 112.277 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -104.2 56.19 0.72 Allowed 'General case' 0 CA--C 1.488 -1.408 0 CA-C-N 109.361 -3.563 . . . . 0.0 117.235 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 105.17 -111.61 3.79 Favored Glycine 0 C--O 1.205 -1.712 0 CA-C-N 113.593 -1.639 . . . . 0.0 113.09 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -112.74 19.36 17.49 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 117.413 2.375 . . . . 0.0 117.413 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 131' ' ' PHE . 4.5 pttt -158.91 163.43 36.56 Favored 'General case' 0 N--CA 1.476 0.825 2 O-C-N 131.189 5.306 . . . . 0.0 109.807 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.488 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 4.8 mt -105.39 173.13 6.44 Favored 'General case' 0 CA--C 1.494 -1.206 0 O-C-N 127.104 2.753 . . . . 0.0 112.503 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -133.9 93.73 3.15 Favored 'General case' 0 C--O 1.206 -1.206 0 O-C-N 127.95 3.281 . . . . 0.0 113.803 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.657 HD13 ' CZ ' ' A' ' 131' ' ' PHE . 2.3 mp -79.6 70.93 6.17 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 111.467 -2.606 . . . . 0.0 106.479 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -85.6 108.14 17.84 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 127.387 2.929 . . . . 0.0 109.075 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.505 HD21 ' HB3' ' A' ' 127' ' ' CYS . 0.6 OUTLIER -126.28 177.78 6.22 Favored 'General case' 0 N--CA 1.484 1.275 1 O-C-N 130.091 4.619 . . . . 0.0 113.013 179.83 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.1 m -125.76 170.55 11.46 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 110.593 -3.003 . . . . 0.0 105.364 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER -169.37 38.37 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 123.888 1.804 . . . . 0.0 111.592 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 117.18 -67.3 0.32 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 112.735 -2.03 . . . . 0.0 108.257 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -173.8 43.34 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.005 0 CA-C-N 109.661 -3.269 . . . . 0.0 109.932 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -120.86 4.89 10.49 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 111.669 -2.514 . . . . 0.0 110.006 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 126' ' ' VAL . 8.0 p 6.67 71.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 O-C-N 128.433 3.583 . . . . 0.0 114.925 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.505 ' HB3' HD21 ' A' ' 120' ' ' LEU . 0.5 OUTLIER -66.11 142.82 57.64 Favored 'General case' 0 C--O 1.219 -0.538 0 O-C-N 120.441 -1.412 . . . . 0.0 111.142 -179.532 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.61 147.54 48.68 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 128.432 3.583 . . . . 0.0 110.949 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -122.7 171.06 9.43 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 118.312 -1.355 . . . . 0.0 112.654 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.15 138.3 30.15 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.422 0 N-CA-C 103.543 -2.762 . . . . 0.0 103.543 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.657 ' CZ ' HD13 ' A' ' 118' ' ' LEU . 45.5 m-85 -126.31 179.97 5.03 Favored 'General case' 0 CA--C 1.488 -1.426 0 CA-C-O 128.149 3.833 . . . . 0.0 117.965 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER -161.89 113.35 1.68 Allowed 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 111.196 -2.729 . . . . 0.0 103.773 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.592 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 33.3 ttpt -58.07 89.77 0.01 OUTLIER 'General case' 0 C--O 1.194 -1.867 0 O-C-N 126.654 2.471 . . . . 0.0 115.299 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt . . . . . 0 C--O 1.26 1.616 0 O-C-N 127.866 3.229 . . . . 0.0 117.906 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.507 2.415 0 CA-C-O 123.052 1.406 . . . . 0.0 109.886 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.4 m -146.4 -54.47 0.26 Allowed 'General case' 0 C--O 1.21 -1.013 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.494 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -140.04 -175.5 4.26 Favored 'General case' 0 CA--C 1.491 -1.326 0 C-N-CA 116.268 -2.173 . . . . 0.0 113.096 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -72.02 -151.86 0.02 OUTLIER 'General case' 0 C--O 1.24 0.562 0 N-CA-C 104.531 -2.396 . . . . 0.0 104.531 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -171.14 135.89 1.03 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 103.28 -2.859 . . . . 0.0 103.28 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -51.43 124.76 12.71 Favored 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 131.456 5.472 . . . . 0.0 113.345 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.11 -173.95 43.97 Favored Glycine 0 C--O 1.206 -1.647 0 CA-C-O 116.426 -2.319 . . . . 0.0 113.895 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.702 HG23 HG23 ' A' ' 40' ' ' THR . 1.2 m -127.18 124.37 38.86 Favored 'General case' 0 C--O 1.209 -1.036 1 O-C-N 132.911 5.712 . . . . 0.0 104.937 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.509 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -118.0 90.35 3.31 Favored 'General case' 0 CA--C 1.493 -1.249 1 O-C-N 129.224 4.077 . . . . 0.0 114.467 179.882 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.57 100.19 0.05 OUTLIER 'General case' 0 C--O 1.218 -0.579 0 O-C-N 126.901 2.626 . . . . 0.0 108.039 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.408 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -33.37 -58.04 0.4 Allowed 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.04 3.337 . . . . 0.0 107.335 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 90.37 -28.21 0.04 OUTLIER 'General case' 0 C--O 1.199 -1.603 1 O-C-N 131.818 5.699 . . . . 0.0 111.006 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.256 3.3 p -175.7 177.25 1.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 124.513 2.102 . . . . 0.0 110.882 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -146.08 168.86 19.9 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 108.828 -3.805 . . . . 0.0 111.458 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -102.18 -107.09 0.25 Allowed 'General case' 0 CA--C 1.477 -1.841 2 O-C-N 133.237 6.586 . . . . 0.0 111.828 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -84.77 87.03 7.28 Favored 'General case' 0 C--O 1.21 -1.013 0 O-C-N 118.783 -2.448 . . . . 0.0 110.464 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.44 -52.23 65.45 Favored 'General case' 0 C--O 1.207 -1.176 0 CA-C-O 127.584 3.564 . . . . 0.0 112.62 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.469 ' CG ' ' HG3' ' A' ' 31' ' ' ARG . 1.1 mp0 -62.06 -51.79 66.54 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 112.297 -2.229 . . . . 0.0 116.379 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.483 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -53.07 -21.65 11.23 Favored Glycine 0 CA--C 1.484 -1.86 1 O-C-N 129.563 4.289 . . . . 0.0 113.651 -179.931 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.456 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -73.81 -45.7 49.81 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 126.237 2.922 . . . . 0.0 105.654 179.615 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.519 ' O ' HG22 ' A' ' 26' ' ' ILE . 24.6 mtm -71.73 -25.38 62.04 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 112.543 -2.117 . . . . 0.0 112.066 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.483 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 1.0 OUTLIER -79.73 -33.92 40.42 Favored 'General case' 0 C--O 1.215 -0.753 0 O-C-N 128.024 3.327 . . . . 0.0 114.989 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.97 78.0 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 109.462 -3.517 . . . . 0.0 113.675 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.661 HD12 ' O ' ' A' ' 24' ' ' LEU . 1.1 pp -84.19 -7.15 59.44 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 128.304 3.502 . . . . 0.0 108.093 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 46.35 93.67 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.59 0 CA-C-O 127.269 3.414 . . . . 0.0 111.105 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.519 HG22 ' O ' ' A' ' 21' ' ' MET . 19.7 tt -111.07 28.45 2.07 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 1 CA-C-O 129.093 4.282 . . . . 0.0 108.869 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.443 ' C ' ' CD1' ' A' ' 28' ' ' PHE . 30.5 m-20 77.03 53.35 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 CA-C-N 108.637 -3.892 . . . . 0.0 110.427 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.605 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER 12.15 69.97 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.104 1 O-C-N 130.319 4.762 . . . . 0.0 117.374 179.036 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.87 -175.01 2.91 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 112.591 -2.095 . . . . 0.0 106.677 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.474 HG21 HH21 ' A' ' 59' ' ' ARG . 3.2 m 93.57 -20.51 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 2 O-C-N 132.95 6.406 . . . . 0.0 114.707 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.511 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -77.53 -171.4 2.14 Favored 'General case' 0 N--CA 1.44 -0.936 1 O-C-N 130.83 5.081 . . . . 0.0 110.839 179.737 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.3 OUTLIER 75.75 21.26 1.69 Allowed 'General case' 0 CA--C 1.498 -1.034 0 O-C-N 128.749 3.78 . . . . 0.0 113.643 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.501 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -170.12 -40.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 O-C-N 128.917 3.886 . . . . 0.0 113.268 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.492 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -72.77 -12.91 61.19 Favored 'General case' 0 C--O 1.209 -1.048 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.56 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -15.03 -48.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 O-C-N 128.789 3.806 . . . . 0.0 114.659 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 14.7 tpt180 -177.79 144.56 0.37 Allowed 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 127.321 2.888 . . . . 0.0 115.219 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.788 ' C ' HD12 ' A' ' 37' ' ' LEU . 1.1 pp -175.52 147.96 0.88 Allowed 'General case' 0 CA--C 1.539 0.532 2 O-C-N 130.675 4.984 . . . . 0.0 109.005 178.73 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 m 1.97 58.42 0.0 OUTLIER 'General case' 0 CA--C 1.482 -1.653 1 O-C-N 133.467 6.729 . . . . 0.0 112.982 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -74.19 137.94 43.44 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -179.332 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.702 HG23 HG23 ' A' ' 8' ' ' THR . 2.9 m -150.6 124.28 9.13 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 109.524 -3.489 . . . . 0.0 114.782 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.68 ' NZ ' HD21 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -109.99 156.85 19.95 Favored 'General case' 0 N--CA 1.49 1.553 1 O-C-N 129.55 4.281 . . . . 0.0 101.938 179.044 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.53 HD12 ' HG2' ' A' ' 53' ' ' LYS . 66.3 mt -149.18 157.71 6.68 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 O-C-N 126.717 2.511 . . . . 0.0 112.198 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.503 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -142.02 135.79 29.24 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 109.014 -3.721 . . . . 0.0 105.981 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.1 t -119.35 -32.62 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.194 0 CA-C-N 112.032 -2.349 . . . . 0.0 116.449 -178.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 23.45 72.09 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -18.75 64.89 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 108.705 -3.861 . . . . 0.0 110.744 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.96 -95.92 0.16 Allowed Glycine 0 C--O 1.2 -2.016 0 CA-C-N 113.637 -1.619 . . . . 0.0 114.23 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -82.05 -27.44 32.99 Favored 'General case' 0 C--O 1.22 -0.497 0 O-C-N 125.874 1.573 . . . . 0.0 111.124 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.7 99.22 11.09 Favored 'General case' 0 CA--C 1.54 0.591 1 O-C-N 129.601 4.313 . . . . 0.0 108.462 179.32 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.554 ' CD2' HD13 ' A' ' 94' ' ' LEU . 90.5 t80 -100.38 104.16 15.58 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 128.447 3.592 . . . . 0.0 114.526 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 36.9 mttm -125.72 83.03 2.12 Favored 'General case' 0 CA--C 1.496 -1.115 1 O-C-N 129.181 4.051 . . . . 0.0 119.097 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.682 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.09 151.85 46.4 Favored 'General case' 0 C--N 1.362 1.146 1 O-C-N 129.281 4.113 . . . . 0.0 106.373 179.664 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.53 ' HG2' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -144.84 165.44 28.12 Favored 'General case' 0 CA--C 1.49 -1.342 0 C-N-CA 115.328 -2.549 . . . . 0.0 111.901 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -129.8 137.05 50.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 125.234 2.445 . . . . 0.0 108.171 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -119.7 51.15 1.19 Allowed 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 110.799 -2.91 . . . . 0.0 115.725 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.45 115.05 27.69 Favored 'General case' 0 N--CA 1.483 1.192 1 O-C-N 133.832 6.957 . . . . 0.0 105.178 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.3 p -45.11 -44.36 10.46 Favored 'General case' 0 CA--C 1.511 -0.541 1 O-C-N 129.361 4.163 . . . . 0.0 110.296 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.742 ' CE2' HD23 ' A' ' 37' ' ' LEU . 6.3 m-85 -48.75 -71.57 0.06 Allowed 'General case' 0 C--N 1.366 1.311 0 O-C-N 128.433 3.583 . . . . 0.0 110.499 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.474 HH21 HG21 ' A' ' 30' ' ' THR . 9.2 mmt180 -128.44 133.29 48.51 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-N 108.876 -3.784 . . . . 0.0 113.257 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -136.39 83.53 2.01 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 126.821 2.576 . . . . 0.0 107.32 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -99.37 -37.37 9.26 Favored 'General case' 0 C--N 1.32 -0.677 0 O-C-N 127.952 3.283 . . . . 0.0 108.672 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.63 152.01 0.06 Allowed 'General case' 0 C--O 1.199 -1.556 0 O-C-N 128.527 3.642 . . . . 0.0 116.684 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.682 ' HB2' HG22 ' A' ' 52' ' ' THR . 7.3 tp -99.33 73.88 1.9 Allowed 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 112.577 -2.101 . . . . 0.0 110.908 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.86 100.26 9.49 Favored 'General case' 0 CA--C 1.487 -1.449 0 O-C-N 126.998 2.686 . . . . 0.0 113.148 -179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.53 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 21.0 m-85 -127.01 -175.23 3.36 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 126.093 2.854 . . . . 0.0 106.994 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -134.75 115.24 13.51 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.351 -3.203 . . . . 0.0 102.351 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.54 HG21 ' CD1' ' A' ' 89' ' ' TRP . 2.4 p -46.72 123.84 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.483 -1.616 0 O-C-N 126.954 2.659 . . . . 0.0 116.083 -179.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 60.8 53.8 42.24 Favored Glycine 0 CA--C 1.487 -1.683 0 O-C-N 127.324 2.89 . . . . 0.0 117.923 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 69' ' ' VAL 0.277 1.8 p -122.26 10.25 5.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.354 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 52.44 72.9 0.37 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.377 5.423 . . . . 0.0 108.308 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.531 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 7.7 t80 -63.71 82.16 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.066 0 CA-C-N 108.582 -3.917 . . . . 0.0 118.325 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -65.13 84.94 0.05 Allowed 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 123.436 1.588 . . . . 0.0 109.417 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.534 ' HG2' HG23 ' A' ' 75' ' ' THR . 32.3 tt0 -71.14 148.91 46.92 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-O 124.819 2.247 . . . . 0.0 108.168 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 82' ' ' ASN . 2.9 m80 -140.6 59.39 1.55 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-N 110.257 -3.156 . . . . 0.0 109.852 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.534 HG23 ' HG2' ' A' ' 73' ' ' GLU . 27.9 p -35.22 146.65 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 110.391 -3.095 . . . . 0.0 114.73 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.81 144.04 0.07 Allowed 'General case' 0 C--O 1.212 -0.911 0 O-C-N 128.994 3.934 . . . . 0.0 111.396 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.91 2.48 64.66 Favored Glycine 0 C--O 1.205 -1.675 0 CA-C-N 111.55 -2.568 . . . . 0.0 107.43 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 tp -147.99 -57.86 0.24 Allowed 'General case' 0 CA--C 1.506 -0.72 1 O-C-N 131.185 4.697 . . . . 0.0 117.266 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -111.13 -62.59 1.52 Allowed 'General case' 0 CA--C 1.502 -0.875 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.06 64.79 1.29 Allowed Glycine 0 N--CA 1.476 1.365 0 CA-C-O 126.171 3.095 . . . . 0.0 109.808 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.42 ' N ' ' OG1' ' A' ' 75' ' ' THR . 5.4 tpt180 -145.75 -131.63 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 109.166 -3.517 . . . . 0.0 112.635 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.443 ' HA ' ' HA ' ' A' ' 74' ' ' HIS . 1.2 p-10 -164.15 -100.78 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 115.114 -2.374 . . . . 0.0 108.294 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.418 HG13 ' C ' ' A' ' 99' ' ' LYS . 21.2 t 91.82 146.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 O-C-N 128.544 3.653 . . . . 0.0 117.027 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.86 87.31 6.6 Favored 'General case' 0 C--O 1.219 -0.522 2 O-C-N 129.398 4.186 . . . . 0.0 107.289 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.531 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 61.7 m -96.41 86.15 4.1 Favored 'General case' 0 C--O 1.202 -1.404 0 O-C-N 128.229 3.456 . . . . 0.0 112.091 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 tp -87.24 94.69 9.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 108.595 -3.911 . . . . 0.0 116.259 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.2 t -74.4 141.74 15.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 O-C-N 119.586 -1.946 . . . . 0.0 108.763 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.587 HG23 ' HB ' ' A' ' 95' ' ' VAL . 9.3 t -164.04 172.73 13.44 Favored 'General case' 0 CA--C 1.488 -1.43 0 CA-C-O 126.87 3.224 . . . . 0.0 110.833 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.696 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 49.7 m95 -98.71 136.93 38.05 Favored 'General case' 0 N--CA 1.437 -1.101 0 O-C-N 117.916 -2.99 . . . . 0.0 109.377 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 1.034 ' HB2' HG23 ' A' ' 93' ' ' THR . 0.3 OUTLIER -93.1 -11.15 33.64 Favored 'General case' 0 CA--C 1.475 -1.94 1 CA-C-O 133.642 6.449 . . . . 0.0 113.966 179.569 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.34 -42.18 1.33 Allowed Glycine 0 C--O 1.198 -2.152 1 CA-C-N 107.588 -4.369 . . . . 0.0 104.594 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.406 ' C ' HG22 ' A' ' 93' ' ' THR . 0.2 OUTLIER -152.85 60.8 0.79 Allowed 'General case' 0 C--O 1.204 -1.312 1 O-C-N 131.594 4.938 . . . . 0.0 110.577 -179.768 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . 1.034 HG23 ' HB2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.91 130.5 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.124 0 O-C-N 127.084 2.74 . . . . 0.0 118.048 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.554 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -74.13 92.32 2.18 Favored 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 130.323 4.765 . . . . 0.0 110.758 179.787 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.945 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.284 79.5 t -90.36 140.6 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 1 O-C-N 130.655 4.972 . . . . 0.0 115.248 -179.75 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.45 ' HB3' ' CZ3' ' A' ' 107' ' ' TRP . 4.5 t -143.95 122.71 12.63 Favored 'General case' 0 C--O 1.195 -1.778 0 O-C-N 125.573 1.796 . . . . 0.0 106.328 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.4 t -101.34 105.2 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.862 0 CA-C-N 111.172 -2.74 . . . . 0.0 111.902 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.509 ' NE2' ' HB3' ' A' ' 105' ' ' ARG . 5.1 mt-30 -86.29 100.79 12.53 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 123.822 1.772 . . . . 0.0 109.88 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.418 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.4 OUTLIER -97.12 96.75 8.67 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 110.037 -3.256 . . . . 0.0 110.507 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -93.29 -97.67 1.48 Allowed Glycine 0 C--O 1.206 -1.646 0 CA-C-N 112.719 -2.037 . . . . 0.0 110.891 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.64 -53.17 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 108.974 -3.613 . . . . 0.0 109.244 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -94.02 -39.61 10.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 111.047 -2.797 . . . . 0.0 112.833 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -115.96 146.63 41.94 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 111.163 -2.744 . . . . 0.0 114.899 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -106.07 97.54 7.34 Favored 'General case' 0 N--CA 1.478 0.957 2 O-C-N 130.29 4.743 . . . . 0.0 102.9 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.509 ' HB3' ' NE2' ' A' ' 98' ' ' GLN . 0.1 OUTLIER -101.5 5.46 41.89 Favored 'General case' 0 C--O 1.214 -0.781 1 O-C-N 130.483 4.864 . . . . 0.0 110.065 -179.724 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.464 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -45.75 93.68 0.01 OUTLIER Glycine 0 N--CA 1.426 -2.012 2 O-C-N 132.393 6.058 . . . . 0.0 114.277 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.597 ' HZ2' HD21 ' A' ' 63' ' ' LEU 0.289 0.0 OUTLIER -108.24 136.32 48.09 Favored 'General case' 0 C--O 1.214 -0.802 1 O-C-N 132.262 5.331 . . . . 0.0 110.304 179.808 . . . . . . . . 5 4 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.39 159.33 43.52 Favored 'General case' 0 CA--C 1.506 -0.728 1 O-C-N 131.121 5.263 . . . . 0.0 113.391 -178.637 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.532 ' HG2' ' HG ' ' A' ' 118' ' ' LEU 0.279 1.8 mp0 -134.04 123.53 24.68 Favored 'General case' 0 C--N 1.368 1.371 0 C-N-CA 115.999 -2.28 . . . . 0.0 111.172 -178.393 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.516 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -117.46 171.32 8.07 Favored 'General case' 0 CA--C 1.498 -1.031 0 O-C-N 128.987 3.93 . . . . 0.0 112.163 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.1 t -109.57 98.81 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.905 0 CA-C-O 124.499 2.095 . . . . 0.0 112.443 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -108.14 85.68 2.16 Favored 'General case' 0 CA--C 1.479 -1.766 0 CA-C-O 125.816 2.722 . . . . 0.0 113.317 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 90.25 -109.28 3.63 Favored Glycine 0 C--O 1.2 -2.024 0 CA-C-N 113.027 -1.897 . . . . 0.0 115.439 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -105.93 -7.78 17.99 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 114.572 -2.632 . . . . 0.0 113.829 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -127.1 174.06 9.2 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 133.132 6.52 . . . . 0.0 110.227 179.954 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.68 HD21 ' NZ ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -136.43 128.26 29.21 Favored 'General case' 0 C--O 1.202 -1.429 0 O-C-N 124.787 1.305 . . . . 0.0 110.517 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.516 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.1 m-85 -78.57 167.17 21.66 Favored 'General case' 0 C--O 1.202 -1.44 0 O-C-N 128.618 3.699 . . . . 0.0 110.11 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.565 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -140.45 59.54 1.55 Allowed 'General case' 0 CA--C 1.509 -0.624 1 CA-C-N 107.291 -4.504 . . . . 0.0 108.079 -179.845 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.2 109.26 1.48 Allowed 'General case' 0 CA--C 1.506 -0.722 0 O-C-N 127.525 3.016 . . . . 0.0 110.525 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.13 148.98 39.75 Favored 'General case' 0 CA--C 1.487 -1.461 1 O-C-N 130.044 4.59 . . . . 0.0 109.902 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 45.5 m -118.47 162.03 19.02 Favored 'General case' 0 C--O 1.208 -1.113 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -161.25 33.52 0.14 Allowed 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 124.2 1.952 . . . . 0.0 113.941 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 104.04 -94.49 1.08 Allowed Glycine 0 CA--C 1.505 -0.531 0 CA-C-N 111.428 -2.624 . . . . 0.0 112.272 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.85 -31.58 45.69 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 112.171 -2.014 . . . . 0.0 111.625 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -103.33 176.87 5.01 Favored 'General case' 0 C--O 1.214 -0.785 1 O-C-N 129.104 4.003 . . . . 0.0 109.332 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.1 m -156.19 87.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 CA-C-N 108.842 -3.799 . . . . 0.0 111.672 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 t -66.49 113.71 4.93 Favored 'General case' 0 CA--C 1.489 -1.392 0 C-N-CA 125.58 1.552 . . . . 0.0 112.765 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.73 93.58 9.31 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 117.612 -1.635 . . . . 0.0 110.858 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.501 ' OE1' HD13 ' A' ' 118' ' ' LEU . 51.6 mt-30 -75.82 165.54 24.86 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 117.532 2.419 . . . . 0.0 117.532 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.508 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -132.46 150.11 32.97 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.428 0 CA-C-O 124.373 2.035 . . . . 0.0 109.058 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.565 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 88.7 m-85 -148.89 175.13 11.53 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 110.854 -2.884 . . . . 0.0 116.509 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.492 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -155.78 137.05 13.88 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 111.9 -2.409 . . . . 0.0 104.98 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.443 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 5.7 ttpt -77.74 94.91 4.54 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 118.185 2.661 . . . . 0.0 118.185 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt . . . . . 0 C--O 1.259 1.557 0 CA-C-O 114.895 -2.479 . . . . 0.0 116.852 179.857 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mtt . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.577 HG22 ' HB3' ' A' ' 92' ' ' ASN . 1.3 p -110.82 177.92 4.52 Favored 'General case' 0 C--O 1.205 -1.271 0 O-C-N 127.642 3.089 . . . . 0.0 110.784 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 mttt 55.87 76.99 0.25 Allowed 'General case' 0 CA--C 1.492 -1.275 0 O-C-N 126.878 2.611 . . . . 0.0 114.974 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -67.92 -53.36 27.0 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.24 169.67 0.3 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.956 2.66 . . . . 0.0 107.468 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 26.31 120.04 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.43 1 O-C-N 129.361 4.163 . . . . 0.0 117.876 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -169.51 -128.32 1.0 Allowed Glycine 0 CA--C 1.532 1.112 0 CA-C-N 112.267 -2.242 . . . . 0.0 114.2 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.538 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 3.7 t 168.63 147.74 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.948 1 O-C-N 133.323 5.954 . . . . 0.0 106.479 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.538 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -145.72 103.02 3.74 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.496 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' N ' ' A' ' 12' ' ' GLU 0.259 1.8 mt-10 -64.56 92.49 0.09 Allowed 'General case' 0 C--O 1.213 -0.861 0 O-C-N 126.72 2.513 . . . . 0.0 108.52 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.594 ' HG3' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -42.26 96.01 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 1 O-C-N 130.227 4.704 . . . . 0.0 103.81 -179.917 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' GLU . 27.8 tt0 -35.81 -37.45 0.1 Allowed 'General case' 0 C--O 1.21 -1.014 1 O-C-N 130.383 4.802 . . . . 0.0 107.403 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.263 4.6 p 173.55 141.08 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 110.723 -2.944 . . . . 0.0 110.327 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -96.69 130.37 43.93 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 111.746 -2.479 . . . . 0.0 110.913 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -116.77 140.64 49.2 Favored 'General case' 0 CA--C 1.499 -1.01 0 O-C-N 128.047 3.342 . . . . 0.0 110.563 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 49.53 69.7 0.57 Allowed 'General case' 0 C--O 1.205 -1.287 0 CA-C-O 126.146 2.879 . . . . 0.0 109.963 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -95.38 -40.44 9.51 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 111.41 -2.632 . . . . 0.0 107.974 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -74.93 -39.13 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 111.183 -2.735 . . . . 0.0 111.089 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.09 -26.72 73.95 Favored Glycine 0 CA--C 1.487 -1.708 0 O-C-N 127.187 2.805 . . . . 0.0 110.771 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -71.61 -31.69 67.18 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 124.961 2.315 . . . . 0.0 109.054 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 12.0 mtt -75.11 -27.04 59.68 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.874 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -79.91 -31.24 40.15 Favored 'General case' 0 C--N 1.317 -0.814 1 O-C-N 133.475 6.734 . . . . 0.0 114.92 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.82 91.38 Favored 'General case' 0 C--O 1.208 -1.086 2 O-C-N 130.835 5.084 . . . . 0.0 113.621 -179.636 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.718 HD11 ' HB ' ' A' ' 26' ' ' ILE . 1.5 pp -103.09 -8.26 20.67 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 110.623 -2.99 . . . . 0.0 109.543 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 49.17 99.18 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.155 1 CA-C-O 128.565 4.031 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.718 ' HB ' HD11 ' A' ' 24' ' ' LEU . 7.3 tt -124.53 42.67 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 109.556 -3.474 . . . . 0.0 109.537 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 76.45 137.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.441 0 CA-C-N 110.339 -3.118 . . . . 0.0 107.479 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -106.0 -172.64 2.13 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 116.42 2.008 . . . . 0.0 116.42 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 58.03 30.85 19.85 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 124.443 2.068 . . . . 0.0 106.343 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.429 ' O ' HD11 ' A' ' 33' ' ' ILE . 0.5 OUTLIER -101.84 -16.05 16.7 Favored 'General case' 0 C--O 1.209 -1.057 1 CA-C-N 107.783 -4.281 . . . . 0.0 115.115 -179.916 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -86.57 -172.43 4.02 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 128.893 3.87 . . . . 0.0 109.949 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.46 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER 82.71 7.84 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 O-C-N 129.05 3.968 . . . . 0.0 113.254 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.429 HD11 ' O ' ' A' ' 30' ' ' THR . 0.3 OUTLIER -147.21 -41.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 128.561 3.663 . . . . 0.0 111.0 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.407 ' H ' HD12 ' A' ' 33' ' ' ILE . . . -90.5 24.93 2.44 Favored 'General case' 0 C--O 1.209 -1.032 0 CA-C-O 123.637 1.684 . . . . 0.0 113.865 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.436 ' C ' ' HD3' ' A' ' 36' ' ' ARG . 66.7 t -55.36 -27.41 20.48 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.399 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.203 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.436 ' HD3' ' C ' ' A' ' 35' ' ' VAL . 1.6 mpt_? 140.01 134.1 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.862 2 O-C-N 130.621 4.95 . . . . 0.0 108.975 179.141 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.516 ' CD2' ' CG ' ' A' ' 58' ' ' PHE . 0.3 OUTLIER -102.54 15.36 29.46 Favored 'General case' 0 N--CA 1.439 -1.019 2 O-C-N 130.377 4.798 . . . . 0.0 111.184 -179.703 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 173.54 -53.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.316 1 O-C-N 132.125 5.891 . . . . 0.0 111.113 179.64 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 67.94 140.29 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 O-C-N 127.488 2.993 . . . . 0.0 115.439 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.0 m 162.42 109.39 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.82 1 O-C-N 131.189 5.305 . . . . 0.0 113.307 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.943 ' CE ' HD22 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -98.52 156.12 16.94 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 127.714 3.134 . . . . 0.0 106.764 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.488 HG22 ' N ' ' A' ' 43' ' ' ILE . 4.4 mp -135.99 162.94 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 O-C-N 128.58 3.675 . . . . 0.0 111.497 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.531 HD13 ' N ' ' A' ' 44' ' ' VAL 0.292 0.2 OUTLIER -134.5 133.25 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.566 1 CA-C-N 107.93 -4.214 . . . . 0.0 108.472 179.771 . . . . . . . . 5 4 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.603 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.5 t -107.95 -64.71 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.312 0 CA-C-N 112.226 -2.261 . . . . 0.0 108.985 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.603 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.0 OUTLIER 56.01 91.96 0.03 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.01 -40.52 11.05 Favored 'General case' 0 CA--C 1.49 -1.328 2 O-C-N 131.031 5.207 . . . . 0.0 113.255 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.56 -93.23 0.09 OUTLIER Glycine 0 C--O 1.2 -1.977 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.808 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.51 -19.14 24.15 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 127.516 2.539 . . . . 0.0 110.332 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.43 110.93 23.29 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 129.078 3.986 . . . . 0.0 109.917 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.622 ' HD2' HD13 ' A' ' 94' ' ' LEU . 1.7 t80 -115.84 110.25 18.77 Favored 'General case' 0 CA--C 1.497 -1.061 0 O-C-N 127.53 3.019 . . . . 0.0 111.64 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 79.47 1.44 Allowed 'General case' 0 C--O 1.202 -1.401 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.85 160.75 5.49 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 127.216 2.822 . . . . 0.0 107.507 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.423 ' NZ ' HD13 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -161.91 148.87 14.02 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 115.226 -2.59 . . . . 0.0 110.301 -179.254 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 t -103.83 136.73 42.95 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-O 124.135 1.922 . . . . 0.0 109.618 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -92.55 6.86 45.67 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 115.908 -1.996 . . . . 0.0 113.038 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.4 m -47.61 102.85 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 O-C-N 131.638 5.587 . . . . 0.0 104.872 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 p -33.13 -43.82 0.11 Allowed 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.479 5.487 . . . . 0.0 109.364 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.516 ' CG ' ' CD2' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -51.37 -68.19 0.19 Allowed 'General case' 0 C--N 1.35 0.62 0 O-C-N 128.755 3.784 . . . . 0.0 111.31 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.12 135.16 30.63 Favored 'General case' 0 CA--C 1.508 -0.641 1 O-C-N 129.283 4.114 . . . . 0.0 111.962 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.57 100.4 7.11 Favored 'General case' 0 C--O 1.2 -1.503 0 O-C-N 128.835 3.835 . . . . 0.0 112.275 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -177.39 113.61 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 1 O-C-N 129.337 4.148 . . . . 0.0 108.186 -179.856 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -77.66 0.46 Allowed 'General case' 0 CA--C 1.495 -1.171 0 O-C-N 126.812 2.57 . . . . 0.0 116.56 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.997 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 9.8 tp -112.07 39.91 2.3 Favored 'General case' 0 N--CA 1.435 -1.207 0 N-CA-C 119.554 3.168 . . . . 0.0 119.554 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.09 101.99 0.26 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 104.276 -2.491 . . . . 0.0 104.276 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 1.019 ' CD1' HG21 ' A' ' 87' ' ' VAL . 2.2 m-85 -147.18 -175.23 4.75 Favored 'General case' 0 CA--C 1.496 -1.12 1 CA-C-O 128.726 4.108 . . . . 0.0 112.304 -179.633 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.529 ' CG2' HG21 ' A' ' 69' ' ' VAL . 2.0 m -150.74 166.45 30.4 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.481 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.747 HG21 ' CD1' ' A' ' 89' ' ' TRP . 14.0 t -96.07 130.4 44.8 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.33 0 O-C-N 127.395 2.934 . . . . 0.0 115.544 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.75 34.81 59.16 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.224 -1.941 . . . . 0.0 116.439 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.529 HG21 ' CG2' ' A' ' 66' ' ' THR . 15.0 t -118.21 55.92 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 117.528 -1.225 . . . . 0.0 109.601 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -15.42 86.13 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.801 1 O-C-N 131.934 5.771 . . . . 0.0 115.612 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.496 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.3 m-85 -59.74 94.09 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 109.528 -3.487 . . . . 0.0 114.082 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 80.27 0.3 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 126.984 2.677 . . . . 0.0 108.654 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.447 ' CD ' ' HB3' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 67.57 150.92 0.07 Allowed 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 125.408 2.528 . . . . 0.0 112.929 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.97 62.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 108.88 -3.782 . . . . 0.0 116.166 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.404 ' C ' ' CG ' ' A' ' 76' ' ' LYS . 55.9 p -136.09 115.94 13.12 Favored 'General case' 0 C--O 1.211 -0.954 0 O-C-N 119.434 -2.041 . . . . 0.0 109.743 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.404 ' CG ' ' C ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -155.24 -64.1 0.12 Allowed 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 126.501 3.048 . . . . 0.0 111.561 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -47.96 -37.76 16.28 Favored Glycine 0 N--CA 1.468 0.831 0 CA-C-N 109.289 -3.596 . . . . 0.0 111.516 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . 0.281 1.5 tp -124.28 32.89 5.4 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.705 ' HB2' HD13 ' A' ' 24' ' ' LEU . 2.3 t0 174.46 -83.43 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 123.499 1.618 . . . . 0.0 112.983 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.93 76.91 0.99 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.674 2.083 . . . . 0.0 110.57 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -148.74 -133.19 0.06 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 111.275 -2.462 . . . . 0.0 114.09 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.447 ' HB3' ' CD ' ' A' ' 73' ' ' GLU . 2.0 p30 177.95 105.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 125.199 1.562 . . . . 0.0 109.835 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.66 HG13 ' N ' ' A' ' 100' ' ' GLY . 99.6 t -136.67 134.04 48.81 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.299 0 N-CA-C 117.665 2.469 . . . . 0.0 117.665 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -60.56 107.88 0.75 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 112.116 -2.311 . . . . 0.0 106.809 178.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.496 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 94.9 m -109.77 65.55 0.62 Allowed 'General case' 0 C--O 1.204 -1.33 0 CA-C-O 126.34 2.971 . . . . 0.0 118.372 -178.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.441 ' HB3' HG23 ' A' ' 97' ' ' VAL . 4.7 tt -65.78 142.3 58.02 Favored 'General case' 0 CA--C 1.514 -0.426 1 CA-C-N 108.04 -4.164 . . . . 0.0 112.602 179.633 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 1.019 HG21 ' CD1' ' A' ' 65' ' ' PHE . 30.8 t -125.35 144.62 34.78 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 CA-C-N 110.995 -2.82 . . . . 0.0 109.682 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.619 ' HA ' HG13 ' A' ' 67' ' ' VAL . 3.6 t -159.72 170.54 21.32 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-O 125.743 2.687 . . . . 0.0 110.117 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.747 ' CD1' HG21 ' A' ' 67' ' ' VAL . 32.4 m95 -94.22 145.26 24.84 Favored 'General case' 0 CA--C 1.507 -0.703 0 C-N-CA 128.015 2.526 . . . . 0.0 106.156 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.606 ' HB2' HG23 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -95.82 -36.28 11.19 Favored 'General case' 0 C--O 1.197 -1.681 1 CA-C-O 129.888 4.661 . . . . 0.0 113.109 179.708 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.46 -47.02 0.44 Allowed Glycine 0 N--CA 1.481 1.659 1 CA-C-N 107.361 -4.472 . . . . 0.0 106.078 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.577 ' HB3' HG22 ' A' ' 2' ' ' THR . 7.1 p30 -122.84 2.17 9.4 Favored 'General case' 0 N--CA 1.429 -1.49 1 O-C-N 132.74 5.612 . . . . 0.0 113.207 -179.125 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.489 ' CB ' ' HA ' ' A' ' 110' ' ' TRP . 1.3 t -160.65 175.68 12.39 Favored 'General case' 0 C--O 1.202 -1.43 0 N-CA-C 119.407 3.114 . . . . 0.0 119.407 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.743 HD11 ' CG1' ' A' ' 87' ' ' VAL 0.257 2.9 tp -92.34 106.59 18.56 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 109.872 -3.331 . . . . 0.0 114.805 179.633 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.606 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.327 41.1 t -108.15 126.09 64.78 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.136 0 CA-C-N 111.003 -2.817 . . . . 0.0 111.862 179.506 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.448 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -137.56 150.69 47.68 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 122.255 1.026 . . . . 0.0 108.999 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.441 HG23 ' HB3' ' A' ' 86' ' ' LEU . 6.0 m -130.79 108.08 14.88 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.545 0 CA-C-O 127.229 3.395 . . . . 0.0 118.046 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.563 ' HB3' HG11 ' A' ' 83' ' ' VAL . 2.9 mm-40 -85.09 112.19 20.43 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 112.243 -2.253 . . . . 0.0 108.007 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -51.68 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 128.419 3.574 . . . . 0.0 112.585 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.66 ' N ' HG13 ' A' ' 83' ' ' VAL . . . 79.75 155.09 9.75 Favored Glycine 0 C--O 1.219 -0.811 0 CA-C-O 124.276 2.042 . . . . 0.0 109.128 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.29 -16.27 14.62 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 110.704 -2.748 . . . . 0.0 111.276 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -50.06 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 127.131 2.172 . . . . 0.0 113.122 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -97.04 166.56 11.54 Favored 'General case' 0 C--O 1.198 -1.633 0 CA-C-O 123.295 1.522 . . . . 0.0 113.486 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.484 ' O ' HG23 ' A' ' 121' ' ' THR . 7.0 m-20 -124.48 97.33 5.26 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 108.752 -3.84 . . . . 0.0 103.398 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.456 ' HD3' ' HB3' ' A' ' 122' ' ' CYS . 0.1 OUTLIER -89.65 2.38 54.82 Favored 'General case' 0 C--O 1.203 -1.36 0 C-N-CA 125.071 1.348 . . . . 0.0 113.421 -179.76 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.446 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -46.06 115.48 1.75 Allowed Glycine 0 C--O 1.203 -1.84 2 CA-C-N 108.177 -4.101 . . . . 0.0 112.506 179.816 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.997 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.262 0.0 OUTLIER -114.02 144.93 42.29 Favored 'General case' 0 C--O 1.193 -1.888 0 O-C-N 129.974 3.985 . . . . 0.0 110.344 179.218 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.3 169.74 21.53 Favored 'General case' 0 C--O 1.207 -1.141 1 O-C-N 129.851 4.47 . . . . 0.0 116.6 -179.053 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.525 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -138.42 157.4 46.28 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 109.221 -3.627 . . . . 0.0 109.503 -179.99 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.489 ' HA ' ' CB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -146.08 12.29 1.23 Allowed 'General case' 0 CA--C 1.502 -0.878 1 O-C-N 129.835 4.46 . . . . 0.0 116.044 179.228 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.464 HG22 HD12 ' A' ' 116' ' ' LEU . 5.8 t 34.22 55.4 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-O 127.226 3.393 . . . . 0.0 116.303 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -60.63 104.53 0.35 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 110.154 -3.203 . . . . 0.0 114.536 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 58.17 -84.1 0.01 OUTLIER Glycine 0 C--O 1.204 -1.771 0 CA-C-N 114.03 -1.441 . . . . 0.0 115.991 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -134.35 49.27 2.26 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 116.428 2.011 . . . . 0.0 116.428 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.405 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.322 -0.604 0 O-C-N 127.406 2.941 . . . . 0.0 109.488 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.943 HD22 ' CE ' ' A' ' 41' ' ' LYS . 3.3 tt -116.0 82.23 1.74 Allowed 'General case' 0 CA--C 1.484 -1.558 0 O-C-N 128.434 3.584 . . . . 0.0 116.597 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -54.05 109.26 0.45 Allowed 'General case' 0 CA--C 1.502 -0.866 0 CA-C-N 109.984 -3.28 . . . . 0.0 114.878 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.489 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -92.02 56.77 2.96 Favored 'General case' 0 C--N 1.36 1.059 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.0 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.04 140.33 58.38 Favored 'General case' 0 CA--C 1.489 -1.366 0 C-N-CA 126.838 2.055 . . . . 0.0 107.945 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.65 162.6 41.06 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 118.32 -1.352 . . . . 0.0 109.062 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 104' ' ' ASN . 2.7 t -134.43 151.53 51.24 Favored 'General case' 0 C--O 1.199 -1.579 0 O-C-N 127.147 2.78 . . . . 0.0 104.421 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.456 ' HB3' ' HD3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -141.53 30.99 1.69 Allowed 'General case' 0 CA--C 1.496 -1.11 0 CA-C-O 123.768 1.747 . . . . 0.0 114.506 -179.237 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 119.38 -61.15 0.49 Allowed Glycine 0 C--O 1.223 -0.541 0 CA-C-N 109.732 -3.394 . . . . 0.0 113.587 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -162.75 69.87 0.26 Allowed 'General case' 0 C--O 1.205 -1.271 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.447 ' C ' HG12 ' A' ' 126' ' ' VAL . 7.2 tp60 -140.71 -49.95 0.44 Allowed 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 110.659 -2.973 . . . . 0.0 109.85 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 126' ' ' VAL . 2.4 p 49.1 87.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.131 1 O-C-N 131.55 5.531 . . . . 0.0 112.337 -179.676 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -72.34 126.9 30.97 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 112.528 -2.124 . . . . 0.0 109.728 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 6.2 mmt85 -106.69 80.39 1.45 Allowed 'General case' 0 CA--C 1.484 -1.578 0 O-C-N 125.762 1.913 . . . . 0.0 112.37 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.11 161.71 2.28 Favored 'General case' 0 C--N 1.35 0.617 0 O-C-N 127.396 2.935 . . . . 0.0 114.548 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -152.42 109.32 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.211 0 CA-C-O 126.449 3.023 . . . . 0.0 104.838 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.594 ' CZ ' ' HG3' ' A' ' 11' ' ' MET . 4.2 m-85 -109.69 174.28 5.94 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-N 108.859 -3.791 . . . . 0.0 116.743 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -154.47 125.38 7.17 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 110.821 -2.9 . . . . 0.0 104.508 179.637 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.531 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 18.8 ttpt -70.63 116.05 10.51 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 128.206 3.441 . . . . 0.0 109.72 178.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.461 ' HB3' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.486 -1.513 0 N-CA-C 118.038 2.607 . . . . 0.0 118.038 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.52 3.038 0 CA-C-O 117.666 -1.159 . . . . 0.0 108.354 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.64 127.7 0.03 OUTLIER 'General case' 0 C--O 1.212 -0.91 0 CA-C-O 122.296 1.046 . . . . 0.0 109.198 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.1 mttt 53.36 178.38 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 57.97 89.44 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 124.428 2.061 . . . . 0.0 108.142 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -148.96 47.21 1.0 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 112.945 -1.934 . . . . 0.0 107.633 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.24 148.88 0.11 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 127.409 2.943 . . . . 0.0 113.082 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.3 174.96 40.04 Favored Glycine 0 C--O 1.223 -0.567 0 CA-C-N 110.969 -2.832 . . . . 0.0 112.77 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.434 HG22 ' HG3' ' A' ' 134' ' ' LYS . 0.4 OUTLIER -116.77 136.87 52.62 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 130.104 4.061 . . . . 0.0 103.877 179.759 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.531 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.274 0.0 OUTLIER -138.88 100.2 3.98 Favored 'General case' 0 CA--C 1.495 -1.143 0 O-C-N 128.564 3.665 . . . . 0.0 112.085 -179.595 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.21 -24.4 0.46 Allowed 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 115.685 -2.102 . . . . 0.0 114.972 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.464 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 3.5 ttm 83.32 -67.58 0.07 Allowed 'General case' 0 C--O 1.244 0.813 0 O-C-N 128.364 3.54 . . . . 0.0 106.072 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.402 ' CB ' ' O ' ' A' ' 11' ' ' MET . 36.0 tt0 108.08 -44.77 0.0 OUTLIER 'General case' 0 C--O 1.206 -1.222 1 O-C-N 130.364 4.79 . . . . 0.0 111.231 179.887 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 177.39 153.64 0.26 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 109.004 -3.725 . . . . 0.0 110.73 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -123.69 134.71 53.68 Favored 'General case' 0 CA--C 1.486 -1.502 0 CA-C-N 111.809 -2.451 . . . . 0.0 111.943 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -73.27 -176.56 2.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 128.936 3.898 . . . . 0.0 111.572 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -9.54 80.73 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.082 0 CA-C-O 124.648 2.166 . . . . 0.0 115.479 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.532 ' CD2' ' HA ' ' A' ' 35' ' ' VAL . 8.3 t80 -80.94 -31.92 34.77 Favored 'General case' 0 C--O 1.203 -1.379 0 CA-C-N 110.038 -3.255 . . . . 0.0 110.258 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -78.24 -49.4 13.82 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 110.725 -2.943 . . . . 0.0 112.905 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.428 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -60.95 -21.59 59.12 Favored Glycine 0 C--N 1.342 0.915 0 O-C-N 127.92 3.262 . . . . 0.0 111.723 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.434 ' CE1' HD11 ' A' ' 120' ' ' LEU . 0.3 OUTLIER -75.24 -39.34 59.98 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 127.399 2.47 . . . . 0.0 105.701 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . 0.251 31.9 mtt -79.74 -23.96 41.91 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 112.533 -2.121 . . . . 0.0 111.631 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.428 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 9.4 ttpt -76.99 -23.84 52.27 Favored 'General case' 0 C--N 1.313 -1.007 0 O-C-N 128.798 3.811 . . . . 0.0 113.102 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -72.05 -54.62 9.29 Favored 'General case' 0 C--O 1.201 -1.451 1 O-C-N 129.906 4.504 . . . . 0.0 109.453 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.856 HD11 ' HB ' ' A' ' 26' ' ' ILE . 0.4 OUTLIER -74.33 -18.93 60.63 Favored 'General case' 0 N--CA 1.488 1.457 1 O-C-N 129.809 4.443 . . . . 0.0 106.237 -179.984 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 45.34 84.33 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.363 0 CA-C-O 126.441 3.02 . . . . 0.0 106.705 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.856 ' HB ' HD11 ' A' ' 24' ' ' LEU . 9.9 tt -94.8 -30.26 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.531 1 CA-C-N 107.866 -4.243 . . . . 0.0 115.353 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -168.55 -175.74 2.58 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 118.345 -2.722 . . . . 0.0 109.997 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -127.52 115.5 18.94 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 63.81 41.46 6.82 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.871 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.11 -5.13 50.97 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 128.725 3.766 . . . . 0.0 110.648 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -75.94 -162.8 0.24 Allowed 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 128.647 2.779 . . . . 0.0 109.236 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HG2' HG13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER 77.46 4.75 3.1 Favored 'General case' 0 CA--C 1.485 -1.549 0 O-C-N 127.424 2.953 . . . . 0.0 114.133 179.553 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.473 ' O ' HD22 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -147.71 -73.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-N 113.416 -1.72 . . . . 0.0 113.43 179.418 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.695 ' HA ' HD21 ' A' ' 37' ' ' LEU . . . -48.98 -19.85 0.45 Allowed 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.532 ' HA ' ' CD2' ' A' ' 17' ' ' PHE . 53.7 t -26.48 -48.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.584 0 O-C-N 126.463 2.352 . . . . 0.0 109.841 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.658 ' C ' HD23 ' A' ' 37' ' ' LEU . 4.6 tpp180 164.54 125.58 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.376 2 O-C-N 131.145 5.278 . . . . 0.0 111.41 178.938 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.711 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -142.42 85.45 1.91 Allowed 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 110.006 -3.27 . . . . 0.0 104.994 -179.9 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m 87.85 120.81 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.896 1 O-C-N 135.346 7.904 . . . . 0.0 110.689 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.464 ' HG2' ' CB ' ' A' ' 11' ' ' MET . 46.4 tp60 -135.8 141.72 44.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 120.513 1.506 . . . . 0.0 110.821 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 40' ' ' THR . 99.3 m -168.99 80.74 0.13 Allowed 'General case' 0 C--O 1.212 -0.879 2 O-C-N 132.258 5.974 . . . . 0.0 112.364 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.93 144.85 54.06 Favored 'General case' 0 N--CA 1.485 1.321 1 O-C-N 129.674 4.359 . . . . 0.0 103.415 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.488 ' N ' ' O ' ' A' ' 53' ' ' LYS . 4.2 mt -138.54 103.6 2.27 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.438 0 CA-C-O 124.087 1.899 . . . . 0.0 115.387 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.589 ' CD1' ' CE1' ' A' ' 50' ' ' PHE 0.289 0.3 OUTLIER -88.17 141.04 14.86 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 1 CA-C-N 107.753 -4.294 . . . . 0.0 108.81 179.8 . . . . . . . . 5 4 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.7 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.1 t -124.8 -66.5 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.367 0 CA-C-N 111.898 -2.41 . . . . 0.0 114.445 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.7 ' N ' HG12 ' A' ' 44' ' ' VAL . 9.6 mt-30 64.39 123.38 0.02 OUTLIER 'General case' 0 CA--C 1.488 -1.424 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -152.01 37.97 0.57 Allowed 'General case' 0 CA--C 1.489 -1.384 0 C-N-CA 114.563 -2.855 . . . . 0.0 116.362 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.0 93.22 0.54 Allowed Glycine 0 C--O 1.201 -1.954 0 CA-C-N 118.985 0.811 . . . . 0.0 111.575 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 53.22 43.92 30.9 Favored 'General case' 0 CA--C 1.507 -0.698 0 O-C-N 128.066 2.862 . . . . 0.0 113.449 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 179.68 96.06 0.02 OUTLIER 'General case' 0 C--O 1.232 0.175 1 O-C-N 129.465 4.228 . . . . 0.0 109.942 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.61 ' CD2' HD22 ' A' ' 94' ' ' LEU . 2.0 t80 -118.75 109.95 16.68 Favored 'General case' 0 CA--C 1.483 -1.613 1 O-C-N 130.094 4.621 . . . . 0.0 112.813 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 20.7 mttt -112.86 80.48 1.35 Allowed 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 118.951 2.945 . . . . 0.0 118.951 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.469 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -63.01 150.36 42.65 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 127.742 3.151 . . . . 0.0 105.668 179.072 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -159.14 133.36 7.71 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 115.845 -2.342 . . . . 0.0 110.502 -179.14 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.29 148.11 22.77 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 126.128 2.142 . . . . 0.0 111.006 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 t30 -112.16 48.35 0.99 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 127.305 2.878 . . . . 0.0 115.081 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.517 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 1.5 p -73.04 158.18 35.91 Favored 'General case' 0 N--CA 1.475 0.814 1 O-C-N 133.091 6.494 . . . . 0.0 105.166 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 57' ' ' THR . 1.0 OUTLIER -103.92 24.03 11.95 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 129.026 3.954 . . . . 0.0 107.141 179.51 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.568 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 14.5 p90 -137.36 -50.71 0.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.82 2.156 . . . . 0.0 116.82 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 -79.78 0.56 Allowed 'General case' 0 CA--C 1.503 -0.859 0 C-N-CA 115.238 -2.585 . . . . 0.0 116.781 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 64.82 67.9 0.53 Allowed 'General case' 0 C--O 1.2 -1.539 0 O-C-N 126.264 2.228 . . . . 0.0 108.883 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 -46.04 41.14 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 110.834 -2.894 . . . . 0.0 109.776 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 47.7 t0 74.24 122.13 0.04 OUTLIER 'General case' 0 CA--C 1.503 -0.838 1 O-C-N 130.437 4.836 . . . . 0.0 110.288 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 1.078 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 13.8 tp -77.14 47.45 0.55 Allowed 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.297 2.248 . . . . 0.0 112.028 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.464 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 54.8 t0 -63.08 96.88 0.1 Allowed 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 106.476 -1.676 . . . . 0.0 106.476 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -134.48 169.17 17.66 Favored 'General case' 0 N--CA 1.475 0.783 1 CA-C-O 129.828 4.632 . . . . 0.0 107.908 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.56 HG22 HG23 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -156.54 126.66 6.47 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 109.715 -3.402 . . . . 0.0 105.041 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.915 ' HA ' HG22 ' A' ' 87' ' ' VAL . 7.2 p -48.27 132.91 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 0 O-C-N 126.277 2.236 . . . . 0.0 116.15 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.14 -0.44 73.56 Favored Glycine 0 C--N 1.359 1.848 0 O-C-N 127.34 2.9 . . . . 0.0 116.943 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.56 HG23 HG22 ' A' ' 66' ' ' THR . 0.9 OUTLIER -65.08 -40.47 89.04 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 C-N-CA 118.398 -1.321 . . . . 0.0 109.565 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 65.12 88.41 0.11 Allowed 'General case' 0 C--N 1.361 1.096 0 O-C-N 128.337 3.523 . . . . 0.0 110.628 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.467 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.4 OUTLIER -70.44 75.94 0.56 Allowed 'General case' 0 C--O 1.216 -0.707 0 O-C-N 127.643 3.089 . . . . 0.0 110.743 -179.645 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -48.36 81.02 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 25.4 mt-10 60.47 -176.47 0.11 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 123.249 1.5 . . . . 0.0 107.9 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 47.7 t60 92.15 97.38 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 109.825 -3.352 . . . . 0.0 116.477 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.28 166.51 24.85 Favored 'General case' 0 C--O 1.198 -1.642 0 CA-C-N 112.111 -2.313 . . . . 0.0 108.925 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 172.07 -31.12 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 O-C-N 126.134 2.146 . . . . 0.0 113.187 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.7 -33.03 48.13 Favored Glycine 0 C--O 1.208 -1.511 0 N-CA-C 107.057 -2.417 . . . . 0.0 107.057 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.3 tp -140.68 101.49 4.09 Favored 'General case' 0 N--CA 1.448 -0.527 1 CA-C-N 107.427 -4.387 . . . . 0.0 115.399 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.794 ' HB2' HD13 ' A' ' 24' ' ' LEU . 23.4 t0 92.06 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.776 0 O-C-N 128.954 3.909 . . . . 0.0 113.489 179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.88 82.41 1.4 Allowed Glycine 0 N--CA 1.469 0.862 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.418 ' HB3' HG23 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -137.35 -170.4 2.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 111.476 -2.362 . . . . 0.0 109.663 -179.413 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.524 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 1.7 m120 -135.59 87.79 2.35 Favored 'General case' 0 C--O 1.202 -1.431 0 O-C-N 127.552 3.032 . . . . 0.0 106.723 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.954 HG22 ' HA2' ' A' ' 100' ' ' GLY . 94.8 t -119.19 142.79 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.557 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -178.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.45 73.83 0.24 Allowed 'General case' 0 C--O 1.218 -0.604 0 O-C-N 127.22 2.825 . . . . 0.0 108.1 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.467 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 18.5 m -76.92 70.61 3.36 Favored 'General case' 0 C--O 1.195 -1.793 0 CA-C-N 109.76 -3.382 . . . . 0.0 112.096 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 165.98 7.82 Favored 'General case' 0 C--O 1.214 -0.788 1 CA-C-N 107.459 -4.428 . . . . 0.0 113.659 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.915 HG22 ' HA ' ' A' ' 67' ' ' VAL . 0.3 OUTLIER -157.52 116.5 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.364 0 CA-C-N 112.467 -2.151 . . . . 0.0 108.625 179.772 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.826 ' HA ' HG23 ' A' ' 67' ' ' VAL . 0.5 OUTLIER -150.0 173.98 13.23 Favored 'General case' 0 CA--C 1.474 -1.946 0 CA-C-N 110.574 -3.012 . . . . 0.0 111.023 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.701 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.0 m95 -96.71 151.67 19.41 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-O 114.832 -2.509 . . . . 0.0 107.982 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.631 ' HB2' HG23 ' A' ' 95' ' ' VAL . 7.0 tp10 -100.67 -40.55 7.31 Favored 'General case' 0 C--O 1.199 -1.597 1 CA-C-O 131.663 5.506 . . . . 0.0 112.143 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 176.35 -48.6 0.11 Allowed Glycine 0 C--O 1.207 -1.548 0 CA-C-N 108.723 -3.853 . . . . 0.0 105.708 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.09 41.73 0.75 Allowed 'General case' 0 N--CA 1.444 -0.748 1 O-C-N 130.586 4.345 . . . . 0.0 110.656 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.447 HG22 ' HB3' ' A' ' 90' ' ' GLU . 0.6 OUTLIER -172.37 153.86 3.07 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 112.091 -2.322 . . . . 0.0 115.367 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.61 HD22 ' CD2' ' A' ' 50' ' ' PHE . 3.1 tp -88.9 93.96 9.77 Favored 'General case' 0 CA--C 1.481 -1.684 0 O-C-N 128.32 3.513 . . . . 0.0 118.561 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.653 HG13 ' NZ ' ' A' ' 108' ' ' LYS 0.341 53.0 t -89.61 114.75 28.03 Favored 'Isoleucine or valine' 0 C--N 1.358 0.977 0 CA-C-N 113.014 -1.903 . . . . 0.0 112.72 178.943 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 75.4 m -119.41 110.35 16.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 103.333 -2.84 . . . . 0.0 103.333 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.56 74.36 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.482 -1.639 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.51 ' HB2' ' HA2' ' A' ' 106' ' ' GLY . 0.1 OUTLIER -53.49 100.19 0.03 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.694 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.4 OUTLIER -97.88 88.3 4.24 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-N 110.647 -2.979 . . . . 0.0 113.745 -178.925 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.954 ' HA2' HG22 ' A' ' 83' ' ' VAL . . . -62.66 -86.56 0.05 OUTLIER Glycine 0 CA--C 1.534 1.223 0 N-CA-C 106.631 -2.588 . . . . 0.0 106.631 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 177.25 -57.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 128.369 3.04 . . . . 0.0 111.312 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -37.07 18.79 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 110.653 -2.976 . . . . 0.0 115.62 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.431 ' HG3' ' CZ ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -120.35 175.97 5.71 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 110.297 -3.138 . . . . 0.0 111.988 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.466 ' HB2' ' CG2' ' A' ' 121' ' ' THR . 0.0 OUTLIER -124.69 115.83 21.39 Favored 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.637 -4.801 . . . . 0.0 102.212 179.267 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.431 ' CZ ' ' HG3' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -115.39 24.8 11.32 Favored 'General case' 0 C--O 1.209 -1.06 0 O-C-N 128.256 3.473 . . . . 0.0 108.217 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.51 ' HA2' ' HB2' ' A' ' 98' ' ' GLN . . . -81.65 129.29 8.95 Favored Glycine 0 N--CA 1.427 -1.953 2 O-C-N 133.492 6.745 . . . . 0.0 115.15 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 1.078 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.258 0.0 OUTLIER -115.57 136.22 53.29 Favored 'General case' 0 C--O 1.202 -1.409 0 O-C-N 129.554 3.737 . . . . 0.0 108.419 177.746 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.653 ' NZ ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -153.03 174.59 13.98 Favored 'General case' 0 C--O 1.206 -1.23 1 O-C-N 129.432 4.208 . . . . 0.0 114.484 -178.634 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.413 ' NE2' HD23 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -134.01 162.54 31.78 Favored 'General case' 0 C--N 1.361 1.102 0 CA-C-N 110.518 -3.037 . . . . 0.0 109.445 -179.502 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.523 ' CZ3' ' HD3' ' A' ' 108' ' ' LYS . 0.4 OUTLIER -170.0 66.47 0.05 Allowed 'General case' 0 C--N 1.31 -1.116 1 O-C-N 131.711 5.632 . . . . 0.0 115.799 -179.931 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.552 HG22 HD21 ' A' ' 116' ' ' LEU . 39.7 t -17.84 99.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.269 0 C-N-CA 128.213 2.605 . . . . 0.0 114.896 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.509 ' HB2' ' CE1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -94.08 38.54 1.08 Allowed 'General case' 0 CA--C 1.49 -1.361 0 CA-C-N 111.819 -2.446 . . . . 0.0 116.317 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.7 -100.82 1.02 Allowed Glycine 0 C--O 1.213 -1.191 0 O-C-N 126.448 2.343 . . . . 0.0 118.065 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -107.01 12.6 28.47 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.894 2.553 . . . . 0.0 117.894 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.402 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 6.6 pttt -157.08 150.03 23.68 Favored 'General case' 0 C--N 1.314 -0.936 1 O-C-N 129.437 4.211 . . . . 0.0 109.192 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.552 HD21 HG22 ' A' ' 111' ' ' VAL . 0.4 OUTLIER -84.34 174.16 10.35 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 126.203 2.189 . . . . 0.0 112.776 179.619 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.509 ' CE1' ' HB2' ' A' ' 112' ' ' GLU . 11.4 m-85 -146.9 89.61 1.83 Allowed 'General case' 0 C--O 1.213 -0.833 0 C-N-CA 115.129 -2.628 . . . . 0.0 112.513 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 118' ' ' LEU . 11.2 mt -83.01 58.86 4.61 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 110.08 -3.236 . . . . 0.0 108.423 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -76.32 91.96 3.29 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 129.713 3.205 . . . . 0.0 111.531 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.434 HD11 ' CE1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -90.73 -179.12 5.45 Favored 'General case' 0 N--CA 1.489 1.504 1 O-C-N 129.367 4.167 . . . . 0.0 110.365 179.628 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.466 ' CG2' ' HB2' ' A' ' 104' ' ' ASN . 18.3 m -129.38 159.08 37.32 Favored 'General case' 0 CA--C 1.492 -1.271 0 O-C-N 127.274 2.859 . . . . 0.0 105.792 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.55 73.27 0.37 Allowed 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 126.738 3.161 . . . . 0.0 113.268 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 63.76 33.29 86.83 Favored Glycine 0 C--O 1.217 -0.909 0 CA-C-N 110.218 -3.174 . . . . 0.0 112.151 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 79.24 51.72 0.03 OUTLIER 'General case' 0 CA--C 1.492 -1.26 0 O-C-N 128.854 3.326 . . . . 0.0 112.43 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.513 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 2.1 mm100 -129.8 24.24 5.36 Favored 'General case' 0 C--O 1.217 -0.614 0 O-C-N 127.572 3.045 . . . . 0.0 106.773 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 126' ' ' VAL . 7.7 p -10.91 79.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 CA-C-N 108.734 -3.848 . . . . 0.0 115.864 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 16.7 t -65.04 151.07 46.95 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.794 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 96.63 3.45 Favored 'General case' 0 CA--C 1.5 -0.967 0 O-C-N 125.101 1.5 . . . . 0.0 112.989 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -73.14 170.2 15.42 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 113.906 -3.118 . . . . 0.0 111.402 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 89.8 t -140.61 140.32 33.95 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.552 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.402 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 14.9 m-85 -123.2 -177.66 3.75 Favored 'General case' 0 CA--C 1.477 -1.857 0 CA-C-N 109.994 -3.275 . . . . 0.0 116.86 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.317 2.9 tptt -167.94 107.77 0.55 Allowed 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 103.218 -2.882 . . . . 0.0 103.218 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.459 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 23.0 ttpt -57.53 93.3 0.01 OUTLIER 'General case' 0 C--O 1.195 -1.796 0 O-C-N 127.094 2.746 . . . . 0.0 112.126 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.434 ' HG3' HG22 ' A' ' 8' ' ' THR . 0.8 OUTLIER . . . . . 0 C--O 1.265 1.876 0 O-C-N 126.85 2.593 . . . . 0.0 114.028 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 mtp . . . . . 0 N--CA 1.504 2.246 0 CA-C-O 120.567 0.222 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 92' ' ' ASN . 0.1 OUTLIER -129.56 -55.17 1.16 Allowed 'General case' 0 C--O 1.208 -1.081 0 O-C-N 125.916 2.01 . . . . 0.0 111.14 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.547 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 17.3 pttp -136.03 -40.5 0.67 Allowed 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 112.623 -2.08 . . . . 0.0 113.059 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -81.27 87.41 6.12 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 125.778 1.924 . . . . 0.0 107.024 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -117.84 138.71 51.91 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -125.51 77.7 1.67 Allowed 'General case' 0 C--N 1.317 -0.845 0 O-C-N 128.348 3.53 . . . . 0.0 111.6 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -125.64 -144.96 6.34 Favored Glycine 0 C--O 1.204 -1.733 0 CA-C-N 111.199 -2.728 . . . . 0.0 114.32 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.44 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -160.41 152.28 20.04 Favored 'General case' 0 N--CA 1.478 0.968 1 O-C-N 133.395 5.997 . . . . 0.0 104.898 179.974 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.679 ' CZ2' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -150.21 122.55 8.42 Favored 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.922 2.639 . . . . 0.0 117.13 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.45 95.52 10.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 126.678 2.486 . . . . 0.0 106.096 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.513 ' HB3' ' CD ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -33.85 -37.78 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 O-C-N 128.516 3.635 . . . . 0.0 106.236 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 78.97 -70.73 0.1 Allowed 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 125.43 2.538 . . . . 0.0 112.206 179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -134.39 169.69 16.86 Favored 'General case' 0 N--CA 1.433 -1.296 1 CA-C-N 108.175 -4.102 . . . . 0.0 107.809 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.409 ' OD1' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -146.47 137.79 24.44 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 108.471 -3.968 . . . . 0.0 112.251 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -79.63 -74.35 0.3 Allowed 'General case' 0 CA--C 1.505 -0.775 0 O-C-N 126.181 2.176 . . . . 0.0 109.033 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -96.87 140.76 30.94 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.796 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -144.05 -52.32 0.32 Allowed 'General case' 0 CA--C 1.491 -1.291 0 CA-C-N 112.488 -2.142 . . . . 0.0 111.179 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.403 ' N ' ' CG ' ' A' ' 17' ' ' PHE . 1.8 tm-20 -70.25 -48.95 54.63 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 124.484 1.114 . . . . 0.0 111.991 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.471 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -60.26 -22.19 58.03 Favored Glycine 0 CA--C 1.492 -1.376 1 O-C-N 129.219 4.074 . . . . 0.0 111.822 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.566 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -79.8 -38.53 32.81 Favored 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.545 ' HG3' ' CG2' ' A' ' 26' ' ' ILE 0.318 0.4 OUTLIER -70.37 -24.79 63.02 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 110.373 -3.103 . . . . 0.0 110.227 -179.598 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.471 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.53 -33.2 42.15 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 129.175 4.047 . . . . 0.0 112.697 179.705 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.45 ' HB2' ' HG2' ' A' ' 125' ' ' GLN . . . -61.59 -37.43 83.86 Favored 'General case' 0 C--O 1.207 -1.163 2 O-C-N 132.316 6.01 . . . . 0.0 113.979 -179.595 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.02 HD12 ' HB2' ' A' ' 79' ' ' ASP 0.351 2.3 mm? -74.87 -45.14 45.04 Favored 'General case' 0 C--O 1.211 -0.954 2 CA-C-N 106.38 -4.918 . . . . 0.0 109.041 -178.241 . . . . . . . . 4 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.27 12.1 t70 91.83 46.35 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.512 3 O-C-N 133.302 6.626 . . . . 0.0 112.809 -179.892 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.545 ' CG2' ' HG3' ' A' ' 21' ' ' MET . 0.6 OUTLIER -105.28 21.33 3.57 Favored 'Isoleucine or valine' 0 C--N 1.361 1.104 1 CA-C-N 107.525 -4.398 . . . . 0.0 111.259 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -87.38 147.27 25.53 Favored 'General case' 0 C--N 1.359 0.988 0 CA-C-N 111.704 -2.498 . . . . 0.0 110.598 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -176.3 43.21 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.672 0 O-C-N 127.189 2.806 . . . . 0.0 113.242 179.867 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 69.22 48.48 0.66 Allowed 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 126.067 2.841 . . . . 0.0 109.392 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.491 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.3 OUTLIER -96.89 -45.78 6.49 Favored 'General case' 0 C--N 1.361 1.089 1 CA-C-N 107.231 -4.532 . . . . 0.0 114.386 -179.993 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.491 ' N ' HG22 ' A' ' 30' ' ' THR . 0.1 OUTLIER -62.89 -179.6 0.29 Allowed 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 114.504 -2.665 . . . . 0.0 111.392 -179.638 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.17 11.09 3.57 Favored 'General case' 0 CA--C 1.488 -1.406 1 O-C-N 130.881 5.113 . . . . 0.0 112.433 179.934 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.6 mt -147.9 -51.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.019 1 O-C-N 132.516 6.135 . . . . 0.0 111.043 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.438 ' HA ' ' CD2' ' A' ' 37' ' ' LEU . . . -77.62 1.72 18.81 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.523 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 t -51.74 -29.85 11.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 124.036 1.874 . . . . 0.0 109.971 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.685 ' HD2' ' HB3' ' A' ' 39' ' ' GLN . 0.0 OUTLIER 164.89 133.83 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 109.011 -3.722 . . . . 0.0 111.258 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.837 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.7 OUTLIER -157.94 96.85 1.5 Allowed 'General case' 0 C--O 1.215 -0.724 2 O-C-N 130.045 4.591 . . . . 0.0 108.081 179.152 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.1 m 62.77 52.65 2.7 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 128.677 3.736 . . . . 0.0 109.863 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.685 ' HB3' ' HD2' ' A' ' 36' ' ' ARG . 11.4 tt0 -74.3 154.38 38.95 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 113.047 -1.888 . . . . 0.0 112.104 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.459 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 82.7 m 177.59 125.3 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.209 1 O-C-N 132.754 6.284 . . . . 0.0 111.847 179.698 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.447 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 8.5 tmtt? -112.74 142.46 45.33 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 127.23 2.831 . . . . 0.0 107.668 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.527 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.5 mp -131.6 159.85 42.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 127.456 2.973 . . . . 0.0 111.044 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.527 ' N ' HG22 ' A' ' 42' ' ' ILE 0.262 0.0 OUTLIER -131.41 150.74 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.604 0 CA-C-N 110.912 -2.858 . . . . 0.0 107.968 179.98 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.634 HG12 ' N ' ' A' ' 45' ' ' GLN . 1.2 t -132.4 -54.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.029 0 C-N-CA 116.544 -2.062 . . . . 0.0 116.102 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.634 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.0 OUTLIER 44.48 88.52 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 -179.754 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.71 45.9 0.98 Allowed 'General case' 0 N--CA 1.481 1.095 1 O-C-N 129.322 4.139 . . . . 0.0 114.622 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.58 93.42 0.36 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-O 117.8 -1.556 . . . . 0.0 113.61 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 75.49 -30.9 0.2 Allowed 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 117.527 2.417 . . . . 0.0 117.527 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 66' ' ' THR . 18.3 m-20 -109.11 100.98 10.07 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.415 2.686 . . . . 0.0 108.191 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.42 ' CE1' HG12 ' A' ' 43' ' ' ILE . 25.8 t80 -99.67 102.06 13.43 Favored 'General case' 0 C--N 1.311 -1.109 1 O-C-N 130.353 4.783 . . . . 0.0 115.059 -178.769 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -115.21 67.62 0.7 Allowed 'General case' 0 CA--C 1.493 -1.215 1 O-C-N 129.623 4.327 . . . . 0.0 117.797 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -58.52 125.88 25.22 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 127.694 3.121 . . . . 0.0 105.838 179.247 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -129.56 154.17 47.32 Favored 'General case' 0 CA--C 1.485 -1.535 0 O-C-N 128.503 3.627 . . . . 0.0 112.284 -178.081 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.507 HG23 ' H ' ' A' ' 56' ' ' SER . 0.6 OUTLIER -106.56 167.46 9.84 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 126.039 2.087 . . . . 0.0 109.938 179.875 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.507 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -137.93 39.56 2.35 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.507 ' H ' HG23 ' A' ' 54' ' ' THR . 14.7 m -75.5 154.32 36.98 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 128.437 3.586 . . . . 0.0 105.245 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.813 ' OG1' HD12 ' A' ' 37' ' ' LEU . 40.6 p -85.65 -1.51 57.23 Favored 'General case' 0 N--CA 1.481 1.091 1 O-C-N 131.285 5.366 . . . . 0.0 109.125 -179.848 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.837 ' HB3' HD11 ' A' ' 37' ' ' LEU . 2.5 p90 -118.21 -40.87 2.91 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.66 128.02 18.86 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 112.695 -2.048 . . . . 0.0 115.052 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -113.09 -161.75 0.77 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 128.677 3.735 . . . . 0.0 107.256 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 60.9 83.62 0.14 Allowed 'General case' 0 CA--C 1.504 -0.808 0 O-C-N 126.408 2.317 . . . . 0.0 110.194 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.19 -65.99 0.93 Allowed 'General case' 0 C--O 1.208 -1.114 0 O-C-N 126.749 2.53 . . . . 0.0 113.894 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 1.126 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 5.2 tp -136.82 41.87 2.49 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 118.455 2.761 . . . . 0.0 118.455 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.56 98.07 0.24 Allowed 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.543 ' CD2' HG21 ' A' ' 87' ' ' VAL . 5.9 m-85 -140.63 -178.36 5.49 Favored 'General case' 0 CA--C 1.488 -1.408 1 CA-C-O 129.427 4.442 . . . . 0.0 110.01 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.59 HG22 HG23 ' A' ' 69' ' ' VAL . 1.6 m -150.61 121.91 7.83 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 109.648 -3.433 . . . . 0.0 104.143 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.795 HG21 ' NE1' ' A' ' 89' ' ' TRP . 5.2 t -61.25 144.1 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 O-C-N 128.134 3.396 . . . . 0.0 116.59 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.95 15.97 61.12 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-N 108.94 -3.754 . . . . 0.0 117.201 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.59 HG23 HG22 ' A' ' 66' ' ' THR 0.269 11.1 t -81.07 -25.43 10.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 C-N-CA 119.044 -1.062 . . . . 0.0 109.344 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 67.86 77.6 0.25 Allowed 'General case' 0 C--N 1.364 1.208 0 O-C-N 129.06 3.975 . . . . 0.0 108.909 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.528 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.3 m-85 -60.51 99.0 0.07 Allowed 'General case' 0 C--N 1.355 0.811 0 O-C-N 127.497 2.998 . . . . 0.0 115.836 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.444 ' C ' ' HG3' ' A' ' 73' ' ' GLU . 74.2 m-20 -68.55 73.11 0.23 Allowed 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 112.358 -2.201 . . . . 0.0 111.352 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.493 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 6.7 mt-10 53.11 -156.51 0.18 Allowed 'General case' 0 CA--C 1.507 -0.683 0 CA-C-O 121.499 0.666 . . . . 0.0 112.339 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.8 m80 71.5 87.97 0.11 Allowed 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 124.763 2.221 . . . . 0.0 112.631 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -125.93 122.56 36.33 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-N 110.214 -3.175 . . . . 0.0 113.04 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.24 168.96 18.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 127.657 3.098 . . . . 0.0 112.254 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.13 34.63 64.52 Favored Glycine 0 C--O 1.207 -1.536 0 CA-C-N 111.782 -2.463 . . . . 0.0 107.845 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.52 ' O ' HD12 ' A' ' 26' ' ' ILE . 4.5 tp -167.45 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.51 -0.57 1 O-C-N 130.417 4.245 . . . . 0.0 116.501 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 1.02 ' HB2' HD12 ' A' ' 24' ' ' LEU . 7.7 t70 -155.17 -57.4 0.1 Allowed 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 116.197 -2.201 . . . . 0.0 113.055 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.63 76.86 1.31 Allowed Glycine 0 C--O 1.213 -1.169 0 O-C-N 126.104 2.127 . . . . 0.0 111.619 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.524 ' HG3' HG23 ' A' ' 83' ' ' VAL . 9.3 ptt180 -137.05 -156.91 0.73 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 111.342 -2.429 . . . . 0.0 111.168 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.493 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.5 OUTLIER -160.14 105.08 1.51 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 128.167 3.417 . . . . 0.0 108.488 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.524 HG23 ' HG3' ' A' ' 81' ' ' ARG . 12.8 t -144.27 135.33 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.2 0 N-CA-C 117.48 2.4 . . . . 0.0 117.48 -178.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.521 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -49.58 145.07 5.26 Favored 'General case' 0 N--CA 1.467 0.39 1 O-C-N 129.708 4.38 . . . . 0.0 106.266 178.183 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.528 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 78.3 m -150.42 66.14 0.95 Allowed 'General case' 0 C--O 1.201 -1.459 0 O-C-N 127.537 3.023 . . . . 0.0 115.251 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 6.0 tt -62.04 140.58 58.36 Favored 'General case' 0 N--CA 1.432 -1.373 1 CA-C-N 108.12 -4.127 . . . . 0.0 110.811 -179.765 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.543 HG21 ' CD2' ' A' ' 65' ' ' PHE . 3.9 t -132.39 135.98 56.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 C-N-CA 126.1 1.76 . . . . 0.0 108.414 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.47 ' HA ' ' CG1' ' A' ' 67' ' ' VAL . 9.7 t -159.81 156.67 27.89 Favored 'General case' 0 CA--C 1.473 -1.982 0 CA-C-O 124.462 2.077 . . . . 0.0 109.28 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.795 ' NE1' HG21 ' A' ' 67' ' ' VAL . 38.5 m95 -90.34 145.31 25.06 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-O 114.602 -2.618 . . . . 0.0 106.761 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.826 ' HB3' HG22 ' A' ' 93' ' ' THR . 7.0 tp10 -97.38 -8.53 29.32 Favored 'General case' 0 CA--C 1.489 -1.367 1 CA-C-O 129.462 4.458 . . . . 0.0 112.055 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.95 -19.17 11.22 Favored Glycine 0 C--O 1.2 -2.023 0 CA-C-N 108.731 -3.85 . . . . 0.0 106.097 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.498 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.8 OUTLIER -158.96 44.88 0.27 Allowed 'General case' 0 N--CA 1.431 -1.391 1 O-C-N 131.826 5.074 . . . . 0.0 111.766 179.978 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.826 HG22 ' HB3' ' A' ' 90' ' ' GLU . 15.1 t 164.1 144.88 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.916 2.561 . . . . 0.0 117.916 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.756 ' CD2' HD21 ' A' ' 63' ' ' LEU . 1.2 tp -87.55 83.17 7.28 Favored 'General case' 0 CA--C 1.504 -0.798 0 O-C-N 127.397 2.936 . . . . 0.0 114.907 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.479 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.355 73.8 t -81.03 127.63 39.38 Favored 'Isoleucine or valine' 0 C--N 1.351 0.672 1 O-C-N 129.285 4.116 . . . . 0.0 111.394 179.663 . . . . . . . . 4 3 . 1 . 007 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -139.23 141.39 37.87 Favored 'General case' 0 C--O 1.196 -1.749 0 N-CA-C 103.953 -2.61 . . . . 0.0 103.953 -179.019 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.2 t -121.87 91.13 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.736 0 N-CA-C 119.719 3.229 . . . . 0.0 119.719 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.441 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 17.4 mm-40 -65.97 97.84 0.39 Allowed 'General case' 0 C--N 1.361 1.072 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.521 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 1.1 tmtm? -39.29 -49.24 1.93 Allowed 'General case' 0 N--CA 1.48 1.075 0 O-C-N 128.507 3.629 . . . . 0.0 112.417 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.467 ' H ' ' CG1' ' A' ' 83' ' ' VAL . . . 87.4 133.97 4.1 Favored Glycine 0 C--O 1.206 -1.652 1 CA-C-O 128.076 4.153 . . . . 0.0 113.879 179.382 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.412 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -100.78 -46.36 5.17 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 108.955 -3.622 . . . . 0.0 107.607 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.412 ' CG ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -146.24 16.44 1.34 Allowed 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 127.798 2.439 . . . . 0.0 115.965 179.773 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.65 -178.73 7.54 Favored 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 125.859 1.664 . . . . 0.0 114.349 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.638 ' O ' HG22 ' A' ' 121' ' ' THR . 7.9 m120 -125.39 88.22 2.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 127.699 3.124 . . . . 0.0 102.827 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.639 HH21 HD13 ' A' ' 24' ' ' LEU . 57.9 mmt-85 -92.92 2.79 56.6 Favored 'General case' 0 C--O 1.212 -0.894 0 O-C-N 126.9 2.625 . . . . 0.0 113.427 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.417 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -37.98 99.44 0.01 OUTLIER Glycine 0 C--O 1.209 -1.41 2 O-C-N 131.974 5.796 . . . . 0.0 113.093 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 1.126 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.299 0.0 OUTLIER -108.63 126.8 53.36 Favored 'General case' 0 C--O 1.209 -1.032 0 O-C-N 128.954 3.385 . . . . 0.0 110.025 179.546 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -153.52 155.08 35.54 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 128.299 3.904 . . . . 0.0 113.809 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.494 ' HG2' ' CD2' ' A' ' 118' ' ' LEU . 0.9 OUTLIER -114.93 -179.42 3.62 Favored 'General case' 0 C--N 1.366 1.283 1 CA-C-N 108.006 -4.179 . . . . 0.0 109.562 -179.186 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.455 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.6 OUTLIER 174.55 77.86 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.509 1 O-C-N 132.017 5.823 . . . . 0.0 117.743 179.113 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 63.6 t -27.55 101.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.817 1 CA-C-O 128.61 4.053 . . . . 0.0 117.435 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -111.06 -179.79 3.83 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 112.257 -2.247 . . . . 0.0 111.852 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -25.8 73.94 0.0 OUTLIER Glycine 0 C--O 1.204 -1.742 0 C-N-CA 127.284 2.373 . . . . 0.0 116.633 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 43.25 68.45 0.51 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 127.674 2.39 . . . . 0.0 116.823 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.473 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 9.3 pttt 160.33 164.83 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.161 1 O-C-N 133.128 6.517 . . . . 0.0 108.33 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.679 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -105.14 151.55 23.89 Favored 'General case' 0 CA--C 1.478 -1.789 0 O-C-N 127.088 2.743 . . . . 0.0 113.544 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.586 ' H ' HD23 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -113.14 98.34 7.08 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 113.425 -1.716 . . . . 0.0 115.609 -179.768 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.494 ' CD2' ' HG2' ' A' ' 109' ' ' GLN . 8.3 mt -85.98 77.61 9.63 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 128.178 3.424 . . . . 0.0 107.593 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.455 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.4 mt-10 -88.81 95.24 10.21 Favored 'General case' 0 CA--C 1.494 -1.19 0 O-C-N 126.666 2.479 . . . . 0.0 111.434 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.576 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -110.79 166.11 11.29 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 127.307 2.879 . . . . 0.0 108.466 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.638 HG22 ' O ' ' A' ' 104' ' ' ASN . 20.2 m -122.18 156.35 33.89 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 110.498 -3.046 . . . . 0.0 105.259 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.8 OUTLIER -162.35 59.9 0.23 Allowed 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 125.283 2.468 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.44 32.93 14.82 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 113.426 -1.715 . . . . 0.0 113.478 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 73.11 28.03 1.94 Allowed 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 111.576 -2.312 . . . . 0.0 111.485 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.45 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -87.15 -28.06 22.68 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 110.896 -2.866 . . . . 0.0 108.165 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.431 ' O ' HG22 ' A' ' 126' ' ' VAL . 0.3 OUTLIER 45.81 119.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 1 O-C-N 131.38 5.425 . . . . 0.0 113.477 -179.766 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.1 t -112.19 120.51 42.04 Favored 'General case' 0 CA--C 1.5 -0.954 0 O-C-N 117.991 -2.943 . . . . 0.0 111.452 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 99.0 8.09 Favored 'General case' 0 CA--C 1.51 -0.578 0 O-C-N 127.105 2.753 . . . . 0.0 112.038 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -79.68 172.2 14.1 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 12.2 t -140.42 148.66 22.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 103.788 -2.671 . . . . 0.0 103.788 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.473 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 18.8 m-85 -138.24 -177.18 4.72 Favored 'General case' 0 CA--C 1.485 -1.534 0 CA-C-O 127.454 3.502 . . . . 0.0 116.797 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.277 9.2 tppt? -162.7 105.18 1.07 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 110.975 -2.83 . . . . 0.0 103.418 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 6.2 ttpt -68.59 78.39 0.28 Allowed 'General case' 0 C--O 1.201 -1.455 0 CA-C-N 111.969 -2.378 . . . . 0.0 113.496 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt . . . . . 0 CA--C 1.481 -1.677 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -179.939 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 50.6 m -160.01 -62.13 0.07 Allowed 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 123.441 1.591 . . . . 0.0 107.847 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.517 ' HG2' ' CZ2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER -68.71 -150.93 0.01 OUTLIER 'General case' 0 C--N 1.357 0.929 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -71.2 -169.74 0.41 Allowed 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.399 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -164.95 148.54 8.65 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 104.451 -2.425 . . . . 0.0 104.451 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -46.16 158.3 0.1 Allowed 'General case' 0 C--N 1.313 -0.982 1 O-C-N 132.83 6.331 . . . . 0.0 116.566 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.77 -167.53 33.68 Favored Glycine 0 C--O 1.203 -1.828 0 O-C-N 127.332 2.895 . . . . 0.0 112.314 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.01 147.01 33.29 Favored 'General case' 0 C--N 1.316 -0.852 1 O-C-N 132.64 5.553 . . . . 0.0 107.801 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.84 ' CE3' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -140.56 130.1 24.08 Favored 'General case' 0 C--N 1.323 -0.548 1 O-C-N 133.282 6.614 . . . . 0.0 111.137 -179.644 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -86.47 -6.25 58.96 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 126.753 2.533 . . . . 0.0 115.332 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.476 ' HG3' ' CE1' ' A' ' 131' ' ' PHE . 19.8 ttm 54.88 85.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.678 0 O-C-N 125.073 1.483 . . . . 0.0 107.257 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -25.43 -38.01 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 131.034 3.734 . . . . 0.0 110.741 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 173.47 169.17 0.17 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 126.753 3.168 . . . . 0.0 111.513 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -104.88 160.86 14.67 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 108.653 -3.885 . . . . 0.0 114.757 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -122.97 -64.41 1.18 Allowed 'General case' 0 CA--C 1.494 -1.183 1 O-C-N 130.275 4.734 . . . . 0.0 113.978 179.79 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -127.22 85.9 2.43 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.681 -1.145 . . . . 0.0 113.872 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -43.44 7.62 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.687 3.117 . . . . 0.0 112.378 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.262 32.9 tt0 -79.6 -35.34 39.73 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 111.096 -2.775 . . . . 0.0 114.282 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -76.91 -22.73 71.05 Favored Glycine 0 N--CA 1.478 1.481 0 C-N-CA 115.301 -3.333 . . . . 0.0 110.917 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.527 ' CE1' HD11 ' A' ' 120' ' ' LEU . 8.9 t80 -62.4 -33.38 74.65 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 124.608 2.147 . . . . 0.0 108.522 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.478 ' HB3' ' CG2' ' A' ' 26' ' ' ILE 0.282 51.4 mtp -75.64 -26.05 57.4 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-N 112.876 -1.965 . . . . 0.0 108.63 -179.752 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -80.02 -29.05 39.31 Favored 'General case' 0 C--N 1.312 -1.057 0 O-C-N 125.511 1.757 . . . . 0.0 112.841 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.61 -46.23 84.35 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 111.061 -2.79 . . . . 0.0 113.925 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.827 HD11 ' HB ' ' A' ' 26' ' ' ILE . 4.0 pp -83.82 -27.12 28.99 Favored 'General case' 0 N--CA 1.48 1.043 1 O-C-N 130.029 4.581 . . . . 0.0 103.005 179.11 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 80.99 93.4 0.05 OUTLIER 'General case' 0 CA--C 1.483 -1.633 1 CA-C-O 129.486 4.469 . . . . 0.0 114.312 179.252 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.827 ' HB ' HD11 ' A' ' 24' ' ' LEU . 1.0 OUTLIER -134.23 20.78 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-O 127.415 3.483 . . . . 0.0 107.669 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.54 99.45 0.03 OUTLIER 'General case' 0 C--N 1.366 1.309 0 CA-C-N 112.27 -2.241 . . . . 0.0 113.516 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -132.98 16.01 4.22 Favored 'General case' 0 CA--C 1.488 -1.423 0 O-C-N 128.81 3.819 . . . . 0.0 112.144 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 48.6 38.65 11.69 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-O 126.321 2.962 . . . . 0.0 109.987 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.19 -11.17 33.38 Favored 'General case' 0 C--N 1.349 0.556 1 CA-C-N 108.326 -4.034 . . . . 0.0 112.092 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -102.31 -172.37 2.12 Favored 'General case' 0 C--O 1.222 -0.373 1 O-C-N 130.791 5.057 . . . . 0.0 110.872 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 91.6 -9.27 0.24 Allowed 'General case' 0 C--O 1.202 -1.428 1 O-C-N 131.312 5.383 . . . . 0.0 112.99 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.655 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.6 OUTLIER -125.79 4.16 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 O-C-N 128.238 3.461 . . . . 0.0 111.682 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -120.8 31.75 6.28 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 123.182 1.468 . . . . 0.0 108.488 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -41.19 -42.24 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.303 0 CA-C-N 110.739 -2.937 . . . . 0.0 111.242 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.734 ' C ' HD23 ' A' ' 37' ' ' LEU . 7.0 tmm_? 150.26 125.02 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.149 2 CA-C-N 107.472 -4.422 . . . . 0.0 113.07 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.914 HD11 ' CZ ' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -145.14 110.69 5.34 Favored 'General case' 0 N--CA 1.435 -1.178 1 O-C-N 129.428 4.205 . . . . 0.0 107.343 -179.961 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.7 m 75.94 25.43 1.11 Allowed 'General case' 0 CA--C 1.502 -0.9 1 O-C-N 132.991 6.432 . . . . 0.0 112.653 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.494 ' CB ' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -70.12 110.67 5.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.026 2.704 . . . . 0.0 116.23 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.4 m -137.58 101.67 4.55 Favored 'General case' 0 C--O 1.206 -1.189 1 O-C-N 129.178 4.049 . . . . 0.0 113.203 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.589 ' HZ1' HD11 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -77.72 139.75 39.44 Favored 'General case' 0 C--O 1.222 -0.372 0 O-C-N 126.671 2.482 . . . . 0.0 108.795 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.443 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.3 mp -125.15 161.45 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 126.509 2.38 . . . . 0.0 109.698 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.742 HD11 ' HE2' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -137.12 126.14 35.76 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.528 0 O-C-N 127.504 3.003 . . . . 0.0 110.439 -179.813 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.655 ' N ' HD13 ' A' ' 43' ' ' ILE . 93.8 t -129.48 86.67 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 112.443 -2.162 . . . . 0.0 111.128 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.61 140.41 32.07 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 127.107 2.754 . . . . 0.0 112.199 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -151.7 31.95 0.57 Allowed 'General case' 0 CA--C 1.488 -1.408 1 CA-C-N 107.435 -4.438 . . . . 0.0 117.41 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.92 -70.07 1.35 Allowed Glycine 0 C--O 1.205 -1.682 0 O-C-N 119.941 -1.724 . . . . 0.0 111.29 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.61 98.28 3.65 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 129.159 3.505 . . . . 0.0 110.695 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.451 ' ND2' ' HE2' ' A' ' 51' ' ' LYS . 42.1 t30 116.66 79.68 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.604 1 O-C-N 129.577 4.298 . . . . 0.0 108.463 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.742 ' HE2' HD11 ' A' ' 43' ' ' ILE . 7.6 t80 -90.5 125.96 35.76 Favored 'General case' 0 C--N 1.313 -1.004 1 O-C-N 131.974 5.797 . . . . 0.0 110.08 179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.451 ' HE2' ' ND2' ' A' ' 49' ' ' ASN . 2.8 mttt -137.05 80.08 1.79 Allowed 'General case' 0 CA--C 1.492 -1.259 0 O-C-N 128.267 3.479 . . . . 0.0 119.027 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.517 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -60.3 157.64 13.23 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 128.397 3.561 . . . . 0.0 107.053 179.476 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 62' ' ' ASP . 0.3 OUTLIER -167.64 141.56 3.54 Favored 'General case' 0 CA--C 1.487 -1.454 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.571 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.53 161.32 14.41 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.617 1.198 . . . . 0.0 111.258 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -128.59 28.72 5.38 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 116.219 1.933 . . . . 0.0 116.219 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 91.0 p -64.3 145.83 55.39 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 128.65 3.719 . . . . 0.0 105.102 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.8 m -64.82 -27.35 68.82 Favored 'General case' 0 N--CA 1.469 0.496 1 O-C-N 132.101 5.876 . . . . 0.0 107.46 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.914 ' CZ ' HD11 ' A' ' 37' ' ' LEU . 4.3 m-30 -82.21 -79.02 0.19 Allowed 'General case' 0 C--O 1.239 0.543 0 O-C-N 128.799 3.812 . . . . 0.0 117.615 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -115.8 88.58 2.91 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 127.603 3.064 . . . . 0.0 115.269 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -92.47 63.3 4.1 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.221 4.076 . . . . 0.0 110.636 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -88.57 111.79 22.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 111.772 -2.467 . . . . 0.0 109.394 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 17.5 p30 -77.64 161.87 27.47 Favored 'General case' 0 C--O 1.204 -1.294 0 O-C-N 127.437 2.961 . . . . 0.0 115.717 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.517 ' HB2' HG22 ' A' ' 52' ' ' THR . 12.4 tp -106.8 45.41 0.98 Allowed 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 112.697 -2.047 . . . . 0.0 111.554 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -71.59 95.0 1.37 Allowed 'General case' 0 C--O 1.203 -1.382 1 O-C-N 129.285 4.116 . . . . 0.0 110.704 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.681 ' CE2' HG22 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -159.57 132.29 6.74 Favored 'General case' 0 CA--C 1.483 -1.606 1 CA-C-O 131.111 5.243 . . . . 0.0 112.912 179.93 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.481 HG23 ' N ' ' A' ' 67' ' ' VAL . 0.4 OUTLIER -85.83 172.04 11.07 Favored 'General case' 0 C--O 1.21 -1.012 0 O-C-N 116.835 -3.666 . . . . 0.0 110.32 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.935 HG21 ' CD1' ' A' ' 89' ' ' TRP . 10.3 t -82.12 136.02 23.8 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.909 0 O-C-N 127.86 3.225 . . . . 0.0 112.916 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.56 5.85 19.48 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.687 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.427 HG11 ' HD1' ' A' ' 71' ' ' PHE . 8.2 p -60.87 -20.93 22.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.192 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 58.14 72.58 0.51 Allowed 'General case' 0 C--N 1.353 0.718 1 O-C-N 130.344 4.777 . . . . 0.0 109.047 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.58 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.4 OUTLIER -66.88 141.42 57.66 Favored 'General case' 0 CA--C 1.493 -1.24 2 CA-C-N 106.648 -4.796 . . . . 0.0 118.254 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -120.91 63.47 0.87 Allowed 'General case' 0 CA--C 1.485 -1.533 0 CA-C-O 124.21 1.957 . . . . 0.0 113.541 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -55.18 143.13 28.57 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-O 125.081 2.372 . . . . 0.0 108.514 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -111.32 18.69 19.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 112.972 -1.922 . . . . 0.0 115.789 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 16.73 98.77 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.06 0 O-C-N 127.095 2.747 . . . . 0.0 115.956 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.84 146.07 27.79 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 128.116 3.385 . . . . 0.0 115.479 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.16 -32.1 7.98 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-N 110.04 -3.255 . . . . 0.0 110.666 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.565 ' O ' HD12 ' A' ' 26' ' ' ILE . 7.2 tp -117.86 -4.23 11.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 129.617 3.775 . . . . 0.0 116.655 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.433 ' HB3' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -159.75 -72.43 0.08 Allowed 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 118.296 -1.361 . . . . 0.0 114.361 -179.879 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.21 84.88 1.79 Allowed Glycine 0 N--CA 1.466 0.688 0 CA-C-O 122.188 0.882 . . . . 0.0 111.273 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.446 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.0 OUTLIER -148.87 -127.32 0.05 Allowed 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.861 -2.17 . . . . 0.0 114.716 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.446 ' ND2' ' O ' ' A' ' 81' ' ' ARG . 3.3 p30 164.43 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 124.533 1.145 . . . . 0.0 110.069 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.439 HG13 ' HA2' ' A' ' 100' ' ' GLY . 0.8 OUTLIER -146.59 165.92 7.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.798 0 N-CA-C 117.443 2.386 . . . . 0.0 117.443 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.482 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -74.82 167.7 21.33 Favored 'General case' 0 C--O 1.241 0.628 2 O-C-N 132.58 6.175 . . . . 0.0 107.715 179.458 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.58 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.2 m -173.4 86.69 0.06 Allowed 'General case' 0 C--O 1.194 -1.828 1 O-C-N 130.197 4.685 . . . . 0.0 111.1 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 110.18 21.56 Favored 'General case' 0 N--CA 1.43 -1.444 1 CA-C-N 106.862 -4.699 . . . . 0.0 116.874 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.681 HG22 ' CE2' ' A' ' 65' ' ' PHE . 17.6 t -80.77 150.59 4.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 CA-C-N 111.859 -2.428 . . . . 0.0 108.667 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.287 22.3 m -160.14 145.77 15.28 Favored 'General case' 0 CA--C 1.474 -1.962 0 CA-C-N 112.608 -2.087 . . . . 0.0 109.964 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.935 ' CD1' HG21 ' A' ' 67' ' ' VAL . 8.9 m95 -85.69 129.09 34.91 Favored 'General case' 0 C--N 1.357 0.899 0 CA-C-O 113.696 -3.05 . . . . 0.0 105.461 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.544 ' HB3' HG21 ' A' ' 93' ' ' THR . 0.5 OUTLIER -99.33 -9.53 23.43 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 127.224 3.392 . . . . 0.0 116.243 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 147.34 -78.2 0.24 Allowed Glycine 0 C--O 1.194 -2.363 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.486 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -134.75 100.5 4.63 Favored 'General case' 0 C--O 1.195 -1.788 1 O-C-N 131.502 4.884 . . . . 0.0 103.265 179.591 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.544 HG21 ' HB3' ' A' ' 90' ' ' GLU . 4.5 t 166.42 -131.87 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 127.478 2.986 . . . . 0.0 113.132 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.587 HD22 ' CE1' ' A' ' 50' ' ' PHE 0.292 1.2 tp 166.19 70.03 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 129.697 3.199 . . . . 0.0 113.925 179.465 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.36 45.5 t -74.66 132.72 32.9 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 N-CA-C 118.586 2.81 . . . . 0.0 118.586 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -137.72 129.67 28.78 Favored 'General case' 0 C--O 1.199 -1.56 0 N-CA-C 103.05 -2.944 . . . . 0.0 103.05 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.2 t -104.37 99.62 8.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 C-N-CA 127.254 2.222 . . . . 0.0 116.527 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.84 93.14 5.58 Favored 'General case' 0 C--N 1.36 1.022 0 CA-C-O 125.398 2.523 . . . . 0.0 110.682 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.482 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -75.55 87.35 2.66 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 111.89 -2.413 . . . . 0.0 111.089 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.439 ' HA2' HG13 ' A' ' 83' ' ' VAL . . . -118.66 165.65 12.94 Favored Glycine 0 C--O 1.209 -1.432 1 CA-C-O 128.566 4.425 . . . . 0.0 113.823 -179.671 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -129.89 109.48 10.94 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 109.98 -3.11 . . . . 0.0 110.798 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? 125.89 -36.25 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.291 0 O-C-N 127.708 3.13 . . . . 0.0 110.881 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.18 156.24 43.28 Favored 'General case' 0 C--O 1.199 -1.587 1 CA-C-N 107.83 -4.259 . . . . 0.0 113.393 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -115.29 118.53 33.53 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 109.868 -3.333 . . . . 0.0 103.537 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 122' ' ' CYS . 6.5 mmt85 -110.91 11.84 22.27 Favored 'General case' 0 C--O 1.213 -0.835 1 O-C-N 129.746 4.404 . . . . 0.0 109.523 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -51.81 92.85 0.01 OUTLIER Glycine 0 N--CA 1.429 -1.789 2 CA-C-N 106.814 -4.721 . . . . 0.0 111.929 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.44 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.262 0.0 OUTLIER -107.43 143.14 36.19 Favored 'General case' 0 C--O 1.206 -1.214 1 O-C-N 130.786 4.463 . . . . 0.0 109.904 179.662 . . . . . . . . 5 4 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.524 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 2.3 ptpt -158.14 172.22 18.8 Favored 'General case' 0 CA--C 1.507 -0.705 1 O-C-N 132.095 5.872 . . . . 0.0 114.43 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.682 ' NE2' HD22 ' A' ' 118' ' ' LEU . 0.0 OUTLIER -122.44 176.69 5.75 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 113.86 -2.971 . . . . 0.0 105.0 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.524 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 20.0 m95 -133.28 -55.64 0.91 Allowed 'General case' 0 C--N 1.311 -1.075 0 O-C-N 125.988 2.055 . . . . 0.0 112.001 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.535 HG23 ' HA ' ' A' ' 93' ' ' THR . 10.8 t 87.37 57.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.777 1 CA-C-O 130.222 4.82 . . . . 0.0 110.134 -176.598 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.95 67.55 1.27 Allowed 'General case' 0 CA--C 1.478 -1.812 1 CA-C-N 107.006 -4.634 . . . . 0.0 117.757 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 87.83 -88.39 1.56 Allowed Glycine 0 C--O 1.202 -1.887 0 N-CA-C 117.527 1.771 . . . . 0.0 117.527 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.474 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 74.5 m-20 -100.94 -23.9 14.45 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 118.962 2.949 . . . . 0.0 118.962 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.474 ' HE2' ' HB2' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -130.72 -168.45 1.99 Allowed 'General case' 0 CA--C 1.499 -0.981 1 O-C-N 130.205 4.691 . . . . 0.0 110.199 179.987 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.84 HD22 ' CE3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -146.31 94.66 2.49 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 128.123 3.821 . . . . 0.0 111.156 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.14 124.47 20.07 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 109.145 -3.662 . . . . 0.0 110.47 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.682 HD22 ' NE2' ' A' ' 109' ' ' GLN . 2.6 mt -95.2 72.2 3.32 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 127.539 3.024 . . . . 0.0 108.882 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -71.39 91.89 1.04 Allowed 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 128.964 3.915 . . . . 0.0 110.909 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.658 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -102.87 160.4 14.64 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 114.26 -1.336 . . . . 0.0 107.55 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.658 ' O ' HD12 ' A' ' 120' ' ' LEU . 4.7 m -124.17 168.73 12.53 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.365 1.666 . . . . 0.0 110.799 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.475 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 10.3 t -167.8 50.8 0.06 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 126.347 2.975 . . . . 0.0 110.38 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 103.29 6.91 44.22 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 112.244 -2.253 . . . . 0.0 112.284 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.9 t0 100.57 28.45 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.058 0 O-C-N 128.523 3.131 . . . . 0.0 112.299 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -85.36 -17.27 37.23 Favored 'General case' 0 C--O 1.206 -1.188 0 C-N-CA 114.207 -2.997 . . . . 0.0 105.468 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 33.3 85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 O-C-N 129.051 3.969 . . . . 0.0 113.284 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 77.0 m -59.44 152.48 21.46 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.18 70.95 1.46 Allowed 'General case' 0 CA--C 1.486 -1.501 0 CA-C-O 124.374 2.035 . . . . 0.0 112.604 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -57.49 170.51 0.53 Allowed 'General case' 0 C--N 1.358 0.936 0 C-N-CA 116.611 -2.035 . . . . 0.0 111.695 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 11.5 t -141.62 105.03 1.4 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.295 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.476 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 12.0 m-85 -99.28 162.37 13.09 Favored 'General case' 0 CA--C 1.494 -1.204 1 CA-C-N 108.111 -4.131 . . . . 0.0 117.628 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.452 ' C ' ' HD2' ' A' ' 132' ' ' LYS 0.384 0.0 OUTLIER -147.82 129.44 15.04 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 110.579 -3.01 . . . . 0.0 104.471 179.989 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.516 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 17.0 tttm -68.53 122.62 18.85 Favored 'General case' 0 C--O 1.198 -1.606 0 O-C-N 127.406 2.941 . . . . 0.0 110.997 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.245 0.861 0 CA-C-O 115.932 -1.985 . . . . 0.0 115.028 -179.906 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 122.705 1.24 . . . . 0.0 108.696 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.3 m -162.67 -52.14 0.04 OUTLIER 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 112.196 -2.274 . . . . 0.0 107.096 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.77 157.6 25.25 Favored 'General case' 0 CA--C 1.491 -1.3 0 O-C-N 127.685 3.116 . . . . 0.0 115.01 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.48 136.63 53.51 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.5 -2.778 . . . . 0.0 103.5 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.502 ' HA ' ' HB3' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -178.83 154.14 0.7 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 114.875 -2.488 . . . . 0.0 105.262 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 24.29 108.67 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.712 1 O-C-N 133.398 6.686 . . . . 0.0 116.934 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.511 ' N ' HG22 ' A' ' 43' ' ' ILE . . . -177.22 147.86 8.52 Favored Glycine 0 C--O 1.211 -1.296 0 CA-C-N 113.411 -1.722 . . . . 0.0 113.333 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.676 HG22 HG23 ' A' ' 42' ' ' ILE . 62.7 p -124.7 63.39 1.12 Allowed 'General case' 0 C--O 1.201 -1.451 0 O-C-N 127.228 2.369 . . . . 0.0 105.813 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.625 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -62.77 128.1 34.34 Favored 'General case' 0 N--CA 1.451 -0.421 1 O-C-N 130.838 5.086 . . . . 0.0 111.282 -179.672 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -77.41 -12.06 59.91 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.483 ' HB2' ' HE3' ' A' ' 11' ' ' MET . 37.6 ttm 54.53 74.97 0.32 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 105.439 -2.059 . . . . 0.0 105.439 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.538 ' HG3' ' HG2' ' A' ' 132' ' ' LYS . 91.3 mt-10 -47.77 -51.9 20.67 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 127.01 2.694 . . . . 0.0 109.883 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.96 154.54 42.03 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 111.511 -2.586 . . . . 0.0 111.356 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.528 HD22 ' HD1' ' A' ' 17' ' ' PHE . 0.0 OUTLIER -134.58 141.12 46.55 Favored 'General case' 0 CA--C 1.483 -1.63 0 O-C-N 128.49 3.619 . . . . 0.0 111.403 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -77.21 -169.81 1.5 Allowed 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 112.661 -2.063 . . . . 0.0 114.085 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -30.1 100.42 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.386 0 C-N-CA 127.108 2.163 . . . . 0.0 114.326 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.528 ' HD1' HD22 ' A' ' 14' ' ' ASN . 1.0 OUTLIER -96.91 -24.8 15.68 Favored 'General case' 0 C--O 1.204 -1.299 0 O-C-N 125.791 1.932 . . . . 0.0 109.547 -179.492 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -76.67 -37.6 55.93 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 113.45 -1.704 . . . . 0.0 112.762 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.7 -24.62 60.03 Favored Glycine 0 N--CA 1.487 2.048 0 C-N-CA 115.951 -3.023 . . . . 0.0 106.547 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.529 ' O ' HD23 ' A' ' 24' ' ' LEU . 1.1 t80 -68.58 -27.77 66.35 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-O 127.236 3.398 . . . . 0.0 108.488 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.569 ' HG2' HG22 ' A' ' 26' ' ' ILE . 3.5 ttt -70.22 -33.57 71.83 Favored 'General case' 0 CA--C 1.488 -1.442 0 CA-C-N 112.704 -2.044 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.9 mtmt -77.0 -21.76 54.16 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 109.177 -3.647 . . . . 0.0 115.987 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.01 -46.49 74.34 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 127.637 3.085 . . . . 0.0 113.456 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.609 HD11 ' HB ' ' A' ' 26' ' ' ILE . 0.5 OUTLIER -96.77 -9.91 27.86 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 128.593 3.683 . . . . 0.0 108.176 -179.71 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t0 38.75 93.78 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.436 1 CA-C-O 129.296 4.379 . . . . 0.0 112.078 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.609 ' HB ' HD11 ' A' ' 24' ' ' LEU . 14.0 tt -105.3 39.38 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 108.684 -3.871 . . . . 0.0 108.525 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.4 t70 81.83 144.77 0.08 Allowed 'General case' 0 C--N 1.352 0.676 0 CA-C-O 116.485 -1.722 . . . . 0.0 108.658 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -96.71 155.57 16.72 Favored 'General case' 0 C--O 1.204 -1.301 1 O-C-N 129.389 4.181 . . . . 0.0 115.746 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.3 77.84 0.29 Allowed 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 111.951 -2.386 . . . . 0.0 105.268 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.6 m -137.62 -61.07 0.64 Allowed 'General case' 0 C--N 1.354 0.791 2 CA-C-N 105.502 -5.317 . . . . 0.0 116.135 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HD3' ' N ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -69.98 -155.05 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.986 0 O-C-N 128.419 3.574 . . . . 0.0 114.423 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.424 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.1 OUTLIER 89.33 -2.77 0.38 Allowed 'General case' 0 C--O 1.204 -1.34 1 O-C-N 130.502 4.876 . . . . 0.0 111.293 -179.722 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.409 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.8 OUTLIER -149.92 35.92 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.671 0 CA-C-N 110.436 -3.075 . . . . 0.0 109.033 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -141.6 35.32 1.63 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 126.025 2.822 . . . . 0.0 108.573 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -53.71 -34.27 24.31 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.457 0 CA-C-N 110.564 -3.017 . . . . 0.0 110.327 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.706 ' C ' HD23 ' A' ' 37' ' ' LEU . 16.1 ttp85 158.0 131.52 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.35 1 CA-C-N 107.488 -4.414 . . . . 0.0 111.584 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.06 HD21 ' CE2' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -130.44 83.9 2.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.543 -3.026 . . . . 0.0 105.65 -179.253 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 m 70.14 -21.07 0.18 Allowed 'General case' 0 C--N 1.317 -0.814 1 O-C-N 134.123 7.139 . . . . 0.0 117.436 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -13.74 92.18 0.01 OUTLIER 'General case' 0 CA--C 1.492 -1.251 0 O-C-N 127.773 3.171 . . . . 0.0 118.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -99.58 101.81 13.13 Favored 'General case' 0 C--O 1.203 -1.375 1 O-C-N 133.443 6.714 . . . . 0.0 109.182 179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.535 ' HE3' HD22 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -81.57 131.64 35.28 Favored 'General case' 0 N--CA 1.485 1.291 1 O-C-N 129.152 4.033 . . . . 0.0 109.6 -179.353 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.676 HG23 HG22 ' A' ' 8' ' ' THR . 8.1 mt -117.82 158.67 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 127.19 2.806 . . . . 0.0 109.814 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.511 HG22 ' N ' ' A' ' 7' ' ' GLY 0.28 0.0 OUTLIER -140.17 146.95 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.444 1 O-C-N 129.123 4.014 . . . . 0.0 109.117 -179.752 . . . . . . . . 5 4 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.454 ' N ' ' O ' ' A' ' 51' ' ' LYS . 79.6 t -153.14 85.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.1 0 CA-C-N 113.204 -1.816 . . . . 0.0 108.299 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.502 ' HB3' ' HA ' ' A' ' 5' ' ' GLN . 0.3 OUTLIER -103.18 117.37 34.38 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 126.605 2.441 . . . . 0.0 113.367 -179.282 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -151.48 106.69 3.31 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 111.249 -2.705 . . . . 0.0 116.848 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 33.97 100.79 0.01 OUTLIER Glycine 0 C--O 1.22 -0.768 0 O-C-N 126.951 2.657 . . . . 0.0 117.913 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.7 t0 78.94 -59.04 0.41 Allowed 'General case' 0 N--CA 1.441 -0.888 0 O-C-N 125.951 1.618 . . . . 0.0 115.087 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.08 116.83 29.27 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 125.067 1.347 . . . . 0.0 112.818 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.602 ' CE2' HD22 ' A' ' 94' ' ' LEU . 8.4 t80 -121.16 119.9 33.69 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 127.271 2.857 . . . . 0.0 117.096 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.472 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -134.32 152.61 51.91 Favored 'General case' 0 C--O 1.193 -1.914 0 O-C-N 128.412 3.57 . . . . 0.0 112.169 179.561 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.622 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -133.33 174.09 10.77 Favored 'General case' 0 CA--C 1.508 -0.635 2 O-C-N 129.914 4.509 . . . . 0.0 106.816 179.645 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.518 ' N ' HG23 ' A' ' 52' ' ' THR . 0.1 OUTLIER -177.22 142.61 0.36 Allowed 'General case' 0 CA--C 1.482 -1.636 0 O-C-N 128.442 3.589 . . . . 0.0 109.893 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.427 HG23 ' HA ' ' A' ' 60' ' ' ASN . 6.5 t -92.03 158.97 15.94 Favored 'General case' 0 CA--C 1.51 -0.565 0 O-C-N 127.917 3.26 . . . . 0.0 111.738 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -131.18 33.53 4.12 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 113.834 -1.53 . . . . 0.0 114.521 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.4 t -72.97 159.41 33.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 126.476 2.36 . . . . 0.0 108.2 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.5 m -70.8 -36.09 72.82 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 110.617 -2.992 . . . . 0.0 105.409 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 1.06 ' CE2' HD21 ' A' ' 37' ' ' LEU . 5.4 m-85 -66.8 -62.42 1.45 Allowed 'General case' 0 C--N 1.361 1.082 0 CA-C-N 112.698 -2.046 . . . . 0.0 111.321 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -139.37 174.99 9.95 Favored 'General case' 0 C--N 1.361 1.099 2 CA-C-N 107.049 -4.614 . . . . 0.0 114.625 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.427 ' HA ' HG23 ' A' ' 54' ' ' THR . 1.5 m120 -146.11 39.88 1.12 Allowed 'General case' 0 C--O 1.203 -1.381 2 O-C-N 130.596 4.935 . . . . 0.0 111.03 -179.573 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -64.02 176.95 0.86 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 126.664 2.477 . . . . 0.0 109.089 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -146.19 146.22 30.73 Favored 'General case' 0 C--O 1.199 -1.597 0 O-C-N 128.207 3.442 . . . . 0.0 116.769 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.622 ' HB2' HG22 ' A' ' 52' ' ' THR . 14.0 tp -92.24 47.44 1.33 Allowed 'General case' 0 C--N 1.361 1.073 0 CA-C-N 111.644 -2.526 . . . . 0.0 111.283 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 -60.92 93.37 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.478 ' CD2' HG21 ' A' ' 87' ' ' VAL . 1.6 m-30 -121.12 -178.09 3.67 Favored 'General case' 0 CA--C 1.491 -1.291 0 CA-C-O 126.962 3.268 . . . . 0.0 110.647 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -164.32 148.83 9.8 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 109.995 -3.275 . . . . 0.0 104.446 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.547 HG23 ' HA ' ' A' ' 88' ' ' THR . 12.0 p -68.81 133.16 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.202 0 O-C-N 127.276 2.86 . . . . 0.0 113.698 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.32 40.13 84.29 Favored Glycine 0 N--CA 1.483 1.8 0 CA-C-N 109.984 -3.28 . . . . 0.0 115.789 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -85.71 -14.97 10.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 C-N-CA 117.761 -1.575 . . . . 0.0 108.873 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 53.66 64.96 1.65 Allowed 'General case' 0 C--O 1.217 -0.612 1 O-C-N 131.981 5.8 . . . . 0.0 108.463 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.436 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 5.5 t80 -54.81 137.86 43.89 Favored 'General case' 0 CA--C 1.499 -1.018 1 O-C-N 129.879 4.487 . . . . 0.0 114.779 -178.889 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -102.4 71.0 1.19 Allowed 'General case' 0 C--O 1.202 -1.439 0 O-C-N 125.547 1.78 . . . . 0.0 108.032 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -53.64 130.59 36.83 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 125.161 2.41 . . . . 0.0 111.351 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -142.83 38.19 1.46 Allowed 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 110.675 -2.966 . . . . 0.0 112.028 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.442 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -38.61 160.68 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.733 0 CA-C-N 111.232 -2.713 . . . . 0.0 116.315 -179.96 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.442 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.6 135.83 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 126.796 3.189 . . . . 0.0 112.447 179.469 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.85 -12.61 14.92 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 111.252 -2.704 . . . . 0.0 106.84 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 tp -117.31 -61.36 1.72 Allowed 'General case' 0 C--N 1.352 0.677 0 CA-C-N 108.993 -3.603 . . . . 0.0 116.583 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -123.19 -53.89 1.81 Allowed 'General case' 0 C--O 1.214 -0.801 0 CA-C-O 123.226 1.489 . . . . 0.0 112.793 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.48 79.08 0.79 Allowed Glycine 0 C--O 1.207 -1.591 0 CA-C-O 125.191 2.551 . . . . 0.0 111.425 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.464 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 2.6 tpt180 -144.36 -101.34 0.11 Allowed 'General case' 0 N--CA 1.486 1.372 1 CA-C-N 107.513 -4.344 . . . . 0.0 113.875 -179.877 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.464 ' N ' ' HG3' ' A' ' 81' ' ' ARG . 0.5 OUTLIER 153.76 120.7 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 O-C-N 127.147 2.78 . . . . 0.0 108.368 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.556 HG12 ' H ' ' A' ' 84' ' ' LYS . 2.1 t -141.97 178.22 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 0 O-C-N 127.717 3.136 . . . . 0.0 113.266 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.556 ' H ' HG12 ' A' ' 83' ' ' VAL . 1.7 mtmt -119.87 95.6 4.83 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 127.038 2.711 . . . . 0.0 110.701 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 91.1 m -91.54 81.06 5.37 Favored 'General case' 0 C--O 1.195 -1.785 0 O-C-N 126.34 2.275 . . . . 0.0 115.244 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 0.6 OUTLIER -69.84 148.36 49.17 Favored 'General case' 0 N--CA 1.433 -1.319 2 CA-C-N 106.525 -4.852 . . . . 0.0 110.849 179.882 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.605 HG13 ' SG ' ' A' ' 96' ' ' CYS . 38.7 t -131.48 143.95 38.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 124.766 1.226 . . . . 0.0 110.731 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.547 ' HA ' HG23 ' A' ' 67' ' ' VAL . 0.7 OUTLIER -164.93 174.06 10.95 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.085 -1.871 . . . . 0.0 111.853 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.697 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 68.9 m95 -98.35 150.0 22.05 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 114.625 -2.607 . . . . 0.0 110.317 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.63 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.6 OUTLIER -96.43 -8.28 32.73 Favored 'General case' 0 C--O 1.206 -1.231 1 CA-C-O 131.808 5.575 . . . . 0.0 112.911 179.665 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.32 -18.15 8.89 Favored Glycine 0 C--O 1.211 -1.283 2 CA-C-N 107.7 -4.318 . . . . 0.0 102.846 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.426 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.3 OUTLIER -171.27 75.39 0.06 Allowed 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 128.919 2.888 . . . . 0.0 110.731 -179.865 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 90' ' ' GLU . 6.4 t 132.92 154.88 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.716 3.206 . . . . 0.0 118.365 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.602 HD22 ' CE2' ' A' ' 50' ' ' PHE . 1.1 tp -81.65 105.6 12.92 Favored 'General case' 0 CA--C 1.493 -1.23 0 O-C-N 127.315 2.885 . . . . 0.0 114.868 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.63 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.296 88.8 t -107.43 110.62 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 111.589 -2.55 . . . . 0.0 111.771 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.605 ' SG ' HG13 ' A' ' 87' ' ' VAL . 33.0 m -130.41 144.34 51.33 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.74 118.18 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.069 0 CA-C-N 112.333 -2.212 . . . . 0.0 116.765 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.464 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 5.3 mt-30 -84.78 93.1 8.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 125.651 2.643 . . . . 0.0 109.009 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -86.33 123.11 31.21 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-N 107.485 -4.416 . . . . 0.0 109.016 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -131.83 -85.6 0.32 Allowed Glycine 0 C--O 1.202 -1.885 0 CA-C-O 126.415 3.23 . . . . 0.0 108.271 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.438 ' HG2' ' N ' ' A' ' 102' ' ' LYS . 43.7 tt0 -149.97 -78.42 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 1 CA-C-N 107.752 -4.224 . . . . 0.0 112.951 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.5 ' HD2' ' HG3' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -94.71 -9.22 35.44 Favored 'General case' 0 C--O 1.206 -1.224 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.5 ' HG3' ' HD2' ' A' ' 102' ' ' LYS . 4.5 mt-10 -97.51 152.99 18.44 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -140.64 83.35 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 2 O-C-N 132.437 6.085 . . . . 0.0 101.906 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.464 ' HB2' ' CG ' ' A' ' 98' ' ' GLN . 16.7 mmm-85 -88.69 12.33 15.13 Favored 'General case' 0 C--O 1.22 -0.492 0 O-C-N 126.947 2.655 . . . . 0.0 115.284 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.53 109.37 1.74 Allowed Glycine 0 CA--C 1.541 1.702 1 O-C-N 130.533 4.895 . . . . 0.0 116.38 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.54 ' CH2' ' HB2' ' A' ' 96' ' ' CYS . 6.9 p90 -95.65 3.44 53.98 Favored 'General case' 0 N--CA 1.427 -1.623 2 O-C-N 134.858 6.858 . . . . 0.0 114.285 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -20.9 141.21 0.0 OUTLIER 'General case' 0 C--N 1.363 1.154 1 O-C-N 130.483 4.865 . . . . 0.0 115.886 -178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -107.46 167.96 9.57 Favored 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.566 -2.561 . . . . 0.0 110.531 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -173.94 61.9 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.02 1 O-C-N 130.736 5.022 . . . . 0.0 116.889 179.04 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.403 HG23 ' H ' ' A' ' 111' ' ' VAL . 99.9 t -22.53 94.1 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.634 0 O-C-N 126.672 2.483 . . . . 0.0 114.335 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.459 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -90.19 16.25 8.88 Favored 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 124.71 2.195 . . . . 0.0 115.341 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.74 122.6 4.02 Favored Glycine 0 C--O 1.197 -2.175 0 CA-C-N 113.908 -1.496 . . . . 0.0 114.378 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 63.23 6.09 2.23 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 119.216 3.043 . . . . 0.0 119.216 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.457 ' HE2' ' CE1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -167.97 -153.95 0.14 Allowed 'General case' 0 CA--C 1.496 -1.106 1 O-C-N 129.539 4.274 . . . . 0.0 110.977 179.931 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.535 HD22 ' HE3' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -162.78 110.48 1.28 Allowed 'General case' 0 CA--C 1.478 -1.805 0 C-N-CA 113.556 -3.258 . . . . 0.0 112.886 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.459 ' CD1' ' HB2' ' A' ' 112' ' ' GLU . 83.0 m-85 -66.48 80.52 0.1 Allowed 'General case' 0 C--N 1.351 0.66 1 CA-C-N 108.023 -4.171 . . . . 0.0 117.227 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 116' ' ' LEU . 1.3 tt -67.04 105.58 1.7 Allowed 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 111.716 -2.493 . . . . 0.0 104.82 178.304 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -109.92 115.72 30.32 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 116.416 -1.754 . . . . 0.0 109.15 -178.006 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -121.89 138.77 54.27 Favored 'General case' 0 CA--C 1.504 -0.816 1 O-C-N 130.386 4.804 . . . . 0.0 113.912 -179.98 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.62 ' O ' HD12 ' A' ' 120' ' ' LEU . 80.5 m -110.63 162.53 14.64 Favored 'General case' 0 C--O 1.2 -1.55 0 CA-C-N 108.642 -3.89 . . . . 0.0 105.651 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.92 54.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 127.051 3.31 . . . . 0.0 112.394 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 94.88 -43.56 2.27 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 109.813 -3.358 . . . . 0.0 114.156 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -141.28 -52.7 0.45 Allowed 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 113.412 -1.394 . . . . 0.0 110.279 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -67.01 148.19 52.26 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 126.919 2.637 . . . . 0.0 107.136 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.1 m -132.7 77.05 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.875 1 O-C-N 129.321 4.138 . . . . 0.0 111.973 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.76 142.81 58.27 Favored 'General case' 0 CA--C 1.497 -1.074 0 CA-C-N 114.59 -1.187 . . . . 0.0 112.133 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -125.47 115.14 19.78 Favored 'General case' 0 CA--C 1.506 -0.724 0 O-C-N 125.515 1.759 . . . . 0.0 115.107 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -99.46 167.42 10.63 Favored 'General case' 0 N--CA 1.487 1.379 1 O-C-N 129.118 4.012 . . . . 0.0 110.416 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.3 -46.14 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 119.595 1.089 . . . . 0.0 111.776 -178.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.422 ' C ' ' HB2' ' A' ' 115' ' ' LYS . 7.3 m-85 66.3 174.68 0.24 Allowed 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 128.955 2.902 . . . . 0.0 116.549 -179.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.538 ' HG2' ' HG3' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -157.11 118.34 3.68 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.625 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 21.2 ttpt -61.6 125.82 25.18 Favored 'General case' 0 C--O 1.207 -1.16 0 CA-C-O 116.231 -1.843 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.528 ' HG2' ' HG2' ' A' ' 133' ' ' LYS . 14.8 ptmt . . . . . 0 C--O 1.265 1.901 0 O-C-N 128.931 3.894 . . . . 0.0 118.864 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.374 0 N-CA-C 105.794 -1.928 . . . . 0.0 105.794 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.0 m -64.17 -44.29 92.5 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.535 ' HB3' ' CH2' ' A' ' 89' ' ' TRP . 5.7 mttt -129.44 -29.02 2.24 Favored 'General case' 0 C--N 1.361 1.104 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.55 120.96 32.08 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -134.8 30.49 3.4 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 113.506 -3.14 . . . . 0.0 108.742 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.5 115.81 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 129.024 3.952 . . . . 0.0 112.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -153.38 -123.5 0.95 Allowed Glycine 0 C--O 1.203 -1.807 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.885 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.491 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER 179.53 148.95 0.28 Allowed 'General case' 0 N--CA 1.475 0.806 1 O-C-N 132.616 5.539 . . . . 0.0 107.686 -179.907 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.556 ' CZ3' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -156.93 106.2 2.22 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 128.932 3.895 . . . . 0.0 116.463 -179.726 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -38.74 -39.14 0.47 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 85.53 34.64 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 113.946 -2.93 . . . . 0.0 107.099 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 20.4 -75.94 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.973 1 O-C-N 130.845 5.091 . . . . 0.0 110.552 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -149.74 160.77 43.27 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 111.649 -2.523 . . . . 0.0 110.662 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -116.47 114.02 23.64 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 110.844 -2.889 . . . . 0.0 117.051 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -47.0 83.87 Favored 'General case' 0 CA--C 1.504 -0.806 1 O-C-N 130.085 4.616 . . . . 0.0 113.269 -179.766 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -128.76 95.93 4.24 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 112.362 -2.199 . . . . 0.0 114.739 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.675 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 2.2 t80 -100.31 -57.1 2.19 Favored 'General case' 0 CA--C 1.489 -1.383 0 CA-C-O 127.12 3.343 . . . . 0.0 108.395 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.475 ' N ' ' CD2' ' A' ' 17' ' ' PHE . 0.2 OUTLIER -65.05 -52.9 53.17 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 118.966 -2.333 . . . . 0.0 114.717 179.814 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.422 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -62.33 -25.14 66.36 Favored Glycine 0 N--CA 1.48 1.607 1 O-C-N 130.09 4.619 . . . . 0.0 111.63 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.538 ' OH ' HD21 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -66.98 -43.74 82.27 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-O 125.148 2.404 . . . . 0.0 108.221 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 mtp -72.05 -23.85 61.44 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-N 113.673 -1.603 . . . . 0.0 112.877 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.422 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 2.2 ttpt -76.21 -27.61 56.91 Favored 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 109.568 -3.469 . . . . 0.0 111.819 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.35 66.73 Favored 'General case' 0 C--N 1.318 -0.804 1 O-C-N 130.099 4.624 . . . . 0.0 112.089 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.79 -11.07 49.07 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 127.421 2.951 . . . . 0.0 104.372 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.3 t0 45.71 80.63 0.04 OUTLIER 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.137 3.827 . . . . 0.0 109.128 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.666 HD12 ' O ' ' A' ' 78' ' ' LEU . 14.1 tt -82.7 -15.8 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 1 CA-C-N 108.065 -4.152 . . . . 0.0 109.772 -179.656 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.405 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 1.3 t0 -173.38 -179.26 1.86 Allowed 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 117.523 -1.671 . . . . 0.0 112.289 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -119.25 86.5 2.56 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 62.5 49.88 3.85 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 126.959 2.662 . . . . 0.0 109.297 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' A' ' 27' ' ' ASP . 1.7 t -88.67 -26.59 21.76 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 108.571 -3.922 . . . . 0.0 113.186 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.403 ' O ' HD13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -68.84 -138.24 0.01 OUTLIER 'General case' 0 C--O 1.242 0.697 1 O-C-N 130.127 4.642 . . . . 0.0 108.435 179.953 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 0.1 OUTLIER 84.35 4.38 0.71 Allowed 'General case' 0 CA--C 1.497 -1.077 0 O-C-N 128.82 3.825 . . . . 0.0 113.291 179.422 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.403 HD13 ' O ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -137.43 -21.92 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.928 0 CA-C-N 110.111 -3.222 . . . . 0.0 114.426 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.721 ' HB1' ' CE2' ' A' ' 58' ' ' PHE . . . -90.49 11.34 22.04 Favored 'General case' 0 C--O 1.206 -1.217 0 CA-C-O 123.386 1.565 . . . . 0.0 112.365 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.5 t -44.73 -40.04 1.93 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-O 123.758 1.742 . . . . 0.0 109.931 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 169.34 117.78 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 109.337 -3.574 . . . . 0.0 115.399 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.864 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.4 OUTLIER -147.86 53.76 1.04 Allowed 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 110.704 -2.953 . . . . 0.0 104.972 179.53 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.1 m 68.87 139.94 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.243 1 O-C-N 135.106 7.754 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -125.78 -65.89 0.97 Allowed 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 117.296 2.332 . . . . 0.0 117.296 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.9 m 56.48 108.49 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.622 1 O-C-N 131.971 5.795 . . . . 0.0 111.628 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.7 149.05 23.23 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 127.988 3.305 . . . . 0.0 103.373 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.462 HG22 ' N ' ' A' ' 43' ' ' ILE . 5.1 mt -137.43 156.24 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 1 O-C-N 129.189 4.056 . . . . 0.0 110.29 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.5 ' HA ' ' HA ' ' A' ' 52' ' ' THR 0.32 6.6 tt -130.36 131.51 65.35 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 O-C-N 126.905 2.628 . . . . 0.0 108.257 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.271 72.4 t -137.58 125.98 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 113.412 -1.722 . . . . 0.0 110.312 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -132.67 88.66 2.55 Favored 'General case' 0 CA--C 1.489 -1.371 0 N-CA-C 118.979 2.955 . . . . 0.0 118.979 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -68.0 -54.78 15.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 C-N-CA 114.266 -2.973 . . . . 0.0 115.018 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.54 105.47 0.2 Allowed Glycine 0 C--O 1.205 -1.719 0 O-C-N 121.169 -0.957 . . . . 0.0 112.489 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 63.41 19.27 11.59 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 119.011 -1.075 . . . . 0.0 110.52 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -130.48 154.3 47.9 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 128.144 3.403 . . . . 0.0 108.399 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.719 ' CD1' HD13 ' A' ' 94' ' ' LEU . 51.1 t80 -155.02 99.92 2.15 Favored 'General case' 0 CA--C 1.484 -1.593 1 O-C-N 129.983 4.552 . . . . 0.0 112.932 -179.718 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -120.12 75.72 1.12 Allowed 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 126.508 2.38 . . . . 0.0 112.546 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 43' ' ' ILE . 0.7 OUTLIER -57.68 145.65 33.55 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 128.857 3.848 . . . . 0.0 106.04 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.479 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 4.2 ptmm? -145.26 152.57 40.17 Favored 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 115.396 -2.522 . . . . 0.0 111.397 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.499 HG23 ' HA ' ' A' ' 60' ' ' ASN . 4.1 t -106.43 155.16 19.85 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 124.934 2.302 . . . . 0.0 112.153 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -130.15 52.21 2.03 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 111.543 -2.571 . . . . 0.0 110.302 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 10.5 p -69.12 -99.69 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.078 1 O-C-N 129.332 4.145 . . . . 0.0 112.33 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.465 ' OG1' HD12 ' A' ' 37' ' ' LEU . 0.6 OUTLIER 153.81 -34.05 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 O-C-N 127.281 2.863 . . . . 0.0 104.27 -179.046 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.864 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -82.39 -60.88 2.05 Favored 'General case' 0 C--N 1.368 1.37 0 O-C-N 128.579 3.674 . . . . 0.0 112.111 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.3 98.41 3.43 Favored 'General case' 0 C--O 1.216 -0.704 2 CA-C-N 107.479 -4.418 . . . . 0.0 113.869 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.499 ' HA ' HG23 ' A' ' 54' ' ' THR . 54.3 m-20 -82.99 65.95 8.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 109.556 -3.475 . . . . 0.0 110.507 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -96.72 80.68 3.09 Favored 'General case' 0 CA--C 1.503 -0.862 0 O-C-N 127.058 2.724 . . . . 0.0 109.052 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.479 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 5.7 p-10 -79.72 132.63 36.24 Favored 'General case' 0 C--O 1.2 -1.507 1 O-C-N 129.685 4.366 . . . . 0.0 116.423 -179.605 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.52 HD23 ' CE1' ' A' ' 50' ' ' PHE . 3.2 tp -52.86 118.05 3.4 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 128.537 3.648 . . . . 0.0 109.563 177.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -135.46 84.69 2.11 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 116.766 -1.974 . . . . 0.0 111.639 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.759 ' CD1' HG21 ' A' ' 87' ' ' VAL . 6.5 p90 -171.62 145.07 1.96 Allowed 'General case' 0 N--CA 1.474 0.749 1 CA-C-O 128.939 4.209 . . . . 0.0 111.228 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.86 163.34 26.86 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 110.867 -2.879 . . . . 0.0 106.468 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.646 HG21 ' CD1' ' A' ' 89' ' ' TRP . 9.3 p -77.75 142.28 14.39 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.787 0 O-C-N 128.652 3.72 . . . . 0.0 112.127 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 59.17 14.58 26.11 Favored Glycine 0 N--CA 1.484 1.894 0 C-N-CA 116.217 -2.897 . . . . 0.0 117.323 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -83.63 -18.62 10.04 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.351 0 C-N-CA 118.062 -1.455 . . . . 0.0 107.819 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.492 ' HG3' HD12 ' A' ' 86' ' ' LEU . 1.4 mt-10 74.33 130.72 0.04 OUTLIER 'General case' 0 C--N 1.349 0.584 1 O-C-N 131.488 5.493 . . . . 0.0 109.536 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.685 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.5 t80 -107.74 29.12 7.52 Favored 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.647 3.092 . . . . 0.0 110.62 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -14.23 84.41 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.976 0 O-C-N 127.34 2.9 . . . . 0.0 115.585 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.421 ' HG2' ' HB3' ' A' ' 82' ' ' ASN . 3.0 mp0 59.62 173.23 0.08 Allowed 'General case' 0 C--O 1.209 -1.04 1 CA-C-O 129.128 4.299 . . . . 0.0 111.965 -179.345 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.509 ' N ' ' ND1' ' A' ' 74' ' ' HIS . 1.6 m-70 69.98 78.18 0.2 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-N 110.035 -3.257 . . . . 0.0 114.284 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 76.3 p -85.1 -82.32 0.18 Allowed 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 112.868 -1.969 . . . . 0.0 112.015 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.0 mtmt 60.96 168.98 0.09 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 126.215 2.912 . . . . 0.0 115.542 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.18 19.72 77.55 Favored Glycine 0 C--O 1.207 -1.565 0 CA-C-N 111.239 -2.709 . . . . 0.0 109.921 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.666 ' O ' HD12 ' A' ' 26' ' ' ILE . 3.1 tp -172.1 -44.39 0.02 OUTLIER 'General case' 0 CA--C 1.505 -0.756 1 O-C-N 130.74 4.435 . . . . 0.0 113.399 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.18 -70.21 0.57 Allowed 'General case' 0 CA--C 1.5 -0.948 0 CA-C-O 124.119 1.914 . . . . 0.0 113.011 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.76 87.88 1.21 Allowed Glycine 0 N--CA 1.476 1.332 0 CA-C-N 113.722 -1.581 . . . . 0.0 111.114 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.4 mmt-85 -144.44 178.96 7.57 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 127.084 2.284 . . . . 0.0 109.5 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.421 ' HB3' ' HG2' ' A' ' 73' ' ' GLU . 63.6 m-20 -120.47 75.07 1.09 Allowed 'General case' 0 CA--C 1.501 -0.934 0 O-C-N 124.901 1.376 . . . . 0.0 110.714 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.455 HG13 ' N ' ' A' ' 99' ' ' LYS . 17.5 t -113.47 139.15 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 O-C-N 128.815 3.822 . . . . 0.0 111.421 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.464 ' CA ' ' HE2' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -32.35 -69.34 0.08 Allowed 'General case' 0 CA--C 1.504 -0.794 1 O-C-N 131.864 5.727 . . . . 0.0 112.87 -179.856 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.685 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 62.4 m 62.65 68.47 0.65 Allowed 'General case' 0 C--O 1.199 -1.573 0 C-N-CA 127.432 2.293 . . . . 0.0 110.585 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.551 ' HB3' HG23 ' A' ' 97' ' ' VAL . 4.0 tt -91.3 112.82 24.89 Favored 'General case' 0 N--CA 1.429 -1.514 2 O-C-N 131.502 5.501 . . . . 0.0 116.425 -179.429 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.759 HG21 ' CD1' ' A' ' 65' ' ' PHE . 38.4 t -92.88 151.25 3.65 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 CA-C-O 122.764 1.268 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.477 ' HA ' ' CG2' ' A' ' 67' ' ' VAL . 4.0 t -164.3 159.08 19.49 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 112.203 -2.271 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.683 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.252 18.1 m95 -86.49 149.56 24.89 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 114.083 -2.865 . . . . 0.0 105.171 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.532 ' CB ' HG22 ' A' ' 93' ' ' THR . 2.8 tm-20 -96.82 -47.06 6.01 Favored 'General case' 0 C--O 1.195 -1.786 1 CA-C-O 128.949 4.214 . . . . 0.0 111.974 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -179.76 -49.72 0.08 OUTLIER Glycine 0 C--O 1.197 -2.179 1 CA-C-N 107.669 -4.332 . . . . 0.0 103.899 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -141.54 29.03 1.78 Allowed 'General case' 0 N--CA 1.447 -0.613 1 O-C-N 133.118 5.834 . . . . 0.0 111.344 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.532 HG22 ' CB ' ' A' ' 90' ' ' GLU . 1.5 t -162.42 160.91 26.94 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.719 HD13 ' CD1' ' A' ' 50' ' ' PHE . 3.4 tt -93.51 112.48 24.38 Favored 'General case' 0 CA--C 1.487 -1.479 0 O-C-N 127.951 3.282 . . . . 0.0 114.679 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.352 52.9 t -116.83 134.91 58.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 111.726 -2.488 . . . . 0.0 114.552 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 34.4 t -137.18 140.92 42.1 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.551 HG23 ' HB3' ' A' ' 86' ' ' LEU . 6.1 m -128.93 101.34 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 1 CA-C-O 128.635 4.064 . . . . 0.0 118.949 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.437 ' NE2' HG11 ' A' ' 83' ' ' VAL 0.302 4.0 mm100 -71.9 111.01 6.8 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-N 110.185 -3.189 . . . . 0.0 107.464 179.443 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.455 ' N ' HG13 ' A' ' 83' ' ' VAL . 3.3 ttmt -37.3 -46.03 0.72 Allowed 'General case' 0 C--O 1.195 -1.81 1 O-C-N 129.579 4.299 . . . . 0.0 111.014 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.403 ' H ' HG13 ' A' ' 83' ' ' VAL . . . 114.89 -86.63 0.42 Allowed Glycine 0 C--O 1.203 -1.833 0 CA-C-O 125.925 2.958 . . . . 0.0 113.37 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.78 16.18 7.88 Favored 'General case' 0 CA--C 1.497 -1.095 1 CA-C-N 106.421 -4.889 . . . . 0.0 109.423 -179.633 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.402 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 155.53 -33.83 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 125.852 2.739 . . . . 0.0 113.516 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.402 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 2.7 mt-10 -104.99 178.73 4.48 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 110.037 -3.256 . . . . 0.0 117.301 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . 0.251 7.7 m-20 -144.94 79.9 1.61 Allowed 'General case' 0 N--CA 1.489 1.49 2 CA-C-N 106.535 -4.848 . . . . 0.0 101.732 179.447 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.402 ' C ' ' HG3' ' A' ' 98' ' ' GLN . 2.5 tpt180 -101.21 -3.3 29.3 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 126.376 2.989 . . . . 0.0 114.172 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -52.15 103.53 0.12 Allowed Glycine 0 N--CA 1.426 -1.968 1 CA-C-N 107.271 -4.513 . . . . 0.0 118.724 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.45 ' C ' ' HD2' ' A' ' 108' ' ' LYS . 0.1 OUTLIER -97.16 146.46 25.04 Favored 'General case' 0 C--O 1.214 -0.778 0 O-C-N 129.299 3.588 . . . . 0.0 110.283 178.772 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.604 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -163.08 177.19 9.35 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 128.747 3.779 . . . . 0.0 113.097 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.916 ' HG2' HD13 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -143.12 173.37 11.63 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 116.26 -2.176 . . . . 0.0 108.324 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.604 ' CH2' ' HG3' ' A' ' 108' ' ' LYS 0.29 0.0 OUTLIER -159.23 24.77 0.2 Allowed 'General case' 0 CA--C 1.501 -0.912 1 O-C-N 129.623 4.327 . . . . 0.0 117.542 179.551 . . . . . . . . 5 4 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 32.0 t 23.68 78.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 CA-C-O 127.973 3.749 . . . . 0.0 117.432 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -90.13 57.73 3.86 Favored 'General case' 0 CA--C 1.484 -1.562 0 O-C-N 118.753 -2.467 . . . . 0.0 112.441 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.09 -126.23 7.37 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 111.685 -2.507 . . . . 0.0 111.424 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -106.69 39.49 1.83 Allowed 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 113.875 -1.162 . . . . 0.0 113.139 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.9 pttt -170.48 142.3 2.08 Favored 'General case' 0 C--N 1.316 -0.867 1 O-C-N 130.104 4.627 . . . . 0.0 105.836 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.916 HD13 ' HG2' ' A' ' 109' ' ' GLN . 3.7 pp -115.49 133.89 55.6 Favored 'General case' 0 C--O 1.194 -1.855 0 O-C-N 128.093 3.371 . . . . 0.0 111.202 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.428 ' O ' ' N ' ' A' ' 119' ' ' GLU . 2.9 m-85 -77.7 92.81 4.18 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 109.441 -3.527 . . . . 0.0 114.364 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -74.73 76.88 2.07 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 109.096 -3.684 . . . . 0.0 106.197 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 117' ' ' TYR . 40.8 mt-10 -85.29 101.86 12.89 Favored 'General case' 0 CA--C 1.485 -1.539 0 O-C-N 129.094 3.996 . . . . 0.0 110.682 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.44 154.67 33.35 Favored 'General case' 0 CA--C 1.487 -1.472 1 O-C-N 129.311 4.132 . . . . 0.0 111.686 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.0 m -111.89 160.01 17.81 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 110.458 -3.065 . . . . 0.0 105.738 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 3.3 m -151.85 33.85 0.54 Allowed 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.541 1.064 . . . . 0.0 111.647 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.71 -41.26 2.25 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 22.6 t70 172.12 91.45 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.295 0 C-N-CA 125.941 1.697 . . . . 0.0 108.609 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -167.78 -53.47 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 111.067 -2.788 . . . . 0.0 105.435 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.424 ' O ' HG12 ' A' ' 126' ' ' VAL . 4.1 t 58.26 54.22 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.686 1 O-C-N 130.14 4.65 . . . . 0.0 113.716 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 49.6 t -42.11 124.69 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 124.663 1.227 . . . . 0.0 110.193 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.48 92.89 4.31 Favored 'General case' 0 CA--C 1.486 -1.506 0 CA-C-N 113.732 -1.576 . . . . 0.0 114.043 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -74.17 157.21 36.35 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 114.919 -2.712 . . . . 0.0 113.658 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.441 ' O ' HG12 ' A' ' 130' ' ' VAL . 52.0 t -142.51 86.97 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 CA-C-O 125.066 2.365 . . . . 0.0 108.068 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.532 ' CE2' ' HB2' ' A' ' 9' ' ' TRP 0.266 6.2 m-85 -72.2 -179.33 2.8 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 109.583 -3.462 . . . . 0.0 116.335 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.67 120.95 0.93 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 109.118 -3.673 . . . . 0.0 103.607 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.556 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 3.2 ttpm? -70.72 90.37 0.77 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 112.111 -2.313 . . . . 0.0 115.048 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.405 ' HD3' HG22 ' A' ' 8' ' ' THR . 3.9 ttpt . . . . . 0 CA--C 1.482 -1.664 0 CA-C-O 114.149 -2.834 . . . . 0.0 118.186 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 mtt . . . . . 0 N--CA 1.51 2.57 0 CA-C-O 123.112 1.434 . . . . 0.0 108.492 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.9 -164.68 1.99 Allowed 'General case' 0 C--O 1.206 -1.215 0 CA-C-N 112.919 -1.946 . . . . 0.0 108.353 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.409 ' H ' ' CD ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -82.4 43.81 0.84 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 115.834 -2.346 . . . . 0.0 116.196 -179.804 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -106.82 97.94 7.66 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -92.76 -124.42 0.09 Allowed 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 115.354 -2.26 . . . . 0.0 107.261 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 71.52 100.02 0.07 Allowed 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 130.329 3.452 . . . . 0.0 112.542 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.27 -130.44 1.18 Allowed Glycine 0 CA--C 1.534 1.242 0 CA-C-O 114.789 -3.228 . . . . 0.0 113.759 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.534 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -169.6 147.35 3.5 Favored 'General case' 0 C--O 1.214 -0.811 1 O-C-N 133.59 6.112 . . . . 0.0 104.519 -179.892 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.534 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -148.24 109.42 4.32 Favored 'General case' 0 CA--C 1.494 -1.176 1 O-C-N 130.941 5.151 . . . . 0.0 114.78 -179.894 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -78.41 119.99 22.51 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 127.4 2.937 . . . . 0.0 111.576 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.531 ' HB3' ' HG2' ' A' ' 39' ' ' GLN . 3.4 ttp -57.54 96.05 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 O-C-N 126.243 2.215 . . . . 0.0 106.53 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.59 -14.23 40.3 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 130.207 3.403 . . . . 0.0 111.688 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.415 ' HB3' HG23 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -173.8 158.29 3.22 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.609 -1.632 . . . . 0.0 113.262 -179.865 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.422 ' HB3' ' CE ' ' A' ' 11' ' ' MET . 14.1 p-10 -133.86 129.47 36.48 Favored 'General case' 0 CA--C 1.493 -1.228 0 O-C-N 127.947 3.28 . . . . 0.0 111.337 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -101.25 -71.31 0.71 Allowed 'General case' 0 CA--C 1.477 -1.833 1 O-C-N 129.779 4.425 . . . . 0.0 115.247 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.98 -71.07 0.51 Allowed 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 118.845 -2.409 . . . . 0.0 115.697 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 71.73 -72.58 0.11 Allowed 'General case' 0 C--O 1.198 -1.609 0 O-C-N 126.546 2.403 . . . . 0.0 112.156 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.49 ' CB ' ' HB3' ' A' ' 31' ' ' ARG . 0.1 OUTLIER -76.49 -30.44 57.25 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.987 -179.672 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.47 -22.97 77.89 Favored Glycine 0 N--CA 1.484 1.843 1 O-C-N 130.345 4.778 . . . . 0.0 108.404 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.58 -46.65 53.3 Favored 'General case' 0 C--O 1.194 -1.837 0 CA-C-O 126.006 2.813 . . . . 0.0 108.933 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.7 mtt -59.93 -29.5 68.43 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 110.451 -3.068 . . . . 0.0 112.928 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -79.72 -23.93 42.01 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 127.757 3.16 . . . . 0.0 112.008 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.37 -29.09 64.55 Favored 'General case' 0 C--O 1.205 -1.243 1 O-C-N 132.211 5.944 . . . . 0.0 114.419 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.484 HD11 ' O ' ' A' ' 78' ' ' LEU . 0.9 OUTLIER -111.06 20.06 17.82 Favored 'General case' 0 CA--C 1.539 0.538 1 O-C-N 129.807 4.442 . . . . 0.0 108.529 179.975 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 20.45 86.75 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.571 1 O-C-N 130.053 4.596 . . . . 0.0 110.279 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.419 ' CG2' ' N ' ' A' ' 27' ' ' ASP . 6.4 tp -98.77 -39.78 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 CA-C-O 127.045 3.307 . . . . 0.0 112.017 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.419 ' N ' ' CG2' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -171.61 -158.61 0.13 Allowed 'General case' 0 C--N 1.359 0.994 0 O-C-N 119.241 -2.162 . . . . 0.0 109.183 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -143.84 49.14 1.39 Allowed 'General case' 0 C--O 1.207 -1.152 0 O-C-N 121.441 -0.787 . . . . 0.0 112.335 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 152.19 78.98 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.792 0 O-C-N 127.942 3.277 . . . . 0.0 107.699 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.5 m -139.17 22.42 2.59 Favored 'General case' 0 CA--C 1.504 -0.798 2 CA-C-N 106.282 -4.963 . . . . 0.0 113.357 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.49 ' HB3' ' CB ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.44 24.05 10.89 Favored 'General case' 0 CA--C 1.509 -0.603 0 O-C-N 128.186 3.429 . . . . 0.0 113.945 179.744 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.501 ' O ' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -114.45 15.19 17.93 Favored 'General case' 0 CA--C 1.488 -1.441 0 O-C-N 127.284 2.865 . . . . 0.0 112.464 -179.44 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.506 ' N ' HD12 ' A' ' 33' ' ' ILE . 0.4 OUTLIER -170.04 74.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.362 1.132 1 CA-C-N 107.931 -4.213 . . . . 0.0 109.493 -179.791 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 33' ' ' ILE . . . 172.32 -38.25 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.182 0 O-C-N 120.367 -1.458 . . . . 0.0 109.079 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 51.1 t -17.95 -47.85 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 O-C-N 128.935 3.897 . . . . 0.0 112.717 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.654 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 159.42 114.68 0.0 OUTLIER 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 108.955 -3.748 . . . . 0.0 113.333 179.515 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.944 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -145.53 85.94 1.73 Allowed 'General case' 0 C--O 1.212 -0.905 1 CA-C-N 108.249 -4.069 . . . . 0.0 107.138 179.722 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.5 m 72.91 47.35 0.21 Allowed 'General case' 0 N--CA 1.485 1.318 1 O-C-N 133.973 7.046 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 11' ' ' MET . 4.0 tt0 -79.52 135.36 36.61 Favored 'General case' 0 CA--C 1.492 -1.257 0 C-N-CA 118.393 -1.323 . . . . 0.0 113.277 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.4 m -152.52 120.47 6.17 Favored 'General case' 0 C--O 1.212 -0.905 0 C-N-CA 130.26 3.424 . . . . 0.0 111.5 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.782 ' HE2' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -103.62 152.97 21.13 Favored 'General case' 0 N--CA 1.48 1.048 1 O-C-N 129.169 4.043 . . . . 0.0 103.486 179.853 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.502 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.2 mp -140.0 156.64 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 O-C-N 126.886 2.616 . . . . 0.0 109.71 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.502 ' N ' HG22 ' A' ' 42' ' ' ILE 0.295 1.4 tt -127.38 138.08 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.495 0 O-C-N 128.217 3.448 . . . . 0.0 109.45 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.8 t -137.14 87.69 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.274 0 CA-C-N 112.038 -2.346 . . . . 0.0 109.704 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -99.61 102.99 14.66 Favored 'General case' 0 C--O 1.21 -0.982 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.86 -14.27 23.32 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 128.012 3.32 . . . . 0.0 112.477 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.69 -96.23 0.18 Allowed Glycine 0 C--O 1.203 -1.795 0 CA-C-O 122.955 1.308 . . . . 0.0 111.208 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.628 ' O ' HG23 ' A' ' 66' ' ' THR . 96.1 m-20 -86.36 -13.6 45.98 Favored 'General case' 0 C--O 1.21 -1.002 0 CA-C-N 110.872 -2.664 . . . . 0.0 110.661 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -109.69 93.34 4.45 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 128.438 3.586 . . . . 0.0 109.57 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.877 ' CD2' HD13 ' A' ' 94' ' ' LEU . 91.3 t80 -108.15 101.04 10.3 Favored 'General case' 0 CA--C 1.501 -0.926 1 O-C-N 129.66 4.35 . . . . 0.0 115.446 -179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 30.4 mttt -112.35 85.98 2.26 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 119.022 2.971 . . . . 0.0 119.022 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.428 ' O ' HG22 ' A' ' 52' ' ' THR . 0.9 OUTLIER -65.25 120.47 12.8 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 128.255 3.472 . . . . 0.0 106.222 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -125.43 150.82 46.94 Favored 'General case' 0 CA--C 1.493 -1.232 0 O-C-N 126.513 2.383 . . . . 0.0 112.31 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -98.14 175.3 6.14 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 125.407 1.692 . . . . 0.0 110.457 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.486 ' HB2' HD11 ' A' ' 42' ' ' ILE . 2.4 t-20 -148.65 35.75 0.78 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.827 -1.988 . . . . 0.0 115.483 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.542 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 9.6 p -73.04 167.86 20.25 Favored 'General case' 0 C--N 1.323 -0.549 1 O-C-N 130.66 4.975 . . . . 0.0 111.927 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 57' ' ' THR . 10.3 m -101.56 -1.84 31.98 Favored 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 128.738 3.774 . . . . 0.0 110.746 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.944 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -108.93 -58.95 1.95 Allowed 'General case' 0 C--O 1.218 -0.597 0 O-C-N 123.962 0.789 . . . . 0.0 110.864 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.7 mtt85 -137.8 122.59 18.78 Favored 'General case' 0 C--N 1.357 0.899 1 O-C-N 130.183 4.677 . . . . 0.0 116.186 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.4 99.38 5.81 Favored 'General case' 0 N--CA 1.439 -0.988 1 O-C-N 129.168 4.042 . . . . 0.0 111.209 -179.894 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.58 -67.78 0.92 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 110.177 -3.192 . . . . 0.0 107.653 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.441 ' HB2' ' CB ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER 98.02 176.81 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.364 5.415 . . . . 0.0 110.692 179.963 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 65' ' ' PHE . 8.6 tp -113.92 49.91 0.96 Allowed 'General case' 0 N--CA 1.436 -1.155 0 O-C-N 127.183 2.802 . . . . 0.0 112.643 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.509 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 14.9 t70 -59.59 89.37 0.01 OUTLIER 'General case' 0 C--O 1.211 -0.958 0 O-C-N 128.742 3.776 . . . . 0.0 105.923 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.548 ' CD2' HG11 ' A' ' 87' ' ' VAL . 0.8 OUTLIER -125.81 -174.1 3.0 Favored 'General case' 0 CA--C 1.495 -1.165 1 CA-C-O 128.994 4.235 . . . . 0.0 110.141 -179.763 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.628 HG23 ' O ' ' A' ' 48' ' ' ASP . 1.0 OUTLIER -167.12 122.15 1.07 Allowed 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 109.856 -3.338 . . . . 0.0 106.374 179.529 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.851 HG13 ' HA ' ' A' ' 88' ' ' THR . 3.7 t -36.92 119.9 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.202 -1.412 1 O-C-N 129.638 4.336 . . . . 0.0 115.769 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.32 23.8 70.03 Favored Glycine 0 N--CA 1.487 2.05 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.3 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.575 HG23 ' HB ' ' A' ' 66' ' ' THR . 1.2 t -69.09 -32.39 53.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.508 0 CA-C-N 112.162 -2.019 . . . . 0.0 109.939 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 57.03 73.99 0.43 Allowed 'General case' 0 C--N 1.356 0.867 1 O-C-N 130.555 4.909 . . . . 0.0 108.697 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -84.29 122.97 29.65 Favored 'General case' 0 CA--C 1.498 -1.042 1 O-C-N 129.352 4.157 . . . . 0.0 119.225 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -91.49 54.71 2.58 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.091 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HG2' HG23 ' A' ' 75' ' ' THR . 5.5 tt0 -21.94 109.01 0.02 OUTLIER 'General case' 0 CA--C 1.483 -1.617 0 CA-C-O 126.051 2.834 . . . . 0.0 113.257 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.82 54.73 0.86 Allowed 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 110.3 -3.137 . . . . 0.0 112.044 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.475 HG23 ' HG2' ' A' ' 73' ' ' GLU . 0.8 OUTLIER -53.16 169.95 0.1 Allowed 'General case' 0 C--O 1.201 -1.471 0 CA-C-N 110.809 -2.905 . . . . 0.0 112.316 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.441 ' HA ' ' CA ' ' A' ' 80' ' ' GLY . 0.1 OUTLIER 158.89 -32.19 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.807 1 O-C-N 130.036 4.585 . . . . 0.0 115.807 -179.917 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.59 -21.49 57.89 Favored Glycine 0 C--O 1.218 -0.868 0 CA-C-N 108.441 -3.981 . . . . 0.0 112.843 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.484 ' O ' HD11 ' A' ' 24' ' ' LEU 0.311 5.6 tp -171.32 36.47 0.02 OUTLIER 'General case' 0 CA--C 1.503 -0.849 1 O-C-N 132.977 5.751 . . . . 0.0 113.477 -179.844 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.475 ' HB3' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -170.65 -58.47 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.66 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.441 ' CA ' ' HA ' ' A' ' 76' ' ' LYS . . . 67.36 58.33 8.06 Favored Glycine 0 C--O 1.204 -1.734 0 C-N-CA 125.976 1.75 . . . . 0.0 111.463 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.28 -170.24 1.6 Allowed 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 129.707 3.828 . . . . 0.0 115.255 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -163.43 81.62 0.46 Allowed 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 113.445 -1.707 . . . . 0.0 109.411 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.519 HG11 ' HG2' ' A' ' 98' ' ' GLN . 3.6 t -125.02 155.37 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 0 O-C-N 127.528 3.017 . . . . 0.0 117.511 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -87.25 86.08 7.24 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 109.686 -3.416 . . . . 0.0 111.22 -179.79 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.4 m -90.52 85.64 6.19 Favored 'General case' 0 C--O 1.206 -1.201 0 O-C-N 127.202 2.814 . . . . 0.0 111.2 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.7 tt -79.85 146.97 31.93 Favored 'General case' 0 CA--C 1.511 -0.534 2 CA-C-N 106.521 -4.854 . . . . 0.0 112.019 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.548 HG11 ' CD2' ' A' ' 65' ' ' PHE . 1.4 p -134.9 143.4 37.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 125.792 1.637 . . . . 0.0 112.126 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.851 ' HA ' HG13 ' A' ' 67' ' ' VAL . 5.8 t -166.98 169.48 12.95 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-O 126.75 3.166 . . . . 0.0 112.209 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.705 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.8 m95 -91.83 145.01 24.9 Favored 'General case' 0 CA--C 1.509 -0.628 0 O-C-N 117.579 -3.201 . . . . 0.0 105.732 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.565 ' HB3' HG22 ' A' ' 93' ' ' THR . 1.1 tm-20 -85.9 -59.54 2.27 Favored 'General case' 0 C--O 1.203 -1.374 0 CA-C-O 127.813 3.673 . . . . 0.0 111.077 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.71 59.52 0.01 OUTLIER Glycine 0 C--O 1.195 -2.33 2 N-CA-C 100.818 -4.913 . . . . 0.0 100.818 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.491 ' O ' ' HB ' ' A' ' 93' ' ' THR . 12.3 t-20 99.2 93.06 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 2 O-C-N 131.929 5.135 . . . . 0.0 104.142 -178.52 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.565 HG22 ' HB3' ' A' ' 90' ' ' GLU . 1.2 t 127.04 152.47 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.389 0 C-N-CA 130.291 3.436 . . . . 0.0 118.352 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.877 HD13 ' CD2' ' A' ' 50' ' ' PHE 0.268 0.6 OUTLIER -93.64 97.69 10.64 Favored 'General case' 0 CA--C 1.486 -1.495 0 CA-C-N 110.209 -3.178 . . . . 0.0 117.585 -179.407 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.529 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.418 42.3 t -92.65 151.1 3.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 CA-C-N 112.803 -1.999 . . . . 0.0 113.883 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.652 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 0.8 OUTLIER -165.84 157.23 13.9 Favored 'General case' 0 C--O 1.204 -1.328 0 O-C-N 126.977 2.673 . . . . 0.0 105.041 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.422 HG22 ' C ' ' A' ' 96' ' ' CYS 0.286 0.0 OUTLIER -150.93 115.33 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.741 2 O-C-N 129.746 4.404 . . . . 0.0 115.259 -179.869 . . . . . . . . 5 4 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.519 ' HG2' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -78.25 98.14 5.79 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 126.329 2.966 . . . . 0.0 109.444 -179.873 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -85.27 84.62 7.61 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 109.595 -3.457 . . . . 0.0 110.898 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.469 ' CA ' HG13 ' A' ' 83' ' ' VAL . . . -94.4 -155.95 31.96 Favored Glycine 0 C--O 1.2 -2.016 0 CA-C-O 125.53 2.739 . . . . 0.0 108.058 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -93.02 -47.42 7.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 110.528 -2.836 . . . . 0.0 113.066 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.458 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -111.29 -61.32 1.71 Allowed 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -75.31 167.19 22.38 Favored 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 111.391 -2.641 . . . . 0.0 117.385 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.43 ' O ' ' HB ' ' A' ' 121' ' ' THR . 44.9 m-80 -121.6 86.71 2.62 Favored 'General case' 0 CA--C 1.537 0.471 1 CA-C-N 107.353 -4.476 . . . . 0.0 103.592 179.508 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.502 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 28.4 mmm-85 -87.8 175.03 8.02 Favored 'General case' 0 N--CA 1.48 1.066 1 O-C-N 129.672 4.357 . . . . 0.0 107.374 179.549 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.23 -167.39 33.9 Favored Glycine 0 C--O 1.207 -1.554 1 O-C-N 130.705 5.003 . . . . 0.0 115.693 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.652 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 1.6 p90 -175.52 16.44 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.76 1 O-C-N 131.977 5.163 . . . . 0.0 121.15 178.964 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.54 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -45.24 133.33 7.03 Favored 'General case' 0 C--O 1.208 -1.126 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 -176.83 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.401 ' O ' ' CE3' ' A' ' 110' ' ' TRP . 24.5 mm-40 -93.06 168.09 11.36 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 113.975 -2.916 . . . . 0.0 109.525 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.54 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 10.8 m95 -125.07 -38.58 2.31 Favored 'General case' 0 C--O 1.211 -0.956 1 O-C-N 130.226 4.704 . . . . 0.0 114.231 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.5 t 67.3 51.99 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.81 1 CA-C-O 129.721 4.581 . . . . 0.0 109.048 -175.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -98.97 122.72 42.59 Favored 'General case' 0 CA--C 1.475 -1.916 1 CA-C-N 107.043 -4.617 . . . . 0.0 119.009 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 35.35 74.2 0.09 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 118.147 2.019 . . . . 0.0 118.147 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 73.57 -30.85 0.21 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 129.398 3.079 . . . . 0.0 119.257 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.462 ' HG3' ' CE1' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -106.12 174.65 5.79 Favored 'General case' 0 CA--C 1.498 -1.034 1 O-C-N 130.272 4.733 . . . . 0.0 109.756 -179.784 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.782 HD22 ' HE2' ' A' ' 41' ' ' LYS . 4.4 tt -121.04 94.97 4.51 Favored 'General case' 0 C--O 1.197 -1.708 1 O-C-N 129.951 4.532 . . . . 0.0 112.269 179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.462 ' CE1' ' HG3' ' A' ' 115' ' ' LYS . 5.9 m-30 -66.39 131.26 45.68 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 109.938 -3.301 . . . . 0.0 111.123 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.592 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -109.21 102.98 11.88 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 111.171 -2.74 . . . . 0.0 107.947 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -107.44 139.08 42.49 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.705 HD12 ' O ' ' A' ' 121' ' ' THR . 0.1 OUTLIER -137.29 149.91 47.42 Favored 'General case' 0 CA--C 1.485 -1.546 1 O-C-N 129.941 4.525 . . . . 0.0 108.487 -179.568 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.705 ' O ' HD12 ' A' ' 120' ' ' LEU . 4.0 m -111.23 156.48 21.4 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.21 -2.144 . . . . 0.0 105.21 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.24 88.66 0.67 Allowed 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 119.13 -1.028 . . . . 0.0 110.959 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 46.24 39.93 10.05 Favored Glycine 0 CA--C 1.508 -0.399 0 CA-C-O 122.725 1.18 . . . . 0.0 114.776 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 t70 71.21 92.31 0.09 Allowed 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 126.275 1.83 . . . . 0.0 110.432 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.22 -53.1 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.374 1 O-C-N 130.275 4.734 . . . . 0.0 105.467 179.813 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.623 HG22 HG23 ' A' ' 121' ' ' THR . 15.8 t 61.78 78.02 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 CA-C-N 108.834 -3.803 . . . . 0.0 117.953 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.429 ' HB3' HD23 ' A' ' 120' ' ' LEU . 4.5 t -58.89 125.99 25.82 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 113.436 -1.711 . . . . 0.0 108.671 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -110.72 100.41 9.18 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 125.606 1.816 . . . . 0.0 110.615 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -93.6 163.93 13.36 Favored 'General case' 0 CA--C 1.489 -1.398 0 O-C-N 124.691 1.244 . . . . 0.0 112.258 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.415 HG23 ' HB3' ' A' ' 13' ' ' SER . 0.7 OUTLIER -136.46 137.34 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-O 126.288 2.947 . . . . 0.0 106.996 -179.882 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.592 ' CE1' ' HB2' ' A' ' 118' ' ' LEU 0.273 64.1 m-85 -124.56 177.41 5.95 Favored 'General case' 0 CA--C 1.497 -1.09 1 CA-C-N 108.055 -4.157 . . . . 0.0 116.612 179.855 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.77 139.31 19.61 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 110.622 -2.99 . . . . 0.0 103.774 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.506 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 4.9 ttmm -79.17 119.62 22.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-O 116.654 -1.641 . . . . 0.0 111.939 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.404 ' HB3' HG22 ' A' ' 8' ' ' THR . 13.7 ptpt . . . . . 0 CA--C 1.49 -1.348 0 O-C-N 128.885 3.865 . . . . 0.0 118.863 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.96 157.93 39.89 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 119.482 -0.887 . . . . 0.0 108.845 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.415 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 1.2 ptmm? 27.86 37.48 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.176 0 O-C-N 128.327 3.517 . . . . 0.0 117.988 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -148.63 71.98 1.17 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -133.2 160.28 37.71 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -147.25 165.66 29.41 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.632 3.708 . . . . 0.0 112.614 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.3 -149.53 9.89 Favored Glycine 0 C--O 1.203 -1.802 0 CA-C-O 116.619 -2.212 . . . . 0.0 112.693 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.7 t -163.65 41.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 129.236 3.551 . . . . 0.0 105.155 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.731 ' CZ2' HD23 ' A' ' 116' ' ' LEU 0.307 0.1 OUTLIER -36.69 103.43 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.816 1 O-C-N 131.45 5.469 . . . . 0.0 112.179 -179.208 . . . . . . . . 5 4 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.41 -51.17 60.49 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.689 2.493 . . . . 0.0 114.884 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.2 ttt 93.41 86.85 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.669 1 O-C-N 129.904 4.503 . . . . 0.0 103.591 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -43.9 -47.54 8.37 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 129.059 3.974 . . . . 0.0 110.802 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -158.33 -179.77 8.41 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 111.214 -2.721 . . . . 0.0 112.111 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -156.22 151.8 27.01 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 17' ' ' PHE . 3.1 mm-40 -93.82 -164.07 1.13 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 108.628 -3.896 . . . . 0.0 110.769 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.412 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 11.3 p30 -30.21 83.69 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 C-N-CA 127.401 2.28 . . . . 0.0 111.85 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.4 ' N ' ' O ' ' A' ' 15' ' ' GLU . 13.3 t80 -69.7 -31.12 68.96 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.342 3.925 . . . . 0.0 107.898 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.533 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -73.69 -49.17 27.11 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 110.649 -2.978 . . . . 0.0 111.48 179.659 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.433 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -53.57 -22.44 16.98 Favored Glycine 0 CA--C 1.487 -1.7 1 O-C-N 130.425 4.828 . . . . 0.0 113.506 179.784 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.54 ' OH ' HD21 ' A' ' 78' ' ' LEU . 6.5 t80 -79.72 -38.02 34.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.576 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -77.25 -20.59 54.94 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 113.046 -1.888 . . . . 0.0 112.055 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.433 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 2.3 ttmt -73.48 -39.99 64.47 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 110.468 -3.06 . . . . 0.0 111.659 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.53 -40.18 85.05 Favored 'General case' 0 C--O 1.211 -0.933 1 O-C-N 130.429 4.831 . . . . 0.0 111.383 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.673 HD13 HD13 ' A' ' 26' ' ' ILE 0.322 15.1 mt -70.53 -29.74 66.3 Favored 'General case' 0 C--O 1.208 -1.107 2 O-C-N 130.002 4.564 . . . . 0.0 104.861 -179.885 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t0 56.55 43.97 24.83 Favored 'General case' 0 C--O 1.202 -1.425 3 O-C-N 131.696 5.622 . . . . 0.0 103.806 -177.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.673 HD13 HD13 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -70.9 -9.91 13.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 1 CA-C-N 105.665 -5.243 . . . . 0.0 112.592 -178.403 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 50.2 -157.45 0.09 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 109.015 -3.721 . . . . 0.0 114.133 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 1.9 m-30 79.98 -20.38 0.39 Allowed 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 127.956 3.285 . . . . 0.0 115.741 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.49 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . . . 58.25 60.62 2.58 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 103.721 -2.696 . . . . 0.0 103.721 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.476 ' O ' HG22 ' A' ' 30' ' ' THR . 34.2 m -127.87 42.76 3.26 Favored 'General case' 0 N--CA 1.475 0.786 2 CA-C-N 105.369 -5.378 . . . . 0.0 115.294 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.533 ' HB2' ' HA ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.06 -34.69 3.81 Favored 'General case' 0 CA--C 1.499 -1.017 1 O-C-N 129.457 4.223 . . . . 0.0 113.536 -179.629 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.472 ' N ' ' HG2' ' A' ' 31' ' ' ARG 0.258 19.7 tttm -99.11 55.6 1.01 Allowed 'General case' 0 C--N 1.309 -1.158 0 O-C-N 125.762 1.914 . . . . 0.0 107.7 179.809 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.73 -49.77 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.293 2 O-C-N 132.67 6.231 . . . . 0.0 109.732 -179.703 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.554 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -89.57 11.71 18.81 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.511 179.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.2 t -37.15 -46.22 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 O-C-N 125.897 1.998 . . . . 0.0 111.167 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.585 ' HD2' ' HB3' ' A' ' 39' ' ' GLN . 0.8 OUTLIER 169.13 100.6 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.63 1 O-C-N 130.103 4.627 . . . . 0.0 115.351 -179.991 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.711 HD23 ' CD2' ' A' ' 58' ' ' PHE . 1.4 pp -96.71 -8.72 30.69 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 128.329 3.518 . . . . 0.0 107.314 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.648 ' N ' HD12 ' A' ' 37' ' ' LEU . 1.8 m 143.94 112.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.128 1 O-C-N 133.109 6.506 . . . . 0.0 110.282 -179.894 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.585 ' HB3' ' HD2' ' A' ' 36' ' ' ARG . 61.8 tt0 -127.47 148.2 50.3 Favored 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.619 3.074 . . . . 0.0 115.301 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.417 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 41.7 m -144.46 119.37 9.95 Favored 'General case' 0 C--N 1.318 -0.769 1 O-C-N 131.469 5.481 . . . . 0.0 111.147 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -103.7 107.91 18.97 Favored 'General case' 0 C--N 1.351 0.631 0 O-C-N 127.471 2.982 . . . . 0.0 103.761 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.534 HD11 ' HB2' ' A' ' 55' ' ' ASN . 3.9 mp -98.02 158.26 3.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 O-C-N 127.252 2.845 . . . . 0.0 110.699 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.519 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -134.77 144.83 33.65 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 110.188 -3.187 . . . . 0.0 109.005 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.441 HG21 ' NZ ' ' A' ' 53' ' ' LYS . 56.9 t -149.1 78.85 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.33 0 CA-C-N 111.82 -2.446 . . . . 0.0 111.951 -179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' A' ' 3' ' ' LYS . 0.8 OUTLIER -77.75 150.48 34.39 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -166.64 91.18 0.42 Allowed 'General case' 0 CA--C 1.498 -1.036 1 O-C-N 129.42 4.2 . . . . 0.0 111.747 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 54.55 -89.48 0.01 OUTLIER Glycine 0 C--N 1.345 1.066 0 CA-C-O 119.833 -0.426 . . . . 0.0 112.523 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -99.55 -39.71 8.19 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 126.796 2.115 . . . . 0.0 116.458 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -85.84 112.98 21.62 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 126.086 2.116 . . . . 0.0 111.975 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.495 ' CE2' HD22 ' A' ' 94' ' ' LEU . 76.8 t80 -112.8 97.98 6.91 Favored 'General case' 0 C--N 1.316 -0.89 1 O-C-N 129.707 4.379 . . . . 0.0 112.315 -179.915 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -117.21 89.36 3.1 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 119.282 3.068 . . . . 0.0 119.282 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.537 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -76.86 158.42 30.8 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 127.443 2.964 . . . . 0.0 106.691 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.441 ' NZ ' HG21 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -155.31 148.94 25.25 Favored 'General case' 0 CA--C 1.486 -1.482 0 O-C-N 127.654 3.096 . . . . 0.0 109.575 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.2 t -105.4 116.87 32.67 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.652 2.781 . . . . 0.0 107.196 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.534 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -82.31 15.75 2.32 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 117.037 2.236 . . . . 0.0 117.037 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.81 155.81 7.35 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 127.356 2.91 . . . . 0.0 109.248 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.419 ' H ' HD11 ' A' ' 37' ' ' LEU . 7.0 p -89.77 -34.2 16.26 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 128.977 3.923 . . . . 0.0 104.01 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.711 ' CD2' HD23 ' A' ' 37' ' ' LEU . 1.3 m-85 -57.97 -65.15 0.69 Allowed 'General case' 0 C--O 1.24 0.562 0 O-C-N 126.922 2.639 . . . . 0.0 111.223 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -151.56 110.2 3.82 Favored 'General case' 0 C--N 1.362 1.151 1 CA-C-N 108.24 -4.073 . . . . 0.0 116.726 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -111.64 87.75 2.63 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 127.316 2.885 . . . . 0.0 108.934 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.57 -56.46 4.0 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 128.708 3.755 . . . . 0.0 107.377 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER 89.6 154.35 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.646 1 O-C-N 132.924 6.39 . . . . 0.0 115.697 -179.944 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.603 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 11.6 tp -99.34 47.25 0.96 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 111.536 -2.574 . . . . 0.0 112.376 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.83 94.75 1.44 Allowed 'General case' 0 C--O 1.206 -1.205 0 O-C-N 123.903 0.752 . . . . 0.0 109.054 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.526 ' CD2' HG21 ' A' ' 87' ' ' VAL . 0.5 OUTLIER -127.15 178.54 5.96 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-O 127.116 3.341 . . . . 0.0 108.558 -179.681 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -151.53 143.47 23.84 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 112.583 -2.099 . . . . 0.0 105.44 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.836 HG21 ' NE1' ' A' ' 89' ' ' TRP . 1.6 t -70.07 152.12 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 0 O-C-N 127.223 2.827 . . . . 0.0 114.194 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 47.37 37.49 12.07 Favored Glycine 0 N--CA 1.469 0.883 0 CA-C-N 111.238 -2.71 . . . . 0.0 114.373 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.262 9.9 p -98.16 -14.37 7.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.042 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.478 ' HA ' HD12 ' A' ' 86' ' ' LEU . 1.3 tt0 55.68 74.14 0.39 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 128.665 3.728 . . . . 0.0 110.884 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.579 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 6.4 t80 -64.35 70.63 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.903 1 O-C-N 129.745 4.403 . . . . 0.0 113.67 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -51.83 87.59 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.32 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.505 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 40.11 -160.72 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 O-C-N 126.934 2.646 . . . . 0.0 112.924 179.54 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 91.62 90.98 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.341 -2.209 . . . . 0.0 116.436 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.466 ' C ' ' HG2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -148.01 153.66 39.27 Favored 'General case' 0 C--O 1.201 -1.492 0 CA-C-N 111.251 -2.704 . . . . 0.0 112.0 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.466 ' HG2' ' C ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 178.99 136.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.795 1 O-C-N 129.111 4.007 . . . . 0.0 111.271 -179.887 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.47 7.41 42.74 Favored Glycine 0 C--O 1.204 -1.725 0 CA-C-N 111.232 -2.713 . . . . 0.0 109.993 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.608 ' HA ' HD11 ' A' ' 26' ' ' ILE . 4.0 tp -165.6 36.38 0.06 Allowed 'General case' 0 C--N 1.351 0.648 0 O-C-N 128.439 3.082 . . . . 0.0 116.36 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.465 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 7.6 t0 159.3 -66.54 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.044 2.715 . . . . 0.0 113.189 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.67 78.61 0.82 Allowed Glycine 0 C--O 1.204 -1.719 0 O-C-N 126.097 2.123 . . . . 0.0 110.144 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.27 -146.53 0.15 Allowed 'General case' 0 CA--C 1.494 -1.182 0 O-C-N 129.44 3.671 . . . . 0.0 113.193 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.505 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 15.2 m-20 -163.38 112.91 1.31 Allowed 'General case' 0 C--O 1.202 -1.431 0 CA-C-O 117.471 -1.252 . . . . 0.0 108.934 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.7 HG22 ' HA2' ' A' ' 100' ' ' GLY . 71.1 t -146.95 131.83 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 N-CA-C 117.833 2.531 . . . . 0.0 117.833 -178.047 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -60.48 115.56 3.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 110.657 -2.974 . . . . 0.0 107.701 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.579 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 40.8 m -122.4 74.31 1.17 Allowed 'General case' 0 C--O 1.198 -1.656 0 O-C-N 127.915 3.26 . . . . 0.0 115.633 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.491 ' HB3' ' CG2' ' A' ' 97' ' ' VAL . 5.3 tp -67.33 143.44 56.38 Favored 'General case' 0 N--CA 1.437 -1.079 2 CA-C-N 106.037 -5.074 . . . . 0.0 108.908 -179.684 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.526 HG21 ' CD2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -123.34 131.09 73.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 O-C-N 126.402 2.314 . . . . 0.0 107.415 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 89' ' ' TRP 0.333 1.7 m -151.3 159.42 44.33 Favored 'General case' 0 CA--C 1.479 -1.782 0 CA-C-N 113.027 -1.897 . . . . 0.0 109.585 -179.562 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.836 ' NE1' HG21 ' A' ' 67' ' ' VAL . 58.8 m95 -87.07 143.66 27.22 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 114.509 -2.662 . . . . 0.0 106.503 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.841 ' HB3' HG22 ' A' ' 93' ' ' THR . 11.0 tp10 -90.28 -35.45 15.27 Favored 'General case' 0 CA--C 1.479 -1.752 1 CA-C-O 133.074 6.178 . . . . 0.0 112.469 179.798 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.18 -41.75 0.27 Allowed Glycine 0 C--O 1.206 -1.602 1 CA-C-N 107.009 -4.632 . . . . 0.0 103.2 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.533 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -155.65 67.64 0.63 Allowed 'General case' 0 C--O 1.197 -1.69 1 O-C-N 131.267 4.745 . . . . 0.0 107.897 -179.787 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.841 HG22 ' HB3' ' A' ' 90' ' ' GLU . 14.6 t 159.18 147.19 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 118.051 2.611 . . . . 0.0 118.051 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.531 HD23 ' OE1' ' A' ' 109' ' ' GLN . 0.7 OUTLIER -85.97 82.66 8.04 Favored 'General case' 0 CA--C 1.495 -1.165 1 O-C-N 132.679 6.237 . . . . 0.0 116.816 179.491 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.538 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.343 54.5 t -84.12 135.71 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 CA-C-O 115.558 -2.163 . . . . 0.0 112.663 179.492 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.11 137.77 29.38 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.491 ' CG2' ' HB3' ' A' ' 86' ' ' LEU . 16.4 m -113.14 118.49 58.19 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.996 1 O-C-N 130.098 4.624 . . . . 0.0 117.15 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.402 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 3.7 mm-40 -94.95 99.02 11.12 Favored 'General case' 0 C--O 1.221 -0.416 0 O-C-N 119.373 -2.079 . . . . 0.0 108.766 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.2 OUTLIER -93.74 77.6 4.26 Favored 'General case' 0 C--O 1.201 -1.47 0 CA-C-N 111.059 -2.791 . . . . 0.0 108.324 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.7 ' HA2' HG22 ' A' ' 83' ' ' VAL . . . -81.65 -117.98 0.46 Allowed Glycine 0 C--O 1.207 -1.573 0 CA-C-N 112.286 -2.234 . . . . 0.0 112.082 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 174.03 94.62 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.984 -2.108 . . . . 0.0 111.731 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? 128.19 -28.62 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 129.159 2.984 . . . . 0.0 111.772 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.35 174.33 10.73 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 110.091 -3.231 . . . . 0.0 116.552 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -125.38 97.36 5.17 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 113.579 -3.105 . . . . 0.0 105.888 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.473 ' HD3' ' HA ' ' A' ' 122' ' ' CYS 0.285 17.9 mmt180 -91.47 6.76 44.28 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 128.844 3.84 . . . . 0.0 113.809 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.402 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -49.0 97.14 0.01 OUTLIER Glycine 0 CA--C 1.533 1.194 2 O-C-N 133.166 6.541 . . . . 0.0 111.48 179.992 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.603 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.263 0.0 OUTLIER -104.16 137.92 41.4 Favored 'General case' 0 C--N 1.317 -0.815 1 O-C-N 130.97 4.571 . . . . 0.0 108.55 178.541 . . . . . . . . 5 4 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.65 -179.46 7.63 Favored 'General case' 0 C--O 1.204 -1.302 1 O-C-N 131.853 5.721 . . . . 0.0 115.101 -178.047 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.579 ' HB2' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -139.77 177.37 8.0 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 109.147 -3.661 . . . . 0.0 107.747 -179.835 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.466 ' CD1' ' HB3' ' A' ' 117' ' ' TYR 0.27 0.5 OUTLIER 177.93 100.45 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.642 1 O-C-N 132.694 6.246 . . . . 0.0 115.713 178.637 . . . . . . . . 5 4 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.4 t -46.62 96.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.486 -1.491 0 CA-C-O 126.416 3.008 . . . . 0.0 115.63 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.91 96.7 6.41 Favored 'General case' 0 CA--C 1.484 -1.595 0 CA-C-O 125.221 2.439 . . . . 0.0 115.945 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.76 72.78 0.47 Allowed Glycine 0 N--CA 1.439 -1.141 0 CA-C-N 112.049 -2.341 . . . . 0.0 117.101 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 49.48 63.08 2.3 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 126.587 1.992 . . . . 0.0 116.057 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 160.63 148.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.667 1 O-C-N 130.003 4.564 . . . . 0.0 109.419 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.731 HD23 ' CZ2' ' A' ' 9' ' ' TRP . 1.2 mm? -83.19 -174.82 5.51 Favored 'General case' 0 CA--C 1.495 -1.149 0 O-C-N 127.156 2.785 . . . . 0.0 111.679 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.466 ' HB3' ' CD1' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -155.81 69.53 0.67 Allowed 'General case' 0 C--O 1.203 -1.355 0 O-C-N 128.053 3.346 . . . . 0.0 110.751 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.83 87.24 0.06 Allowed 'General case' 0 CA--C 1.505 -0.767 1 CA-C-N 107.512 -4.404 . . . . 0.0 109.022 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -105.78 97.64 7.44 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 125.644 1.84 . . . . 0.0 111.081 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.574 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -102.74 162.66 12.74 Favored 'General case' 0 C--N 1.365 1.24 0 O-C-N 126.645 2.466 . . . . 0.0 108.406 179.568 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.469 ' O ' HD12 ' A' ' 120' ' ' LEU . 0.6 OUTLIER -139.53 160.84 38.91 Favored 'General case' 0 C--O 1.2 -1.518 0 O-C-N 128.372 3.545 . . . . 0.0 105.541 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.473 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -159.11 59.66 0.41 Allowed 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 126.795 3.188 . . . . 0.0 110.185 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.97 -69.97 0.5 Allowed Glycine 0 N--CA 1.435 -1.397 0 CA-C-N 110.282 -3.145 . . . . 0.0 111.075 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -162.45 64.13 0.22 Allowed 'General case' 0 C--O 1.206 -1.228 0 CA-C-N 110.646 -2.777 . . . . 0.0 109.197 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -158.09 36.96 0.25 Allowed 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 111.336 -2.665 . . . . 0.0 105.562 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.519 HG13 ' O ' ' A' ' 126' ' ' VAL . 7.9 p -35.06 111.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 O-C-N 128.847 3.842 . . . . 0.0 113.792 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.6 t -89.71 119.44 30.12 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 119.352 -2.092 . . . . 0.0 107.577 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -106.55 111.46 24.02 Favored 'General case' 0 N--CA 1.477 0.913 1 O-C-N 129.3 4.125 . . . . 0.0 110.678 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -108.76 164.89 11.98 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 126.175 2.172 . . . . 0.0 112.763 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -127.1 157.19 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 N-CA-C 103.24 -2.874 . . . . 0.0 103.24 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -136.22 173.51 11.63 Favored 'General case' 0 CA--C 1.477 -1.863 0 CA-C-N 108.712 -3.858 . . . . 0.0 117.84 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.321 0.5 OUTLIER -162.17 97.02 1.01 Allowed 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 110.575 -3.011 . . . . 0.0 103.827 -179.621 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.52 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 12.2 pttt -33.39 -44.42 0.14 Allowed 'General case' 0 C--O 1.198 -1.607 1 O-C-N 131.168 5.293 . . . . 0.0 117.521 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.447 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 30.0 ttmt . . . . . 0 CA--C 1.481 -1.698 0 CA-C-O 114.745 -2.55 . . . . 0.0 111.817 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.6 mtp . . . . . 0 N--CA 1.501 2.108 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.8 -162.11 0.85 Allowed 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 118.253 -0.88 . . . . 0.0 108.704 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.536 ' HB2' ' CH2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER -49.3 -19.12 0.45 Allowed 'General case' 0 C--N 1.356 0.873 0 O-C-N 125.644 1.84 . . . . 0.0 113.402 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -63.07 104.35 0.56 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 103.443 -2.799 . . . . 0.0 103.443 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -138.4 -177.59 4.92 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 111.684 -2.507 . . . . 0.0 104.96 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -178.54 145.72 0.33 Allowed 'General case' 0 C--O 1.22 -0.482 1 O-C-N 129.499 4.249 . . . . 0.0 111.554 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -176.23 -151.56 8.92 Favored Glycine 0 C--O 1.201 -1.923 0 CA-C-O 115.652 -2.749 . . . . 0.0 115.066 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 ' HD2' ' A' ' 134' ' ' LYS . 5.5 t -167.05 42.73 0.05 OUTLIER 'General case' 0 C--O 1.204 -1.32 1 O-C-N 134.444 6.614 . . . . 0.0 107.791 179.727 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.539 ' CZ2' HD12 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -34.42 136.74 0.13 Allowed 'General case' 0 C--O 1.242 0.673 1 O-C-N 132.073 5.858 . . . . 0.0 112.024 179.926 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.494 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.4 mt-10 -103.84 53.36 0.75 Allowed 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 117.715 -1.594 . . . . 0.0 110.934 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.421 ' O ' ' N ' ' A' ' 13' ' ' SER . 15.8 ttp -4.92 67.28 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 O-C-N 128.978 3.924 . . . . 0.0 108.957 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.494 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.6 tt0 -12.82 -45.09 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.803 1 O-C-N 133.182 6.551 . . . . 0.0 112.427 -178.518 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 11' ' ' MET . 1.2 t -173.7 161.69 3.95 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 109.524 -3.489 . . . . 0.0 109.886 -179.734 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -116.08 156.61 26.09 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 109.686 -3.416 . . . . 0.0 112.735 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -117.77 -56.66 2.18 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 127.067 2.729 . . . . 0.0 110.609 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -116.68 113.41 22.6 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 119.8 -1.812 . . . . 0.0 107.822 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . 0.296 25.0 t80 -115.29 -47.41 2.85 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 127.659 3.6 . . . . 0.0 112.524 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -76.38 -48.75 18.78 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 110.969 -2.832 . . . . 0.0 114.274 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -53.4 -21.84 14.09 Favored Glycine 0 CA--C 1.484 -1.869 0 O-C-N 124.982 1.426 . . . . 0.0 113.465 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.512 ' N ' HE21 ' A' ' 125' ' ' GLN . 0.1 OUTLIER -69.14 -48.0 63.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.206 -1.775 . . . . 0.0 106.206 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.462 ' O ' HG22 ' A' ' 26' ' ' ILE . 1.7 mtm -70.42 -32.28 69.82 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 111.807 -2.451 . . . . 0.0 112.472 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.68 -23.39 56.21 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 128.569 2.748 . . . . 0.0 114.998 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.0 -32.13 50.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 110.226 -3.17 . . . . 0.0 108.804 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.49 HD13 ' HB2' ' A' ' 79' ' ' ASP 0.291 3.3 mt -74.03 -23.99 59.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 111.229 -2.714 . . . . 0.0 104.464 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 t70 63.24 58.86 1.35 Allowed 'General case' 0 C--O 1.216 -0.705 1 CA-C-O 128.514 4.006 . . . . 0.0 106.416 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.608 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 1.3 tt -71.72 -47.44 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.983 1 CA-C-N 106.73 -4.759 . . . . 0.0 110.594 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 178.59 123.25 0.05 OUTLIER 'General case' 0 C--N 1.361 1.102 0 CA-C-N 113.981 -1.463 . . . . 0.0 109.231 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.449 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 93.1 m-85 -72.65 121.71 20.23 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 117.093 -1.843 . . . . 0.0 114.512 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 78.93 51.65 0.03 OUTLIER 'General case' 0 C--O 1.209 -1.054 0 C-N-CA 126.995 2.118 . . . . 0.0 110.527 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.423 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.4 OUTLIER -87.67 -52.64 5.21 Favored 'General case' 0 C--N 1.355 0.848 2 O-C-N 130.018 4.574 . . . . 0.0 112.001 -179.921 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.535 ' HD3' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.25 -138.42 0.01 OUTLIER 'General case' 0 C--O 1.244 0.777 0 CA-C-O 112.437 -3.649 . . . . 0.0 111.92 -179.734 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.535 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER 98.18 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 O-C-N 128.633 3.708 . . . . 0.0 111.071 -179.864 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.694 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -117.44 8.42 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 1 O-C-N 131.057 5.223 . . . . 0.0 110.383 -179.787 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -116.28 22.04 13.17 Favored 'General case' 0 C--N 1.346 0.429 0 O-C-N 124.735 1.272 . . . . 0.0 107.779 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.4 t -49.77 -36.37 11.15 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.344 0 CA-C-O 123.881 1.801 . . . . 0.0 111.483 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.58 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.5 OUTLIER 171.36 128.7 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.828 1 CA-C-N 108.22 -4.082 . . . . 0.0 110.858 179.837 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 37' ' ' LEU . 1.4 mt -97.74 -50.24 4.53 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 129.038 3.961 . . . . 0.0 104.049 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.3 m -170.23 142.96 2.31 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.727 5.642 . . . . 0.0 112.008 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.533 ' HG2' ' N ' ' A' ' 40' ' ' THR . 0.1 OUTLIER -125.03 150.43 46.76 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 126.074 2.109 . . . . 0.0 114.853 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.533 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 66.2 m 178.23 109.11 0.03 OUTLIER 'General case' 0 N--CA 1.433 -1.287 1 O-C-N 129.478 4.237 . . . . 0.0 111.904 178.815 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.89 152.56 19.63 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 127.928 3.267 . . . . 0.0 105.272 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 43' ' ' ILE . 5.1 mp -137.48 157.81 34.3 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.369 0 C-N-CA 117.635 -1.626 . . . . 0.0 110.467 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.552 HG12 ' CE1' ' A' ' 50' ' ' PHE 0.251 3.4 tt -136.43 125.71 38.14 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 2 O-C-N 131.646 5.591 . . . . 0.0 109.07 -179.685 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 59.7 t -124.94 102.97 11.61 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 CA-C-N 111.837 -2.438 . . . . 0.0 111.988 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.593 ' HG3' ' CD1' ' A' ' 50' ' ' PHE . 9.6 mt-30 -121.83 89.47 3.13 Favored 'General case' 0 CA--C 1.488 -1.429 0 CA-C-O 125.137 2.399 . . . . 0.0 114.743 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -78.64 -8.41 58.63 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-N 108.788 -3.824 . . . . 0.0 113.006 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.51 -106.8 0.25 Allowed Glycine 0 C--O 1.203 -1.841 0 CA-C-O 123.504 1.613 . . . . 0.0 113.741 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.559 ' O ' HG23 ' A' ' 67' ' ' VAL . 2.0 m-20 -98.62 -1.19 41.47 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 112.728 -1.736 . . . . 0.0 113.059 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.88 90.25 3.3 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 127.793 3.183 . . . . 0.0 108.907 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.593 ' CD1' ' HG3' ' A' ' 45' ' ' GLN . 6.4 t80 -96.44 103.66 15.58 Favored 'General case' 0 CA--C 1.496 -1.108 0 O-C-N 128.278 3.486 . . . . 0.0 113.305 -179.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.0 73.25 1.01 Allowed 'General case' 0 CA--C 1.496 -1.124 0 O-C-N 128.169 3.418 . . . . 0.0 118.202 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.633 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -52.28 165.55 0.23 Allowed 'General case' 0 C--N 1.358 0.95 0 CA-C-N 112.221 -2.263 . . . . 0.0 108.87 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.511 ' N ' HG23 ' A' ' 52' ' ' THR . 0.0 OUTLIER -170.91 153.31 3.84 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 114.843 -2.743 . . . . 0.0 106.653 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.406 HG22 ' HA ' ' A' ' 60' ' ' ASN . 0.7 OUTLIER -108.11 152.34 24.66 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 127.382 2.927 . . . . 0.0 107.847 178.902 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -104.84 10.44 34.44 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 125.562 1.789 . . . . 0.0 115.258 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.533 ' HB3' ' CD1' ' A' ' 58' ' ' PHE . 54.4 m -44.35 152.2 0.21 Allowed 'General case' 0 N--CA 1.477 0.924 1 O-C-N 129.199 4.062 . . . . 0.0 105.513 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.552 HG23 HD12 ' A' ' 37' ' ' LEU 0.266 7.3 t -83.51 -35.24 25.0 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-N 111.752 -2.476 . . . . 0.0 110.719 -179.049 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.651 ' CE2' HD21 ' A' ' 37' ' ' LEU 0.251 0.0 OUTLIER -60.2 -38.34 83.02 Favored 'General case' 0 C--N 1.366 1.301 0 O-C-N 126.811 2.57 . . . . 0.0 111.524 -179.475 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 168.57 162.43 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.516 1 O-C-N 130.723 5.014 . . . . 0.0 112.05 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.406 ' HA ' HG22 ' A' ' 54' ' ' THR . 1.6 m-20 -113.38 127.65 56.2 Favored 'General case' 0 C--O 1.209 -1.074 1 O-C-N 130.366 4.791 . . . . 0.0 107.903 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -106.38 28.42 7.79 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 126.331 2.269 . . . . 0.0 108.39 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -13.62 112.52 0.02 OUTLIER 'General case' 0 C--O 1.205 -1.257 1 O-C-N 130.287 4.742 . . . . 0.0 117.502 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.832 HD21 ' CZ ' ' A' ' 65' ' ' PHE . 9.9 tt -68.16 121.82 16.99 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 127.503 3.002 . . . . 0.0 108.796 177.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -141.02 83.08 1.87 Allowed 'General case' 0 CA--C 1.485 -1.549 0 C-N-CA 113.956 -3.098 . . . . 0.0 112.237 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.947 ' CD1' HG21 ' A' ' 87' ' ' VAL . 5.3 p90 -142.49 167.42 22.14 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 126.076 2.846 . . . . 0.0 110.926 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -119.88 157.3 29.02 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 112.647 -2.069 . . . . 0.0 108.115 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 48' ' ' ASP . 1.9 t -51.67 141.74 4.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.119 0 O-C-N 127.027 2.705 . . . . 0.0 115.085 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 23.37 47.55 0.01 OUTLIER Glycine 0 CA--C 1.5 -0.875 1 O-C-N 131.501 5.5 . . . . 0.0 117.857 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -97.84 0.12 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 59.03 73.59 0.48 Allowed 'General case' 0 C--N 1.357 0.892 0 O-C-N 128.947 3.904 . . . . 0.0 109.254 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.46 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 5.3 t80 -67.59 138.14 56.21 Favored 'General case' 0 N--CA 1.451 -0.405 2 O-C-N 129.602 4.314 . . . . 0.0 116.652 -179.801 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -112.79 93.63 4.52 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 113.171 -1.832 . . . . 0.0 110.62 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -72.39 154.21 41.02 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-O 126.517 3.056 . . . . 0.0 109.796 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -131.78 74.15 1.57 Allowed 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 108.984 -3.735 . . . . 0.0 109.764 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 70.3 p -49.85 -79.49 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 114.265 -2.779 . . . . 0.0 116.19 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 13.0 97.32 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.816 1 O-C-N 129.656 4.347 . . . . 0.0 115.782 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 142.01 -29.14 2.22 Favored Glycine 0 C--O 1.213 -1.212 0 CA-C-N 110.345 -3.116 . . . . 0.0 107.666 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.608 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 12.6 tp -141.13 50.01 1.63 Allowed 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 108.481 -3.86 . . . . 0.0 115.395 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.498 ' N ' HD12 ' A' ' 26' ' ' ILE . 5.6 t70 151.73 -67.78 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.893 1.996 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.03 65.28 1.18 Allowed Glycine 0 C--O 1.229 -0.217 0 O-C-N 126.235 2.21 . . . . 0.0 112.818 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.46 ' CG ' ' N ' ' A' ' 82' ' ' ASN 0.267 3.3 tpt180 -139.97 -122.05 0.12 Allowed 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 113.836 -2.983 . . . . 0.0 112.936 -179.721 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.46 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER 156.15 101.81 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 O-C-N 128.299 3.499 . . . . 0.0 108.665 -179.275 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.771 HG13 ' HA2' ' A' ' 100' ' ' GLY . 1.9 t -134.33 165.18 32.29 Favored 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 127.043 2.714 . . . . 0.0 117.684 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.48 ' N ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -75.24 163.88 27.05 Favored 'General case' 0 C--O 1.218 -0.56 2 O-C-N 133.426 6.704 . . . . 0.0 107.503 179.19 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.46 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.1 m -168.76 98.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.983 1 O-C-N 130.799 5.062 . . . . 0.0 110.152 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.06 93.55 7.44 Favored 'General case' 0 C--O 1.209 -1.043 2 O-C-N 130.911 5.132 . . . . 0.0 116.626 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.947 HG21 ' CD1' ' A' ' 65' ' ' PHE . 26.1 t -68.4 131.66 33.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.197 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -157.95 160.77 37.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 124.188 1.947 . . . . 0.0 111.711 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.741 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 70.3 m95 -88.8 142.5 27.61 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 114.649 -2.596 . . . . 0.0 106.708 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.871 ' HB2' HG23 ' A' ' 93' ' ' THR . 0.0 OUTLIER -92.76 -60.37 1.83 Allowed 'General case' 0 CA--C 1.48 -1.718 1 CA-C-O 132.477 5.894 . . . . 0.0 113.456 179.552 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.02 61.72 0.03 OUTLIER Glycine 0 CA--C 1.542 1.778 1 CA-C-N 107.84 -4.255 . . . . 0.0 104.428 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 92.39 66.08 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.038 1 O-C-N 132.388 5.405 . . . . 0.0 105.701 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.871 HG23 ' HB2' ' A' ' 90' ' ' GLU . 1.9 t 166.21 141.95 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 50' ' ' PHE . 4.8 tp -86.05 106.5 17.25 Favored 'General case' 0 CA--C 1.487 -1.458 1 O-C-N 131.239 5.337 . . . . 0.0 114.161 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.735 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.376 40.8 t -109.87 148.68 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.014 0 CA-C-N 109.385 -3.552 . . . . 0.0 114.418 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.22 133.07 17.0 Favored 'General case' 0 C--O 1.219 -0.532 0 O-C-N 125.739 1.899 . . . . 0.0 106.544 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.8 t -103.11 73.46 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.598 0 CA-C-N 110.133 -3.212 . . . . 0.0 115.256 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.575 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 1.8 mm-40 -53.36 101.4 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 122.383 1.087 . . . . 0.0 109.084 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -95.98 98.23 10.22 Favored 'General case' 0 C--O 1.205 -1.254 0 CA-C-N 109.315 -3.584 . . . . 0.0 112.358 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.771 ' HA2' HG13 ' A' ' 83' ' ' VAL . . . -94.19 -136.72 8.32 Favored Glycine 0 C--O 1.212 -1.239 0 O-C-N 127.94 3.275 . . . . 0.0 111.063 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -154.66 -47.39 0.09 Allowed 'General case' 0 CA--C 1.502 -0.891 1 CA-C-N 107.695 -4.252 . . . . 0.0 109.631 179.675 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.433 ' HD3' ' C ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -101.86 3.6 39.4 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 123.408 1.575 . . . . 0.0 115.033 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.78 174.62 13.64 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 110.222 -3.172 . . . . 0.0 117.307 -179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.2 96.59 5.15 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 108.838 -3.801 . . . . 0.0 101.637 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.525 ' HB3' ' NE2' ' A' ' 98' ' ' GLN . 12.2 mmm-85 -87.68 -2.41 58.59 Favored 'General case' 0 C--O 1.208 -1.122 1 O-C-N 129.506 4.254 . . . . 0.0 111.593 -179.693 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.575 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.66 95.52 0.01 OUTLIER Glycine 0 C--O 1.208 -1.501 2 O-C-N 133.719 6.887 . . . . 0.0 115.551 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.517 ' CD1' ' C ' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -110.46 137.69 47.83 Favored 'General case' 0 C--N 1.319 -0.754 1 O-C-N 130.997 4.586 . . . . 0.0 108.242 178.04 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -163.19 177.84 8.72 Favored 'General case' 0 CA--C 1.506 -0.717 1 O-C-N 130.454 4.846 . . . . 0.0 111.403 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.532 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -139.71 -174.33 3.87 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 113.849 -2.977 . . . . 0.0 108.133 -179.529 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.431 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.2 OUTLIER 179.4 89.17 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.235 1 O-C-N 130.377 4.798 . . . . 0.0 117.683 178.961 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . 0.25 70.3 t -34.71 104.57 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-O 125.051 2.358 . . . . 0.0 112.187 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.526 ' HG2' ' CD2' ' A' ' 117' ' ' TYR . 0.7 OUTLIER -107.29 28.87 7.66 Favored 'General case' 0 CA--C 1.478 -1.811 0 CA-C-N 111.534 -2.575 . . . . 0.0 117.81 -179.633 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.42 95.36 0.84 Allowed Glycine 0 C--O 1.21 -1.392 0 O-C-N 119.576 -1.952 . . . . 0.0 117.944 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 61.83 35.03 16.77 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 165.19 154.91 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.153 1 O-C-N 130.729 5.018 . . . . 0.0 110.015 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.539 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 1.1 mt -91.69 -172.75 3.32 Favored 'General case' 0 CA--C 1.484 -1.575 0 O-C-N 127.378 2.924 . . . . 0.0 112.399 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.526 ' CD2' ' HG2' ' A' ' 112' ' ' GLU . 0.0 OUTLIER -150.46 83.86 1.36 Allowed 'General case' 0 C--N 1.362 1.142 0 CA-C-N 111.659 -2.519 . . . . 0.0 113.182 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.479 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -73.33 88.14 1.54 Allowed 'General case' 0 N--CA 1.475 0.778 2 CA-C-N 107.989 -4.187 . . . . 0.0 109.562 -179.894 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -100.47 102.34 13.5 Favored 'General case' 0 CA--C 1.499 -0.985 0 O-C-N 128.863 3.852 . . . . 0.0 109.803 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.516 HD11 ' SG ' ' A' ' 122' ' ' CYS . 0.2 OUTLIER -121.52 155.27 35.33 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 128.136 3.397 . . . . 0.0 109.347 -179.847 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.1 t -133.59 154.76 50.63 Favored 'General case' 0 C--N 1.311 -1.103 1 O-C-N 129.56 4.288 . . . . 0.0 104.759 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.516 ' SG ' HD11 ' A' ' 120' ' ' LEU 0.273 2.8 m -139.43 39.78 2.06 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.887 1.327 . . . . 0.0 110.962 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 132.93 -57.51 0.71 Allowed Glycine 0 CA--C 1.526 0.781 0 CA-C-N 111.696 -2.502 . . . . 0.0 108.526 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -172.77 49.64 0.02 OUTLIER 'General case' 0 CA--C 1.491 -1.294 0 CA-C-N 109.845 -3.177 . . . . 0.0 106.955 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.512 HE21 ' N ' ' A' ' 20' ' ' TYR . 1.4 tm0? -103.38 -22.93 13.6 Favored 'General case' 0 C--O 1.208 -1.122 0 C-N-CA 116.666 -2.014 . . . . 0.0 110.369 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 126' ' ' VAL . 11.8 p 27.1 63.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 CA-C-O 125.297 2.475 . . . . 0.0 117.11 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.412 ' N ' ' O ' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -57.71 149.29 22.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 118.923 -2.361 . . . . 0.0 108.191 -179.691 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -135.09 87.71 2.36 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 128.181 3.426 . . . . 0.0 111.002 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -83.02 164.52 20.3 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.42 139.45 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 123.963 1.839 . . . . 0.0 106.078 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.479 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 39.6 m-85 -123.02 179.66 4.59 Favored 'General case' 0 CA--C 1.492 -1.263 0 CA-C-O 126.716 3.15 . . . . 0.0 117.42 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.415 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.297 0.0 OUTLIER -165.76 122.41 1.39 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 109.903 -3.317 . . . . 0.0 104.473 -179.936 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.492 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 19.7 ttpt -71.6 57.35 0.28 Allowed 'General case' 0 C--O 1.202 -1.445 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.518 ' HD2' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.796 0 N-CA-C 117.976 2.584 . . . . 0.0 117.976 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mtt . . . . . 0 N--CA 1.509 2.525 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 m -80.35 141.14 35.7 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 113.857 -1.519 . . . . 0.0 111.88 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.462 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 17.0 mttt 45.83 34.96 2.05 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.71 104.53 5.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 104.006 -2.59 . . . . 0.0 104.006 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . 0.262 7.7 mt-30 -139.39 145.75 39.33 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 103.616 -2.735 . . . . 0.0 103.616 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 156.7 126.16 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.919 1 O-C-N 131.571 5.545 . . . . 0.0 112.108 179.944 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 150.48 -169.91 30.39 Favored Glycine 0 C--O 1.2 -1.97 0 O-C-N 127.054 2.721 . . . . 0.0 110.224 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.553 HG23 HG23 ' A' ' 40' ' ' THR . 0.9 OUTLIER -129.57 145.08 51.51 Favored 'General case' 0 C--N 1.318 -0.8 1 O-C-N 131.963 5.155 . . . . 0.0 107.664 -179.962 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.573 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -138.04 109.2 6.82 Favored 'General case' 0 CA--C 1.498 -1.028 1 O-C-N 131.199 5.312 . . . . 0.0 112.177 -179.773 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -56.02 -15.25 3.28 Favored 'General case' 0 C--N 1.316 -0.863 0 O-C-N 126.828 2.58 . . . . 0.0 115.415 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.9 ttp 59.02 81.49 0.16 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -35.27 -43.95 0.25 Allowed 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 128.879 3.862 . . . . 0.0 110.993 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.268 4.8 p -157.97 162.76 38.23 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 112.046 -2.343 . . . . 0.0 111.535 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -132.3 124.8 29.56 Favored 'General case' 0 CA--C 1.482 -1.664 1 CA-C-N 107.898 -4.228 . . . . 0.0 112.223 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.33 -149.42 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 128.173 3.42 . . . . 0.0 107.65 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -44.61 139.47 2.86 Favored 'General case' 0 C--O 1.2 -1.514 0 CA-C-N 119.551 1.069 . . . . 0.0 112.815 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -126.75 -44.27 1.67 Allowed 'General case' 0 C--O 1.197 -1.669 0 CA-C-O 125.695 2.664 . . . . 0.0 111.648 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.66 -22.17 47.2 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-N 111.348 -2.66 . . . . 0.0 115.542 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.81 -31.03 62.84 Favored Glycine 0 N--CA 1.474 1.21 0 O-C-N 128.129 3.393 . . . . 0.0 108.29 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.424 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -70.12 -34.32 72.95 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-O 124.7 2.191 . . . . 0.0 108.958 -179.906 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.596 ' O ' HG22 ' A' ' 26' ' ' ILE . 2.1 mtm -73.16 -24.09 60.52 Favored 'General case' 0 CA--C 1.484 -1.568 0 C-N-CA 114.749 -2.78 . . . . 0.0 113.765 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -78.33 -24.33 46.61 Favored 'General case' 0 CA--C 1.538 0.512 1 O-C-N 132.184 5.928 . . . . 0.0 110.585 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.38 -32.18 73.69 Favored 'General case' 0 C--O 1.202 -1.406 1 O-C-N 130.664 4.978 . . . . 0.0 112.857 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.424 HD23 ' O ' ' A' ' 20' ' ' TYR . 0.7 OUTLIER -118.56 19.93 13.13 Favored 'General case' 0 N--CA 1.472 0.634 1 O-C-N 129.411 4.194 . . . . 0.0 107.42 179.648 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.35 -64.03 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 128.37 3.544 . . . . 0.0 112.675 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.596 HG22 ' O ' ' A' ' 21' ' ' MET . 8.3 tt 36.65 34.42 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.828 1 CA-C-O 129.095 4.283 . . . . 0.0 113.768 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.88 175.08 0.13 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 109.415 -3.539 . . . . 0.0 111.786 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.439 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.9 m-85 -112.65 168.78 9.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 113.703 -1.589 . . . . 0.0 113.476 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 83.71 103.37 0.05 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.442 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.8 OUTLIER 176.81 -45.63 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.394 2.934 . . . . 0.0 112.625 -179.753 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 30' ' ' THR . 0.0 OUTLIER -53.25 -9.37 0.16 Allowed 'General case' 0 CA--C 1.497 -1.074 0 C-N-CA 129.698 3.199 . . . . 0.0 114.458 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -31.47 27.36 Favored 'General case' 0 CA--C 1.482 -1.668 0 C-N-CA 117.212 -1.795 . . . . 0.0 114.365 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.714 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -135.11 15.26 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.913 1 O-C-N 129.45 4.219 . . . . 0.0 114.877 -179.925 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -114.94 12.47 16.82 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 118.919 -1.113 . . . . 0.0 112.469 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.4 t -52.7 -39.18 29.58 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.527 0 CA-C-O 122.888 1.328 . . . . 0.0 111.983 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.723 ' C ' HD23 ' A' ' 37' ' ' LEU . 1.0 OUTLIER 173.93 131.74 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 108.493 -3.958 . . . . 0.0 111.178 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.819 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -101.68 -60.56 1.51 Allowed 'General case' 0 N--CA 1.435 -1.194 1 O-C-N 129.676 4.36 . . . . 0.0 105.798 -179.523 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.52 HG22 ' O ' ' A' ' 38' ' ' THR . 22.1 m -153.23 36.63 0.47 Allowed 'General case' 0 CA--C 1.489 -1.399 1 O-C-N 131.102 5.251 . . . . 0.0 112.032 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.442 ' HB3' ' HD3' ' A' ' 36' ' ' ARG . 6.7 tt0 -63.59 118.22 7.9 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 116.355 1.983 . . . . 0.0 116.355 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.553 HG23 HG23 ' A' ' 8' ' ' THR . 1.4 m -121.99 132.61 54.62 Favored 'General case' 0 C--O 1.204 -1.306 1 O-C-N 129.246 4.091 . . . . 0.0 110.183 179.312 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -107.87 141.4 39.52 Favored 'General case' 0 N--CA 1.475 0.811 1 O-C-N 129.372 4.17 . . . . 0.0 107.497 -179.84 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.659 HD13 ' CD ' ' A' ' 53' ' ' LYS . 2.9 mp -132.46 155.44 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 O-C-N 126.788 2.555 . . . . 0.0 110.776 179.246 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.515 ' N ' HG22 ' A' ' 42' ' ' ILE . 13.4 tt -132.94 129.02 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.543 0 CA-C-O 126.139 2.876 . . . . 0.0 109.46 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.427 ' O ' HG12 ' A' ' 44' ' ' VAL . 3.0 t -124.56 48.46 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.372 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -55.97 108.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.563 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -123.64 14.29 9.42 Favored 'General case' 0 CA--C 1.476 -1.877 1 O-C-N 129.532 4.27 . . . . 0.0 117.751 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.32 103.28 2.71 Favored Glycine 0 C--O 1.214 -1.156 0 C-N-CA 119.282 -1.437 . . . . 0.0 112.153 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 73.09 -65.47 0.35 Allowed 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 127.821 2.719 . . . . 0.0 112.072 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -96.81 86.72 4.11 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 129.054 3.971 . . . . 0.0 109.818 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.526 ' CD2' HD13 ' A' ' 94' ' ' LEU . 1.7 t80 -98.1 109.91 22.59 Favored 'General case' 0 N--CA 1.475 0.8 1 O-C-N 130.39 4.806 . . . . 0.0 110.999 -179.869 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -120.25 99.46 6.6 Favored 'General case' 0 CA--C 1.487 -1.477 1 O-C-N 129.885 4.49 . . . . 0.0 119.933 -179.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.539 HG22 ' CB ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -72.71 173.62 8.78 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 126.921 2.638 . . . . 0.0 106.506 178.224 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.659 ' CD ' HD13 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -172.53 145.64 1.62 Allowed 'General case' 0 CA--C 1.488 -1.423 0 C-N-CA 115.975 -2.29 . . . . 0.0 111.515 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.3 t -98.13 126.82 43.75 Favored 'General case' 0 CA--C 1.496 -1.104 0 O-C-N 128.209 3.443 . . . . 0.0 109.68 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -96.76 35.11 1.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.407 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 0.9 OUTLIER -79.88 110.11 14.94 Favored 'General case' 0 N--CA 1.473 0.687 1 O-C-N 130.187 4.68 . . . . 0.0 105.176 179.642 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.47 -36.97 46.58 Favored 'General case' 0 C--O 1.209 -1.027 1 O-C-N 129.759 4.412 . . . . 0.0 108.407 -179.638 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.515 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 1.2 p90 -74.63 -23.83 58.75 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -173.77 100.76 0.11 Allowed 'General case' 0 C--O 1.21 -0.993 1 O-C-N 131.417 5.448 . . . . 0.0 116.389 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -107.52 89.79 3.1 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 108.802 -3.817 . . . . 0.0 105.718 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -77.36 -29.08 53.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.37 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 t0 69.16 131.5 0.03 OUTLIER 'General case' 0 CA--C 1.499 -0.993 0 O-C-N 127.435 2.959 . . . . 0.0 112.902 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.539 ' CB ' HG22 ' A' ' 52' ' ' THR . 3.9 tp -100.32 58.93 0.98 Allowed 'General case' 0 C--O 1.214 -0.805 0 O-C-N 125.102 1.501 . . . . 0.0 109.868 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -99.43 98.66 9.55 Favored 'General case' 0 C--O 1.203 -1.388 0 O-C-N 126.911 2.632 . . . . 0.0 112.89 -178.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.527 ' CE2' ' CZ2' ' A' ' 107' ' ' TRP . 6.8 p90 -132.73 -179.16 5.29 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 124.031 1.872 . . . . 0.0 106.396 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.761 HG22 HG23 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -129.87 155.72 45.54 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 104.165 -2.532 . . . . 0.0 104.165 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 p -78.77 135.12 26.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.072 0 O-C-N 126.775 2.547 . . . . 0.0 114.344 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 23.59 75.97 Favored Glycine 0 N--CA 1.488 2.129 0 C-N-CA 116.372 -2.823 . . . . 0.0 116.103 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.761 HG23 HG22 ' A' ' 66' ' ' THR . 3.0 t -73.28 -25.16 21.11 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.89 74.59 0.4 Allowed 'General case' 0 C--N 1.364 1.203 1 O-C-N 130.458 4.848 . . . . 0.0 109.509 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.449 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 4.4 m-85 -43.83 147.47 0.46 Allowed 'General case' 0 CA--C 1.503 -0.865 0 O-C-N 128.277 3.485 . . . . 0.0 118.324 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -107.63 56.31 0.64 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 115.995 -1.955 . . . . 0.0 112.491 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' CB ' ' CA ' ' A' ' 83' ' ' VAL . 0.6 OUTLIER 19.16 84.47 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.813 1 CA-C-O 129.267 4.365 . . . . 0.0 114.544 179.765 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.415 ' H ' ' HB2' ' A' ' 82' ' ' ASN . 47.1 t60 -169.7 125.69 0.85 Allowed 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 109.518 -3.492 . . . . 0.0 118.057 178.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.53 HG22 ' CB ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -161.64 168.82 22.73 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.143 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.46 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -152.91 161.89 41.98 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 125.652 2.644 . . . . 0.0 114.514 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.83 -7.1 82.33 Favored Glycine 0 C--O 1.217 -0.91 0 CA-C-N 111.155 -2.748 . . . . 0.0 113.475 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.627 HD23 HH22 ' A' ' 105' ' ' ARG . 2.8 tp -123.67 -63.88 1.19 Allowed 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -118.78 -58.15 1.98 Allowed 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 113.762 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.58 64.26 0.59 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 127.715 2.578 . . . . 0.0 110.949 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ttm105 151.64 146.38 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 O-C-N 128.556 3.151 . . . . 0.0 109.142 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.53 ' CB ' HG22 ' A' ' 75' ' ' THR . 0.0 OUTLIER -132.45 5.89 4.08 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.676 -178.463 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.604 ' CA ' ' CB ' ' A' ' 73' ' ' GLU 0.32 16.2 t 49.49 178.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 1 O-C-N 130.199 4.687 . . . . 0.0 116.177 -178.936 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.587 ' N ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -76.85 82.2 3.43 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 124.193 1.949 . . . . 0.0 106.71 177.929 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.494 HG23 ' SG ' ' A' ' 96' ' ' CYS . 83.6 m -93.09 69.14 4.41 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 109.305 -3.589 . . . . 0.0 117.209 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 3.9 tt -63.6 150.89 43.1 Favored 'General case' 0 N--CA 1.432 -1.366 2 CA-C-N 106.631 -4.804 . . . . 0.0 110.338 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.7 t -130.58 143.02 42.19 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.108 0 C-N-CA 124.374 1.07 . . . . 0.0 109.308 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.1 173.47 14.3 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-O 125.854 2.74 . . . . 0.0 111.848 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.706 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 60.1 m95 -92.78 154.02 18.54 Favored 'General case' 0 CA--C 1.508 -0.672 0 C-N-CA 128.537 2.735 . . . . 0.0 106.473 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.51 ' HG3' ' CG2' ' A' ' 95' ' ' VAL . 0.3 OUTLIER -111.13 -52.23 2.8 Favored 'General case' 0 CA--C 1.485 -1.533 1 CA-C-O 129.735 4.588 . . . . 0.0 115.976 179.588 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 156.91 84.82 0.05 OUTLIER Glycine 0 C--O 1.196 -2.248 2 N-CA-C 101.829 -4.508 . . . . 0.0 101.829 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 67.37 46.15 1.48 Allowed 'General case' 0 C--O 1.216 -0.67 1 O-C-N 136.371 7.748 . . . . 0.0 110.211 -179.724 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.459 HG23 ' N ' ' A' ' 94' ' ' LEU . 0.5 OUTLIER -179.19 157.36 0.82 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 179.379 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.526 HD13 ' CD2' ' A' ' 50' ' ' PHE . 1.6 tp -87.68 136.57 32.9 Favored 'General case' 0 CA--C 1.477 -1.863 1 O-C-N 130.898 5.124 . . . . 0.0 114.044 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.51 ' CG2' ' HG3' ' A' ' 90' ' ' GLU 0.361 54.8 t -144.64 134.49 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.114 0 CA-C-N 112.387 -2.188 . . . . 0.0 116.737 179.738 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.494 ' SG ' HG23 ' A' ' 85' ' ' THR . 0.0 OUTLIER -136.67 148.94 47.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.844 2.59 . . . . 0.0 104.394 179.622 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.3 t -125.93 83.23 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.937 0 N-CA-C 118.224 2.675 . . . . 0.0 118.224 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.434 ' HG3' ' C ' ' A' ' 105' ' ' ARG . 2.6 mt-30 -58.3 105.17 0.26 Allowed 'General case' 0 C--N 1.359 0.987 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -139.08 86.83 2.16 Favored 'General case' 0 C--O 1.203 -1.392 0 O-C-N 128.775 3.797 . . . . 0.0 114.669 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 83' ' ' VAL . . . -149.7 -66.63 0.01 OUTLIER Glycine 0 C--N 1.342 0.892 0 CA-C-O 125.827 2.904 . . . . 0.0 109.367 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.81 169.8 9.61 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 108.682 -3.759 . . . . 0.0 112.222 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.43 -63.84 0.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 127.551 3.032 . . . . 0.0 114.868 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -59.7 145.56 44.52 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 111.21 -2.723 . . . . 0.0 117.714 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -111.24 87.74 2.62 Favored 'General case' 0 N--CA 1.49 1.56 1 CA-C-N 107.869 -4.241 . . . . 0.0 101.756 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.627 HH22 HD23 ' A' ' 78' ' ' LEU . 1.3 mmm180 -104.91 3.72 31.15 Favored 'General case' 0 C--O 1.199 -1.591 1 O-C-N 132.227 5.955 . . . . 0.0 113.198 -179.117 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -55.13 107.91 0.86 Allowed Glycine 0 N--CA 1.426 -2.002 2 CA-C-N 106.192 -5.004 . . . . 0.0 114.896 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.527 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE 0.262 0.0 OUTLIER -96.56 148.55 22.72 Favored 'General case' 0 C--O 1.207 -1.172 0 O-C-N 128.266 2.98 . . . . 0.0 110.38 179.344 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.453 ' N ' ' CD1' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -163.51 176.91 9.28 Favored 'General case' 0 C--O 1.2 -1.509 1 O-C-N 129.106 4.004 . . . . 0.0 113.423 -178.82 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.516 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -147.2 175.6 10.62 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.845 -2.434 . . . . 0.0 108.95 -179.48 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.462 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.1 OUTLIER -172.28 39.5 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.01 1 O-C-N 129.172 4.045 . . . . 0.0 117.816 179.863 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.401 HG22 HD12 ' A' ' 116' ' ' LEU 0.255 12.8 t 6.92 82.66 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.227 0 C-N-CA 127.55 2.34 . . . . 0.0 115.009 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -84.03 32.14 0.49 Allowed 'General case' 0 CA--C 1.488 -1.419 0 N-CA-C 117.205 2.298 . . . . 0.0 117.205 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 93.56 105.52 1.77 Allowed Glycine 0 C--O 1.21 -1.399 0 N-CA-C 117.409 1.724 . . . . 0.0 117.409 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 1.4 m-20 58.04 15.93 3.48 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 118.66 2.837 . . . . 0.0 118.66 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.424 ' HD2' ' HB2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -167.58 156.35 9.66 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 129.04 3.963 . . . . 0.0 110.13 -179.634 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.401 HD12 HG22 ' A' ' 111' ' ' VAL . 0.4 OUTLIER -111.97 106.32 14.98 Favored 'General case' 0 CA--C 1.482 -1.646 0 O-C-N 128.254 3.471 . . . . 0.0 117.574 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.421 ' CE2' ' HE2' ' A' ' 115' ' ' LYS . 1.2 m-85 -66.34 99.54 0.56 Allowed 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 116.238 -2.185 . . . . 0.0 115.985 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.08 70.8 8.44 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 114.881 -2.727 . . . . 0.0 106.498 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -83.93 111.86 19.63 Favored 'General case' 0 CA--C 1.502 -0.901 0 O-C-N 127.488 2.993 . . . . 0.0 111.268 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.75 156.21 43.9 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 128.651 3.72 . . . . 0.0 110.952 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.403 HG22 ' H ' ' A' ' 123' ' ' GLY . 59.4 m -112.24 160.26 17.79 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 126.951 2.657 . . . . 0.0 105.438 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.9 m -146.18 25.52 1.25 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 120.411 1.46 . . . . 0.0 112.799 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.403 ' H ' HG22 ' A' ' 121' ' ' THR . . . 106.68 29.37 4.72 Favored Glycine 0 N--CA 1.437 -1.235 0 O-C-N 125.834 1.959 . . . . 0.0 114.49 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 126.39 -31.18 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 130.169 3.387 . . . . 0.0 110.996 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -79.15 81.97 5.36 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 128.132 3.395 . . . . 0.0 111.653 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.489 ' O ' HG12 ' A' ' 126' ' ' VAL . 39.1 t -68.34 94.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-N 110.068 -3.242 . . . . 0.0 111.489 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.1 m -72.75 106.12 4.6 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 116.289 -1.815 . . . . 0.0 109.884 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.9 75.98 4.19 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 128.309 3.505 . . . . 0.0 112.917 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -56.54 146.7 24.14 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 115.573 -2.156 . . . . 0.0 110.442 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.2 t -122.63 100.63 8.49 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.424 ' HB2' ' HD2' ' A' ' 115' ' ' LYS . 6.0 m-85 -75.93 176.18 8.11 Favored 'General case' 0 CA--C 1.48 -1.748 0 CA-C-N 109.753 -3.385 . . . . 0.0 116.878 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.423 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.411 0.0 OUTLIER -171.05 110.14 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 110.393 -3.094 . . . . 0.0 103.747 179.795 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.56 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 32.3 ttpt -49.58 127.78 16.28 Favored 'General case' 0 C--O 1.218 -0.576 1 O-C-N 130.149 4.655 . . . . 0.0 110.588 179.476 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 37.7 pttt . . . . . 0 CA--C 1.491 -1.322 0 O-C-N 126.903 2.627 . . . . 0.0 117.545 -179.561 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.4 mtp . . . . . 0 N--CA 1.506 2.36 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.6 -44.63 0.19 Allowed 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.029 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.489 ' HD3' ' CH2' ' A' ' 89' ' ' TRP . 1.1 ptpt -116.03 82.87 1.85 Allowed 'General case' 0 C--N 1.363 1.175 0 N-CA-C 117.84 2.533 . . . . 0.0 117.84 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.27 116.43 31.93 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 102.848 -3.019 . . . . 0.0 102.848 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -133.13 -102.41 0.26 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 115.229 -2.32 . . . . 0.0 109.331 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 m120 35.38 41.4 0.09 Allowed 'General case' 0 C--N 1.307 -1.272 0 O-C-N 127.957 3.286 . . . . 0.0 114.427 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -101.43 -120.09 4.61 Favored Glycine 0 C--O 1.204 -1.766 0 CA-C-O 115.524 -2.82 . . . . 0.0 112.174 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.445 ' OG1' HG23 ' A' ' 42' ' ' ILE . 2.2 m 170.13 147.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.664 1 O-C-N 131.14 4.67 . . . . 0.0 104.132 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.588 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -142.68 91.68 2.33 Favored 'General case' 0 C--N 1.323 -0.577 1 O-C-N 133.422 6.701 . . . . 0.0 116.937 179.935 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 12' ' ' GLU . 10.6 mt-10 -61.66 111.87 2.01 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 116.321 -2.151 . . . . 0.0 107.945 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 37.0 ttp -61.4 74.24 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.715 0 O-C-N 127.096 2.748 . . . . 0.0 106.733 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.402 ' N ' ' O ' ' A' ' 10' ' ' GLU . 1.7 tt0 -23.67 -47.28 0.01 OUTLIER 'General case' 0 C--O 1.2 -1.502 0 O-C-N 128.285 3.491 . . . . 0.0 111.749 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.262 0.3 OUTLIER -145.08 152.2 39.72 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 109.013 -3.721 . . . . 0.0 111.573 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -116.31 104.46 11.51 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-N 109.716 -3.402 . . . . 0.0 112.976 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -50.85 31.82 Favored 'General case' 0 CA--C 1.503 -0.846 1 O-C-N 130.107 4.629 . . . . 0.0 112.364 179.892 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.465 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -161.05 150.34 16.78 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-O 125.239 2.447 . . . . 0.0 110.421 -179.797 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.51 ' CD1' ' N ' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -121.77 -58.15 1.76 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 124.926 2.298 . . . . 0.0 110.02 179.706 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 19' ' ' GLY . 9.2 pt-20 -71.32 -28.55 64.17 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 113.756 -1.566 . . . . 0.0 114.537 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.465 ' N ' ' OD1' ' A' ' 16' ' ' ASN . . . -70.71 -23.27 77.95 Favored Glycine 0 N--CA 1.488 2.148 0 O-C-N 128.549 3.656 . . . . 0.0 109.374 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.422 ' CD2' HD11 ' A' ' 120' ' ' LEU . 2.7 t80 -75.38 -28.28 59.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 119.049 1.425 . . . . 0.0 108.751 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.547 ' HG2' HG21 ' A' ' 26' ' ' ILE . 21.9 mtt -76.95 -33.3 57.69 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-N 113.245 -1.798 . . . . 0.0 107.838 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.481 ' HA ' ' CE ' ' A' ' 22' ' ' LYS . 4.7 mmpt? -68.59 -30.04 68.7 Favored 'General case' 0 C--O 1.203 -1.363 0 O-C-N 128.558 3.661 . . . . 0.0 114.159 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.5 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -73.48 -39.17 65.1 Favored 'General case' 0 C--O 1.208 -1.114 2 O-C-N 130.994 5.184 . . . . 0.0 114.773 179.688 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.614 HD12 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -103.7 0.24 30.33 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 127.627 3.079 . . . . 0.0 108.314 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 40.06 98.53 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.251 1 CA-C-O 129.32 4.39 . . . . 0.0 109.804 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.547 HG21 ' HG2' ' A' ' 21' ' ' MET . 6.4 tp -127.09 -45.01 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.108 0 CA-C-N 109.637 -3.438 . . . . 0.0 113.137 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -151.07 142.91 23.83 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 119.119 -2.238 . . . . 0.0 108.849 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.515 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 7.6 m-85 -80.95 65.33 6.05 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 72.19 73.47 0.16 Allowed 'General case' 0 C--O 1.203 -1.35 0 O-C-N 127.331 2.894 . . . . 0.0 107.848 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.15 -40.96 64.44 Favored 'General case' 0 N--CA 1.479 1.023 1 CA-C-N 106.658 -4.792 . . . . 0.0 114.141 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.667 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -71.01 -120.55 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.019 1 O-C-N 130.317 4.76 . . . . 0.0 112.636 -179.827 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.23 9.5 2.14 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 129.021 3.951 . . . . 0.0 108.335 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 31' ' ' ARG . 2.7 mp -142.17 -49.51 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 111.415 -2.63 . . . . 0.0 108.175 -179.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -93.2 35.29 1.08 Allowed 'General case' 0 C--O 1.205 -1.264 0 CA-C-O 122.228 1.013 . . . . 0.0 111.877 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.504 HG13 ' CZ ' ' A' ' 17' ' ' PHE . 55.0 t -50.47 -34.95 12.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.705 0 C-N-CA 127.48 2.312 . . . . 0.0 115.897 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 153.74 122.82 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 1 O-C-N 129.394 4.184 . . . . 0.0 111.487 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.817 HD12 ' N ' ' A' ' 38' ' ' THR . 1.3 pp -106.27 -11.52 16.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 113.937 -2.935 . . . . 0.0 110.87 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.817 ' N ' HD12 ' A' ' 37' ' ' LEU . 6.3 m 145.96 98.85 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.082 1 O-C-N 134.132 7.145 . . . . 0.0 111.039 -179.694 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.96 114.78 26.99 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 127.089 2.743 . . . . 0.0 117.562 -179.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 m -106.43 112.14 25.02 Favored 'General case' 0 C--O 1.209 -1.061 1 O-C-N 130.522 4.889 . . . . 0.0 110.824 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.544 ' NZ ' HD12 ' A' ' 43' ' ' ILE . 2.4 tmtt? -105.55 119.94 40.38 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 127.908 3.255 . . . . 0.0 107.593 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.572 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.7 mp -109.86 159.93 9.18 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 128.645 3.715 . . . . 0.0 111.625 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.572 ' N ' HG22 ' A' ' 42' ' ' ILE 0.307 1.0 OUTLIER -132.37 146.83 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-N 109.443 -3.526 . . . . 0.0 106.898 179.668 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 55.8 t -156.88 113.66 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.34 0 O-C-N 126.389 2.305 . . . . 0.0 110.428 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.456 ' HG2' ' CD2' ' A' ' 50' ' ' PHE . 1.1 mt-30 -114.73 134.37 55.15 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-O 125.159 2.409 . . . . 0.0 112.88 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -130.04 40.84 3.5 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 108.445 -3.979 . . . . 0.0 110.741 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.0 114.76 0.02 OUTLIER Glycine 0 C--N 1.349 1.304 0 CA-C-N 112.525 -2.125 . . . . 0.0 110.646 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 73.5 -68.9 0.2 Allowed 'General case' 0 C--O 1.217 -0.612 0 O-C-N 126.796 2.115 . . . . 0.0 111.735 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -78.85 92.96 4.92 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.754 1.622 . . . . 0.0 109.934 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.697 ' CE1' HD22 ' A' ' 94' ' ' LEU . 44.8 t80 -98.18 117.59 32.89 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.006 5.191 . . . . 0.0 111.259 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -130.35 86.76 2.42 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 128.236 3.46 . . . . 0.0 117.713 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.524 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -68.77 153.19 44.22 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 128.181 3.426 . . . . 0.0 106.725 179.868 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.467 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -156.33 147.1 21.89 Favored 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 128.007 3.317 . . . . 0.0 108.294 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.404 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 1.0 OUTLIER -108.83 151.9 25.61 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 127.001 2.688 . . . . 0.0 107.756 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -134.79 52.51 2.04 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.62 -92.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 1 O-C-N 131.859 5.724 . . . . 0.0 110.315 179.845 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 m 148.15 -53.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.448 1 O-C-N 130.795 5.06 . . . . 0.0 102.288 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.495 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 3.0 m-85 -51.42 -58.77 5.34 Favored 'General case' 0 N--CA 1.474 0.771 1 O-C-N 130.725 5.016 . . . . 0.0 108.231 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -154.47 111.12 3.3 Favored 'General case' 0 C--N 1.364 1.232 1 CA-C-N 106.952 -4.658 . . . . 0.0 113.823 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.404 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 0.0 OUTLIER -105.39 97.84 7.62 Favored 'General case' 0 C--O 1.218 -0.566 1 O-C-N 130.565 4.916 . . . . 0.0 110.329 179.89 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.0 89.91 3.21 Favored 'General case' 0 C--N 1.318 -0.763 1 O-C-N 129.36 4.163 . . . . 0.0 105.899 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.467 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 21.8 p30 -84.11 165.19 18.7 Favored 'General case' 0 C--O 1.199 -1.579 1 O-C-N 130.688 4.993 . . . . 0.0 115.987 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.769 HD21 ' HZ2' ' A' ' 107' ' ' TRP . 10.8 tp -100.58 54.06 0.87 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 111.43 -2.623 . . . . 0.0 112.268 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.41 100.12 12.79 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 124.266 1.984 . . . . 0.0 112.771 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.556 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -151.0 -137.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 112.774 -2.012 . . . . 0.0 110.47 179.478 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.6 m -156.14 153.44 29.31 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.478 HG11 ' CD1' ' A' ' 89' ' ' TRP . 3.4 t -76.32 151.91 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.313 0 O-C-N 125.194 1.559 . . . . 0.0 113.81 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 43.64 30.21 1.44 Allowed Glycine 0 C--O 1.215 -1.08 1 O-C-N 130.663 4.977 . . . . 0.0 115.241 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.266 0.8 OUTLIER -102.54 -5.52 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 112.679 -1.761 . . . . 0.0 109.829 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 66.37 99.45 0.05 OUTLIER 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 127.138 2.774 . . . . 0.0 111.78 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.573 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 2.4 t80 -83.38 95.48 8.23 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 127.417 2.948 . . . . 0.0 118.591 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 36.3 p-10 -74.21 76.33 1.8 Allowed 'General case' 0 C--O 1.202 -1.437 0 CA-C-O 123.991 1.853 . . . . 0.0 109.238 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -48.4 128.71 15.02 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 125.044 2.354 . . . . 0.0 113.747 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.32 49.66 2.28 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 127.067 3.318 . . . . 0.0 110.522 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.403 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 8.5 t -70.97 -172.99 0.74 Allowed 'General case' 0 C--O 1.203 -1.372 0 CA-C-N 111.161 -2.745 . . . . 0.0 110.893 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.403 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -165.77 -51.05 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 126.459 3.028 . . . . 0.0 114.262 179.97 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -90.72 61.56 3.09 Favored Glycine 0 N--CA 1.473 1.141 0 CA-C-N 109.352 -3.567 . . . . 0.0 112.792 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.514 ' O ' HD11 ' A' ' 24' ' ' LEU 0.268 8.4 tp 176.27 -32.43 0.0 OUTLIER 'General case' 0 C--O 1.241 0.612 0 CA-C-N 109.822 -3.189 . . . . 0.0 115.487 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.554 ' HA ' HD11 ' A' ' 24' ' ' LEU . 15.8 t0 -141.16 -53.68 0.47 Allowed 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.23 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 62.83 65.88 2.88 Favored Glycine 0 C--O 1.206 -1.623 0 CA-C-O 125.481 2.712 . . . . 0.0 111.519 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -127.65 -86.82 0.58 Allowed 'General case' 0 C--N 1.364 1.211 1 CA-C-N 107.043 -4.578 . . . . 0.0 114.372 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 132.36 73.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.117 1 O-C-N 129.271 4.107 . . . . 0.0 108.646 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.67 178.17 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 128.281 3.488 . . . . 0.0 115.929 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -108.85 158.06 18.02 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 133.401 6.688 . . . . 0.0 107.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.573 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.7 m -156.1 75.47 0.89 Allowed 'General case' 0 C--O 1.199 -1.602 0 O-C-N 128.267 3.479 . . . . 0.0 111.547 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.06 146.05 44.31 Favored 'General case' 0 N--CA 1.429 -1.507 1 CA-C-N 107.243 -4.526 . . . . 0.0 109.644 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 t -131.28 148.98 32.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 C-N-CA 127.08 2.152 . . . . 0.0 107.648 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.44 ' CG2' ' N ' ' A' ' 89' ' ' TRP 0.345 0.9 OUTLIER -166.88 165.89 15.84 Favored 'General case' 0 CA--C 1.473 -2.007 0 CA-C-O 125.893 2.759 . . . . 0.0 112.414 -179.712 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.618 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 38.4 m95 -96.3 113.73 25.34 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-O 113.472 -3.156 . . . . 0.0 109.284 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.702 ' CB ' HG23 ' A' ' 93' ' ' THR . 4.9 tp10 -73.74 -45.87 49.37 Favored 'General case' 0 CA--C 1.477 -1.858 1 CA-C-O 131.861 5.601 . . . . 0.0 112.784 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.78 -46.36 0.15 Allowed Glycine 0 CA--C 1.542 1.775 0 CA-C-N 108.692 -3.867 . . . . 0.0 104.94 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -144.16 57.44 1.33 Allowed 'General case' 0 N--CA 1.427 -1.622 0 O-C-N 128.121 2.895 . . . . 0.0 111.268 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.702 HG23 ' CB ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER 170.83 151.93 0.05 OUTLIER 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 108.537 -3.938 . . . . 0.0 117.688 179.475 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.697 HD22 ' CE1' ' A' ' 50' ' ' PHE . 0.4 OUTLIER -85.21 3.9 37.14 Favored 'General case' 0 CA--C 1.476 -1.873 1 O-C-N 131.548 5.53 . . . . 0.0 119.637 -178.941 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.481 ' O ' HG12 ' A' ' 95' ' ' VAL 0.435 27.4 t -3.45 117.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -131.14 149.11 52.74 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-O 123.538 1.637 . . . . 0.0 109.019 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.6 122.35 54.96 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.597 0 CA-C-N 111.854 -2.43 . . . . 0.0 117.369 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.457 ' CG ' ' HB3' ' A' ' 105' ' ' ARG . 1.2 tt0 -90.22 117.54 29.04 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 120.821 -1.174 . . . . 0.0 108.295 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.0 tppt? -47.94 -36.19 12.01 Favored 'General case' 0 N--CA 1.486 1.341 1 O-C-N 129.476 4.235 . . . . 0.0 108.659 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 65.91 -83.22 0.09 OUTLIER Glycine 0 C--O 1.199 -2.063 0 CA-C-N 112.543 -2.117 . . . . 0.0 113.269 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 91.31 35.32 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.052 1 CA-C-N 107.177 -4.511 . . . . 0.0 110.477 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.574 ' CD ' ' HG2' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 169.69 -42.79 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 110.952 -2.84 . . . . 0.0 113.556 -179.881 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.574 ' HG2' ' CD ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -129.38 151.56 49.88 Favored 'General case' 0 N--CA 1.433 -1.321 0 O-C-N 127.096 2.747 . . . . 0.0 115.236 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -82.82 103.06 12.02 Favored 'General case' 0 N--CA 1.491 1.59 1 O-C-N 132.271 5.982 . . . . 0.0 101.888 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.616 ' NH2' HD13 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -118.96 28.02 8.53 Favored 'General case' 0 C--N 1.31 -1.126 1 O-C-N 130.57 4.919 . . . . 0.0 110.562 -178.88 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -93.7 131.05 10.58 Favored Glycine 0 N--CA 1.427 -1.936 1 CA-C-N 106.583 -4.826 . . . . 0.0 112.703 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.769 ' HZ2' HD21 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -111.78 147.01 36.58 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 129.133 3.49 . . . . 0.0 107.047 177.383 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.464 ' HB2' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -138.97 -176.16 4.4 Favored 'General case' 0 C--O 1.215 -0.721 1 O-C-N 129.724 4.39 . . . . 0.0 111.111 -179.102 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.678 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -156.18 115.61 3.54 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 115.308 -2.557 . . . . 0.0 111.119 -176.168 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.52 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -132.7 124.26 27.85 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 117.422 2.379 . . . . 0.0 117.422 179.506 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 42.3 t -59.5 103.98 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.819 0 CA-C-O 123.718 1.723 . . . . 0.0 112.497 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -101.21 40.34 1.3 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 112.239 -2.255 . . . . 0.0 114.406 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.85 -112.7 3.7 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-N 111.789 -2.46 . . . . 0.0 115.036 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -68.15 -49.51 60.51 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -98.27 -179.08 4.25 Favored 'General case' 0 C--O 1.22 -0.48 0 O-C-N 128.963 3.915 . . . . 0.0 107.568 -179.712 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.422 ' HG ' ' N ' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -143.73 136.72 27.54 Favored 'General case' 0 C--O 1.202 -1.41 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.503 179.722 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.52 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 10.1 m-85 -81.76 163.77 22.17 Favored 'General case' 0 C--O 1.208 -1.115 0 C-N-CA 115.538 -2.465 . . . . 0.0 114.133 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 118' ' ' LEU . 2.2 tt -130.34 21.0 5.23 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 128.264 3.477 . . . . 0.0 106.804 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -28.58 125.55 0.1 Allowed 'General case' 0 N--CA 1.48 1.053 1 O-C-N 131.372 5.42 . . . . 0.0 109.922 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.616 HD13 ' NH2' ' A' ' 105' ' ' ARG . 0.2 OUTLIER -143.78 155.8 44.28 Favored 'General case' 0 CA--C 1.488 -1.406 0 C-N-CA 116.012 -2.275 . . . . 0.0 110.518 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.546 ' O ' HD12 ' A' ' 120' ' ' LEU . 23.5 m -114.82 158.8 21.42 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.358 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.5 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -157.66 49.6 0.42 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 126.379 2.99 . . . . 0.0 113.612 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.426 ' CA ' ' HB2' ' A' ' 103' ' ' GLU . . . 93.09 -100.95 2.72 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 112.968 -1.923 . . . . 0.0 108.699 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.92 -59.93 2.49 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 111.665 -2.267 . . . . 0.0 112.236 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -73.59 174.87 7.68 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 128.031 3.332 . . . . 0.0 108.963 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.1 t -150.35 71.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.821 2 O-C-N 131.307 5.38 . . . . 0.0 113.219 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 114.63 1.45 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 116.337 -1.792 . . . . 0.0 110.696 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.12 79.89 1.66 Allowed 'General case' 0 CA--C 1.497 -1.063 0 O-C-N 128.608 3.693 . . . . 0.0 114.171 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -56.13 129.59 40.7 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.277 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.25 0.4 OUTLIER -110.12 136.92 44.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 123.905 1.812 . . . . 0.0 108.753 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.497 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 67.4 m-85 -128.09 168.23 15.65 Favored 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 111.111 -2.768 . . . . 0.0 116.92 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.484 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.354 0.0 OUTLIER -143.61 30.13 1.37 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 116.234 -1.841 . . . . 0.0 108.813 179.881 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.588 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 62.2 176.65 0.13 Allowed 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 117.449 -1.7 . . . . 0.0 111.42 -179.43 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.448 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.259 1.594 0 CA-C-O 116.224 -1.846 . . . . 0.0 114.963 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.201 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.503 ' CG2' ' HB3' ' A' ' 92' ' ' ASN . 0.7 OUTLIER -127.62 -60.29 1.18 Allowed 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 127.265 2.853 . . . . 0.0 106.108 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.34 166.9 11.16 Favored 'General case' 0 CA--C 1.497 -1.083 0 CA-C-N 113.29 -1.777 . . . . 0.0 113.237 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 63.5 t0 67.53 84.54 0.15 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 102.709 -3.071 . . . . 0.0 102.709 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -116.31 46.36 1.6 Allowed 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 44' ' ' VAL . 5.1 t-20 -34.13 137.5 0.11 Allowed 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 126.172 2.17 . . . . 0.0 113.976 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 160.26 -163.53 33.94 Favored Glycine 0 C--O 1.218 -0.887 0 CA-C-O 115.271 -2.961 . . . . 0.0 112.463 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.477 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -136.91 144.47 43.5 Favored 'General case' 0 C--O 1.202 -1.434 1 O-C-N 132.725 5.603 . . . . 0.0 103.688 -179.828 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.554 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.283 0.0 OUTLIER -141.56 137.16 31.77 Favored 'General case' 0 CA--C 1.496 -1.119 1 O-C-N 131.832 5.708 . . . . 0.0 112.891 -179.191 . . . . . . . . 5 4 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.5 mm-40 -81.5 5.12 18.82 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 125.52 1.763 . . . . 0.0 115.551 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.0 ttp 58.61 -91.01 0.03 OUTLIER 'General case' 0 C--O 1.246 0.919 0 CA-C-O 111.955 -3.879 . . . . 0.0 104.134 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.8 tt0 119.54 -45.56 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.985 1 O-C-N 129.495 4.247 . . . . 0.0 110.106 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.96 155.84 5.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.479 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.84 169.89 12.77 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 110.563 -3.017 . . . . 0.0 111.882 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.405 ' HB3' ' O ' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -121.93 124.96 45.3 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 128.812 3.82 . . . . 0.0 113.118 179.923 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 t30 46.35 84.5 0.03 OUTLIER 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 124.051 1.881 . . . . 0.0 112.645 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -92.12 -30.56 15.91 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-N 112.769 -2.014 . . . . 0.0 112.871 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.468 ' HG3' ' CZ ' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -71.24 -56.78 5.35 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.064 -2.398 . . . . 0.0 112.608 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.448 ' HA2' ' HB2' ' A' ' 22' ' ' LYS . . . -53.87 -23.59 23.25 Favored Glycine 0 CA--C 1.489 -1.57 1 O-C-N 132.276 5.985 . . . . 0.0 113.252 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.87 -49.58 19.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 126.843 3.211 . . . . 0.0 108.128 179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.468 ' O ' HG22 ' A' ' 26' ' ' ILE . 19.7 mmm -68.77 -20.54 64.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 119.73 -1.856 . . . . 0.0 112.345 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.448 ' HB2' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.8 -22.77 42.69 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.55 3.031 . . . . 0.0 110.341 179.754 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -37.33 63.71 Favored 'General case' 0 C--O 1.207 -1.177 1 O-C-N 131.745 5.653 . . . . 0.0 112.806 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.84 9.36 40.78 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 128.446 3.591 . . . . 0.0 108.802 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 32.53 66.94 0.17 Allowed 'General case' 0 CA--C 1.482 -1.647 0 CA-C-O 127.008 3.29 . . . . 0.0 113.348 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.666 HD12 ' O ' ' A' ' 78' ' ' LEU . 10.7 tt -87.5 -31.48 5.91 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-O 126.685 3.136 . . . . 0.0 112.355 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.05 -176.55 0.25 Allowed 'General case' 0 C--N 1.36 1.044 0 CA-C-N 112.72 -2.036 . . . . 0.0 112.832 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.445 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 26.4 m-85 -125.0 35.73 4.73 Favored 'General case' 0 CA--C 1.501 -0.915 0 O-C-N 126.517 2.386 . . . . 0.0 111.127 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.52 177.36 6.71 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.258 3.474 . . . . 0.0 106.736 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.602 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.8 OUTLIER 76.97 -62.46 0.4 Allowed 'General case' 0 C--O 1.214 -0.807 0 O-C-N 128.747 3.78 . . . . 0.0 111.423 -179.564 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.468 ' CZ ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -38.4 -19.74 0.01 OUTLIER 'General case' 0 C--O 1.243 0.755 1 O-C-N 130.735 5.022 . . . . 0.0 113.079 -179.86 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -86.81 -32.4 20.34 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 127.668 3.105 . . . . 0.0 111.906 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 30' ' ' THR . 0.2 OUTLIER -111.42 36.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 128.665 3.728 . . . . 0.0 115.071 -179.586 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.26 23.25 11.95 Favored 'General case' 0 C--O 1.201 -1.491 0 CA-C-O 126.081 2.848 . . . . 0.0 108.568 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.431 ' O ' ' CE1' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -62.96 178.74 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 108.785 -3.825 . . . . 0.0 106.65 176.935 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.412 ' HD2' ' HA ' ' A' ' 36' ' ' ARG . 4.2 mpt_? -49.04 -30.39 6.19 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 127.584 3.052 . . . . 0.0 112.254 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.863 HD21 ' HB3' ' A' ' 58' ' ' PHE . 3.8 pp 29.84 108.48 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 2 O-C-N 134.822 7.576 . . . . 0.0 113.479 177.987 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.6 m 57.17 42.95 24.77 Favored 'General case' 0 CA--C 1.479 -1.767 0 CA-C-N 110.793 -2.912 . . . . 0.0 118.333 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.512 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.3 OUTLIER -159.34 -97.59 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.517 ' CG2' ' N ' ' A' ' 41' ' ' LYS . 1.3 m 172.56 159.15 0.11 Allowed 'General case' 0 C--O 1.199 -1.566 0 O-C-N 128.842 3.839 . . . . 0.0 112.387 -175.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.517 ' N ' ' CG2' ' A' ' 40' ' ' THR . 0.0 OUTLIER -111.98 158.21 19.79 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 101.708 -3.441 . . . . 0.0 101.708 178.43 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.783 HD11 ' HB2' ' A' ' 55' ' ' ASN . 2.1 mp -134.32 156.85 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 119.912 1.233 . . . . 0.0 111.587 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.556 ' N ' HG22 ' A' ' 42' ' ' ILE . 5.3 tt -132.31 135.74 57.49 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 0 CA-C-N 111.248 -2.705 . . . . 0.0 107.828 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.693 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.3 t -110.49 -64.97 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 N-CA-C 116.323 1.971 . . . . 0.0 116.323 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.693 ' N ' HG12 ' A' ' 44' ' ' VAL . 1.7 tm0? 65.32 140.24 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 125.851 2.739 . . . . 0.0 112.071 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -165.6 71.93 0.16 Allowed 'General case' 0 C--N 1.363 1.189 0 CA-C-N 110.244 -3.162 . . . . 0.0 114.007 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.06 -89.07 1.5 Allowed Glycine 0 C--O 1.216 -1.025 0 CA-C-O 122.893 1.274 . . . . 0.0 110.793 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -108.76 -44.47 4.02 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 109.586 -3.307 . . . . 0.0 110.788 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -64.16 95.49 0.13 Allowed 'General case' 0 C--N 1.357 0.904 0 O-C-N 127.269 2.856 . . . . 0.0 109.172 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.631 ' CD2' HD22 ' A' ' 94' ' ' LEU . 42.5 t80 -95.91 95.75 8.46 Favored 'General case' 0 CA--C 1.496 -1.134 1 O-C-N 129.539 4.274 . . . . 0.0 113.021 -179.933 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.442 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 43.7 mttt -105.65 165.63 11.03 Favored 'General case' 0 CA--C 1.491 -1.297 0 O-C-N 128.789 3.806 . . . . 0.0 113.84 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.54 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -148.61 111.35 4.79 Favored 'General case' 0 CA--C 1.499 -0.997 1 O-C-N 131.047 5.217 . . . . 0.0 107.797 179.713 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.57 153.17 42.55 Favored 'General case' 0 C--O 1.208 -1.128 0 C-N-CA 117.666 -1.614 . . . . 0.0 111.289 -179.468 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.6 157.67 17.02 Favored 'General case' 0 C--N 1.313 -0.979 0 O-C-N 125.878 1.986 . . . . 0.0 111.073 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.783 ' HB2' HD11 ' A' ' 42' ' ' ILE . 1.7 t-20 -107.82 -18.58 13.78 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-O 113.824 -2.989 . . . . 0.0 115.233 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.475 ' HA ' ' HB3' ' A' ' 39' ' ' GLN . 16.5 p -16.85 152.22 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.181 1 O-C-N 135.703 8.127 . . . . 0.0 113.566 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.84 -33.19 57.94 Favored 'General case' 0 CA--C 1.504 -0.819 1 CA-C-N 107.588 -4.369 . . . . 0.0 109.038 179.519 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.863 ' HB3' HD21 ' A' ' 37' ' ' LEU . 5.8 p90 -68.14 -53.31 26.1 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 126.938 2.648 . . . . 0.0 114.438 -179.349 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -172.47 130.81 0.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 O-C-N 127.985 3.303 . . . . 0.0 110.183 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 90.64 5.81 Favored 'General case' 0 C--O 1.204 -1.318 0 O-C-N 127.604 3.065 . . . . 0.0 113.409 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.58 141.68 37.46 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 109.083 -3.689 . . . . 0.0 109.047 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.91 161.52 14.38 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 126.877 2.611 . . . . 0.0 116.095 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.54 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 11.1 tp -109.99 62.22 0.6 Allowed 'General case' 0 C--O 1.214 -0.781 0 O-C-N 129.096 3.997 . . . . 0.0 110.753 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.442 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 7.2 p-10 -71.11 93.99 1.09 Allowed 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 112.568 -2.106 . . . . 0.0 111.141 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.675 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -127.85 169.36 13.99 Favored 'General case' 0 CA--C 1.494 -1.181 0 CA-C-O 126.686 3.136 . . . . 0.0 109.31 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.63 HG22 ' HB ' ' A' ' 69' ' ' VAL . 0.6 OUTLIER -147.97 172.82 13.61 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 110.302 -3.135 . . . . 0.0 106.972 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.447 HG12 ' N ' ' A' ' 68' ' ' GLY . 21.3 t -87.59 142.82 12.44 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.463 0 O-C-N 126.459 2.35 . . . . 0.0 115.664 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 67' ' ' VAL . . . 37.78 33.55 0.14 Allowed Glycine 0 C--N 1.342 0.894 1 O-C-N 129.806 4.441 . . . . 0.0 116.721 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.63 ' HB ' HG22 ' A' ' 66' ' ' THR . 13.4 p -81.24 -14.22 12.6 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.941 0 C-N-CA 117.797 -1.561 . . . . 0.0 108.459 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 72' ' ' ASP . 24.6 tt0 58.31 75.77 0.37 Allowed 'General case' 0 C--N 1.355 0.815 0 O-C-N 128.692 3.745 . . . . 0.0 109.361 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.569 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.2 OUTLIER -62.11 81.13 0.02 OUTLIER 'General case' 0 C--N 1.345 0.409 1 O-C-N 131.983 5.802 . . . . 0.0 111.039 179.769 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 70' ' ' GLU . 24.3 t70 -60.27 76.74 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.427 ' HG2' ' CA ' ' A' ' 83' ' ' VAL 0.272 32.6 mt-10 57.45 111.48 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.207 0 O-C-N 125.823 1.952 . . . . 0.0 113.698 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.525 ' CE1' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER 176.2 69.17 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 108.667 -3.879 . . . . 0.0 111.923 179.558 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 82.4 p -99.26 -27.97 13.54 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 110.318 -3.128 . . . . 0.0 115.675 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.525 ' HE2' ' CE1' ' A' ' 74' ' ' HIS . 0.1 OUTLIER -35.92 153.94 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 1 O-C-N 130.049 4.593 . . . . 0.0 114.772 -179.819 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.6 24.12 Favored Glycine 0 C--O 1.218 -0.89 0 CA-C-N 111.218 -2.719 . . . . 0.0 110.664 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.666 ' O ' HD12 ' A' ' 26' ' ' ILE . 10.8 tp -163.73 -47.75 0.03 OUTLIER 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 126.963 3.268 . . . . 0.0 112.505 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.79 -67.04 1.03 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 110.562 -3.017 . . . . 0.0 113.24 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.98 69.93 1.16 Allowed Glycine 0 C--O 1.209 -1.44 0 CA-C-O 125.727 2.848 . . . . 0.0 110.842 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.521 ' NE ' ' HA ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -114.47 -156.04 0.59 Allowed 'General case' 0 N--CA 1.49 1.567 1 CA-C-N 107.399 -4.4 . . . . 0.0 107.944 -179.585 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.415 ' CG ' ' HB3' ' A' ' 73' ' ' GLU . 0.3 OUTLIER -174.52 82.21 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 127.544 3.027 . . . . 0.0 108.118 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.438 HG13 ' HA3' ' A' ' 100' ' ' GLY . 2.3 t -138.09 153.54 27.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 N-CA-C 118.17 2.655 . . . . 0.0 118.17 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -55.97 147.05 20.59 Favored 'General case' 0 C--O 1.239 0.524 1 O-C-N 129.592 4.307 . . . . 0.0 106.334 179.448 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.569 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 2.1 m -152.83 70.79 0.9 Allowed 'General case' 0 C--O 1.199 -1.553 1 O-C-N 130.589 4.931 . . . . 0.0 112.066 -179.161 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 70' ' ' GLU . 2.0 tp -70.65 140.88 51.67 Favored 'General case' 0 C--O 1.209 -1.039 1 CA-C-N 107.114 -4.585 . . . . 0.0 115.298 -179.915 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.532 HG12 HD11 ' A' ' 94' ' ' LEU . 2.2 t -116.79 142.31 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 111.728 -2.487 . . . . 0.0 107.012 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.253 16.4 m -159.1 161.82 36.45 Favored 'General case' 0 CA--C 1.48 -1.75 0 O-C-N 126.175 2.172 . . . . 0.0 111.499 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.663 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 33.5 m95 -98.87 143.97 28.6 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 128.309 2.644 . . . . 0.0 107.957 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.686 ' HB3' HG22 ' A' ' 93' ' ' THR . 9.7 tp10 -99.46 -30.78 11.98 Favored 'General case' 0 C--O 1.195 -1.794 1 CA-C-O 128.521 4.01 . . . . 0.0 112.09 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.44 -40.25 0.51 Allowed Glycine 0 C--O 1.21 -1.371 1 N-CA-C 102.751 -4.14 . . . . 0.0 102.751 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.503 ' HB3' ' CG2' ' A' ' 2' ' ' THR . 10.7 p-10 -149.54 31.04 0.74 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.767 5.04 . . . . 0.0 111.579 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.686 HG22 ' HB3' ' A' ' 90' ' ' GLU . 5.5 t -167.74 149.67 5.59 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 117.672 2.471 . . . . 0.0 117.672 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.631 HD22 ' CD2' ' A' ' 50' ' ' PHE . 1.6 tp -85.81 87.24 7.38 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 118.036 2.606 . . . . 0.0 118.036 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.556 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.335 53.4 t -81.79 120.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.361 1.101 0 O-C-N 128.006 3.317 . . . . 0.0 112.451 179.712 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.524 ' HB2' ' CZ3' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -143.07 143.69 31.96 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 126.79 3.185 . . . . 0.0 108.916 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.9 m -133.55 144.08 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 108.459 -3.973 . . . . 0.0 117.813 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -96.57 101.03 12.58 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 110.692 -2.958 . . . . 0.0 106.959 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -92.31 96.11 10.09 Favored 'General case' 0 CA--C 1.496 -1.101 0 C-N-CA 114.449 -2.9 . . . . 0.0 114.229 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.438 ' HA3' HG13 ' A' ' 83' ' ' VAL . . . 138.86 160.49 8.4 Favored Glycine 0 C--N 1.348 1.218 1 CA-C-O 128.055 4.142 . . . . 0.0 114.267 179.137 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.16 178.19 0.06 Allowed 'General case' 0 CA--C 1.499 -1.016 1 CA-C-N 106.631 -4.785 . . . . 0.0 108.553 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.86 -68.35 0.2 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 117.218 2.303 . . . . 0.0 117.218 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -56.31 158.87 3.9 Favored 'General case' 0 C--O 1.2 -1.511 0 CA-C-N 111.253 -2.703 . . . . 0.0 116.671 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.82 105.98 11.23 Favored 'General case' 0 N--CA 1.492 1.637 2 O-C-N 130.094 4.621 . . . . 0.0 102.493 179.719 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 122' ' ' CYS . 19.5 mmm-85 -108.05 31.78 5.26 Favored 'General case' 0 C--N 1.32 -0.68 1 O-C-N 130.308 4.755 . . . . 0.0 112.272 -179.68 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -62.77 83.78 0.04 OUTLIER Glycine 0 N--CA 1.428 -1.848 2 O-C-N 131.209 5.318 . . . . 0.0 113.564 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.675 ' CH2' ' CE2' ' A' ' 65' ' ' PHE 0.283 0.0 OUTLIER -99.44 128.38 45.55 Favored 'General case' 0 C--N 1.319 -0.728 1 O-C-N 131.817 5.069 . . . . 0.0 109.962 179.721 . . . . . . . . 5 4 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.529 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.8 OUTLIER -160.92 150.13 16.83 Favored 'General case' 0 CA--C 1.508 -0.647 1 O-C-N 130.074 4.609 . . . . 0.0 117.052 -177.007 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.444 HE22 HD23 ' A' ' 118' ' ' LEU . 28.0 mm-40 -106.42 179.01 4.39 Favored 'General case' 0 C--N 1.359 0.984 0 CA-C-O 113.497 -3.144 . . . . 0.0 109.648 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.529 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 0.7 OUTLIER 173.37 82.69 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.279 1 O-C-N 131.726 5.641 . . . . 0.0 117.71 178.526 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 80.6 t -45.57 102.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.761 0 CA-C-O 127.973 3.749 . . . . 0.0 116.239 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -85.31 20.28 2.04 Favored 'General case' 0 N--CA 1.484 1.238 1 CA-C-N 108.345 -4.025 . . . . 0.0 116.042 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.49 -101.28 0.33 Allowed Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.148 1.219 . . . . 0.0 116.148 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.53 12.69 25.88 Favored 'General case' 0 C--O 1.207 -1.137 0 N-CA-C 118.302 2.705 . . . . 0.0 118.302 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.417 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.7 OUTLIER -143.7 172.89 12.2 Favored 'General case' 0 C--N 1.32 -0.705 2 O-C-N 132.192 5.933 . . . . 0.0 109.388 179.837 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.737 HD23 ' O ' ' A' ' 116' ' ' LEU . 0.6 OUTLIER -138.78 121.05 15.88 Favored 'General case' 0 CA--C 1.48 -1.74 1 O-C-N 129.88 4.487 . . . . 0.0 111.713 179.942 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.484 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 4.7 m-85 -76.83 158.51 30.77 Favored 'General case' 0 C--O 1.213 -0.857 0 C-N-CA 115.888 -2.325 . . . . 0.0 116.097 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.511 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -137.95 46.49 2.07 Favored 'General case' 0 C--N 1.349 0.572 2 O-C-N 130.039 4.587 . . . . 0.0 108.261 179.789 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -62.03 157.32 19.07 Favored 'General case' 0 CA--C 1.506 -0.739 0 C-N-CA 127.067 2.147 . . . . 0.0 109.338 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.81 177.08 5.93 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 116.735 -1.986 . . . . 0.0 111.305 179.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 47.7 m -135.8 155.71 49.93 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.2 OUTLIER -159.05 72.28 0.55 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 126.01 2.814 . . . . 0.0 114.155 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.27 58.15 9.24 Favored Glycine 0 CA--C 1.532 1.131 0 CA-C-N 112.039 -2.346 . . . . 0.0 111.273 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 62.98 52.6 2.55 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 126.523 1.929 . . . . 0.0 109.594 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -137.46 26.23 2.86 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-N 111.684 -2.507 . . . . 0.0 109.191 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 126' ' ' VAL . 89.6 t -18.63 86.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.963 1 O-C-N 129.688 4.367 . . . . 0.0 111.653 179.926 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.42 150.78 31.2 Favored 'General case' 0 CA--C 1.49 -1.357 0 CA-C-N 111.936 -2.393 . . . . 0.0 112.843 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 3.9 ttp85 -124.71 151.13 45.41 Favored 'General case' 0 C--N 1.353 0.749 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.333 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -136.95 166.31 23.95 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 127.015 2.697 . . . . 0.0 114.862 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.3 t -150.94 143.26 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-O 128.117 3.818 . . . . 0.0 105.99 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.511 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 29.6 m-85 -137.34 -175.83 4.19 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-N 108.988 -3.733 . . . . 0.0 114.48 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -168.77 122.74 0.85 Allowed 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 178.767 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.554 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 35.7 ttpt -50.54 95.55 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 112.467 -2.152 . . . . 0.0 116.013 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt . . . . . 0 C--O 1.259 1.556 0 O-C-N 126.789 2.556 . . . . 0.0 116.499 179.604 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 mtm . . . . . 0 N--CA 1.499 1.98 0 CA-C-O 121.32 0.581 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.62 141.82 2.98 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.457 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm 45.16 76.04 0.1 Allowed 'General case' 0 CA--C 1.493 -1.22 0 O-C-N 127.899 3.249 . . . . 0.0 118.654 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.405 ' HA ' ' CG2' ' A' ' 111' ' ' VAL . 22.9 m-20 53.1 -104.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -170.22 -146.96 0.05 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 114.96 -2.447 . . . . 0.0 105.888 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -170.77 104.94 0.25 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 130.513 3.525 . . . . 0.0 113.242 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -179.81 -117.43 0.55 Allowed Glycine 0 C--O 1.201 -1.953 0 CA-C-O 116.844 -2.087 . . . . 0.0 113.725 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 40' ' ' THR . 30.8 m -167.69 145.61 4.55 Favored 'General case' 0 C--O 1.216 -0.664 1 O-C-N 130.26 4.153 . . . . 0.0 108.439 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.778 ' CZ2' HD12 ' A' ' 116' ' ' LEU 0.287 0.0 OUTLIER -132.65 125.27 29.97 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 128.441 3.588 . . . . 0.0 112.489 -179.785 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -75.37 -4.06 37.2 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 127.16 2.787 . . . . 0.0 115.004 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.531 ' HG3' ' CE1' ' A' ' 131' ' ' PHE 0.27 16.0 ttm 57.86 62.0 2.22 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 116.209 -1.853 . . . . 0.0 107.266 179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -34.91 -34.7 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 127.766 3.166 . . . . 0.0 111.842 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.29 0.2 OUTLIER -151.39 154.67 37.11 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-O 124.889 2.281 . . . . 0.0 112.254 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -129.92 125.2 34.95 Favored 'General case' 0 CA--C 1.503 -0.864 1 CA-C-N 107.629 -4.351 . . . . 0.0 116.695 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.416 ' HB3' ' HB3' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -112.34 122.88 48.98 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 132.042 5.839 . . . . 0.0 113.892 179.934 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.5 t30 49.99 84.64 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 124.024 1.868 . . . . 0.0 114.323 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.62 -37.58 9.08 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-O 125.725 2.679 . . . . 0.0 111.88 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.255 28.9 tt0 -79.24 -36.25 40.25 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 110.708 -2.951 . . . . 0.0 113.032 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.05 -22.92 76.15 Favored Glycine 0 CA--C 1.486 -1.775 0 O-C-N 128.914 3.884 . . . . 0.0 112.286 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -29.75 65.94 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 123.274 1.511 . . . . 0.0 108.899 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.43 -29.99 57.23 Favored 'General case' 0 CA--C 1.49 -1.338 0 C-N-CA 116.616 -2.034 . . . . 0.0 110.648 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -75.6 -29.76 59.37 Favored 'General case' 0 C--N 1.313 -0.981 0 O-C-N 128.089 3.368 . . . . 0.0 111.25 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.502 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -58.19 -48.71 79.47 Favored 'General case' 0 C--N 1.315 -0.91 1 O-C-N 129.979 4.549 . . . . 0.0 114.485 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 79' ' ' ASP . 1.0 OUTLIER -90.15 -12.33 38.54 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 110.262 -3.154 . . . . 0.0 108.789 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.424 ' N ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER 53.27 104.83 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 O-C-N 128.279 3.487 . . . . 0.0 107.387 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 9.6 tt -112.17 -43.05 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 CA-C-N 110.656 -2.975 . . . . 0.0 109.18 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -170.09 33.69 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 118.489 -2.632 . . . . 0.0 112.844 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.463 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.2 OUTLIER 36.16 76.44 0.05 OUTLIER 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 76.83 63.06 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 124.96 2.314 . . . . 0.0 106.29 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -63.69 -43.28 97.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 108.531 -3.941 . . . . 0.0 109.763 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.503 ' HB3' ' HB3' ' A' ' 34' ' ' ALA 0.272 0.0 OUTLIER -74.69 -105.19 0.01 OUTLIER 'General case' 0 C--O 1.246 0.874 2 O-C-N 130.655 4.972 . . . . 0.0 110.527 179.88 . . . . . . . . 5 4 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 31' ' ' ARG . 29.9 tttm 86.77 -3.19 0.67 Allowed 'General case' 0 C--O 1.203 -1.376 0 O-C-N 128.223 3.452 . . . . 0.0 110.07 -178.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.602 HD13 ' N ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -155.42 31.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 O-C-N 127.059 2.725 . . . . 0.0 108.588 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.503 ' HB3' ' HB3' ' A' ' 31' ' ' ARG . . . -138.86 24.09 2.6 Favored 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 112.864 -1.971 . . . . 0.0 110.151 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 t -44.85 -37.37 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.168 0 CA-C-O 125.276 2.465 . . . . 0.0 109.497 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.967 ' C ' HD13 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 177.89 168.85 0.72 Allowed 'General case' 0 C--O 1.216 -0.702 1 CA-C-N 106.568 -4.833 . . . . 0.0 111.081 178.814 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.967 HD13 ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -150.64 -103.98 0.06 Allowed 'General case' 0 C--N 1.316 -0.89 2 O-C-N 132.1 5.875 . . . . 0.0 107.662 -176.922 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.494 HG22 ' O ' ' A' ' 38' ' ' THR . 35.0 m -130.15 38.65 3.76 Favored 'General case' 0 CA--C 1.488 -1.429 0 O-C-N 127.633 3.083 . . . . 0.0 111.991 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -47.2 150.28 0.86 Allowed 'General case' 0 N--CA 1.481 1.076 0 O-C-N 120.236 -1.54 . . . . 0.0 115.066 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 8' ' ' THR . 22.1 m -168.88 108.09 0.46 Allowed 'General case' 0 C--O 1.216 -0.702 1 O-C-N 130.904 5.128 . . . . 0.0 114.33 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 3.7 tmtt? -94.13 144.34 25.58 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 127.482 2.989 . . . . 0.0 107.166 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.569 HD12 ' O ' ' A' ' 53' ' ' LYS . 4.2 mt -124.9 161.67 28.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.327 0 O-C-N 126.449 2.343 . . . . 0.0 110.622 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.528 ' N ' HG22 ' A' ' 42' ' ' ILE . 12.7 tt -139.26 130.61 34.37 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.508 0 CA-C-N 110.419 -3.082 . . . . 0.0 107.517 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.0 t -106.94 -61.14 2.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 CA-C-O 115.538 -2.172 . . . . 0.0 112.117 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 50.5 130.08 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.265 0 CA-C-O 126.64 3.114 . . . . 0.0 115.946 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -163.95 32.46 0.08 Allowed 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 109.434 -3.53 . . . . 0.0 112.913 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 114.92 -118.67 4.4 Favored Glycine 0 C--N 1.345 1.04 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -79.57 -31.01 41.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 118.073 -1.451 . . . . 0.0 112.69 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -105.45 91.51 3.8 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.729 2.811 . . . . 0.0 108.755 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.495 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 14.7 t80 -103.55 137.6 41.4 Favored 'General case' 0 CA--C 1.48 -1.73 1 O-C-N 129.642 4.339 . . . . 0.0 114.766 -179.444 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.481 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -147.99 99.8 3.11 Favored 'General case' 0 C--O 1.203 -1.363 0 N-CA-C 118.317 2.71 . . . . 0.0 118.317 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.588 ' HB ' HD23 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -73.87 153.88 39.68 Favored 'General case' 0 C--O 1.245 0.822 0 O-C-N 128.629 3.706 . . . . 0.0 105.739 177.807 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.569 ' O ' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -159.69 134.76 8.08 Favored 'General case' 0 CA--C 1.483 -1.62 0 C-N-CA 115.197 -2.601 . . . . 0.0 111.876 -178.554 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -97.64 152.52 18.99 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.736 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -144.49 36.21 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 114.267 -1.333 . . . . 0.0 114.021 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.451 ' O ' HG22 ' A' ' 57' ' ' THR . 3.4 p -37.73 -46.48 0.9 Allowed 'General case' 0 C--N 1.317 -0.824 0 O-C-N 128.535 3.647 . . . . 0.0 106.171 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 57' ' ' THR . 0.6 OUTLIER 88.95 10.35 0.09 Allowed 'General case' 0 N--CA 1.481 1.101 1 O-C-N 130.959 5.162 . . . . 0.0 106.219 -179.941 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -110.4 -51.99 2.82 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 110.765 -2.925 . . . . 0.0 110.998 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.517 ' NH2' ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -164.73 90.56 0.54 Allowed 'General case' 0 C--N 1.359 1.019 0 CA-C-N 109.076 -3.693 . . . . 0.0 109.985 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -91.85 126.27 36.87 Favored 'General case' 0 N--CA 1.431 -1.418 1 CA-C-N 108.061 -4.154 . . . . 0.0 111.854 -179.708 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.517 ' CE1' ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -128.55 47.57 2.43 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 128.722 3.764 . . . . 0.0 107.184 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -28.86 133.54 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 O-C-N 128.937 3.898 . . . . 0.0 113.769 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.588 HD23 ' HB ' ' A' ' 52' ' ' THR . 11.7 tp -82.48 56.31 3.25 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -92.4 99.89 12.56 Favored 'General case' 0 C--O 1.205 -1.252 0 O-C-N 126.182 2.176 . . . . 0.0 112.823 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.513 ' HE2' HD11 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -147.89 -157.19 0.79 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 126.526 1.931 . . . . 0.0 107.386 179.134 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.44 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.5 OUTLIER -128.27 179.27 5.71 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 178.209 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.957 HG11 ' CD1' ' A' ' 89' ' ' TRP . 4.1 t -118.97 115.58 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.8 1 O-C-N 129.714 4.384 . . . . 0.0 109.96 -179.206 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.72 -24.34 22.06 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 116.448 -2.787 . . . . 0.0 111.561 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 69' ' ' VAL . 20.8 t -92.48 89.69 2.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 112.587 -1.806 . . . . 0.0 109.378 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.434 ' CG ' HD12 ' A' ' 86' ' ' LEU . 1.4 tm-20 -37.28 102.71 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.761 1 O-C-N 129.879 4.487 . . . . 0.0 113.137 179.472 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.404 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.1 OUTLIER -70.44 86.95 0.63 Allowed 'General case' 0 C--N 1.355 0.828 0 O-C-N 126.045 2.091 . . . . 0.0 111.432 -179.879 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -48.04 85.3 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.51 0 CA-C-N 112.153 -2.294 . . . . 0.0 116.193 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.403 ' CD ' ' HB2' ' A' ' 82' ' ' ASN . 9.8 mt-10 57.84 -165.76 0.16 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 120.827 1.649 . . . . 0.0 108.824 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 92.08 112.83 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.963 0 CA-C-N 110.251 -3.159 . . . . 0.0 110.48 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.418 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 71.4 p -134.11 -105.81 0.23 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 110.921 -2.854 . . . . 0.0 113.462 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 58.56 162.89 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 126.235 2.922 . . . . 0.0 114.613 -179.694 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 64.23 19.95 64.6 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-N 108.582 -3.917 . . . . 0.0 107.713 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.541 ' O ' HD11 ' A' ' 24' ' ' LEU . 9.9 tp -159.15 -52.75 0.06 Allowed 'General case' 0 N--CA 1.475 0.796 0 O-C-N 127.485 2.52 . . . . 0.0 114.826 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.542 ' CB ' HD13 ' A' ' 24' ' ' LEU . 38.7 t0 -125.13 -66.23 0.97 Allowed 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 125.679 2.657 . . . . 0.0 110.421 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.35 74.07 1.21 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.665 2.079 . . . . 0.0 116.608 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -150.65 -130.97 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 112.045 -2.078 . . . . 0.0 113.672 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.403 ' HB2' ' CD ' ' A' ' 73' ' ' GLU . 1.4 p-10 -169.4 115.67 0.58 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.659 1.118 . . . . 0.0 108.843 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.571 HG11 ' OE1' ' A' ' 98' ' ' GLN . 75.6 t -138.09 149.61 24.74 Favored 'Isoleucine or valine' 0 C--N 1.365 1.254 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -179.071 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -63.39 103.86 0.56 Allowed 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 112.281 -2.236 . . . . 0.0 106.877 178.7 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.404 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 14.4 m -115.95 78.47 1.19 Allowed 'General case' 0 C--O 1.208 -1.131 0 O-C-N 126.994 2.684 . . . . 0.0 111.557 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 2.5 tp -86.6 148.95 25.26 Favored 'General case' 0 C--O 1.209 -1.072 1 CA-C-N 106.572 -4.831 . . . . 0.0 109.647 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.607 HG22 ' HB2' ' A' ' 96' ' ' CYS . 49.7 t -135.82 147.33 28.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 125.826 1.651 . . . . 0.0 107.602 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.487 ' O ' HG23 ' A' ' 88' ' ' THR . 8.7 t -167.71 126.96 1.31 Allowed 'General case' 0 CA--C 1.474 -1.979 0 CA-C-O 127.561 3.553 . . . . 0.0 111.934 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.957 ' CD1' HG11 ' A' ' 67' ' ' VAL . 21.2 m95 -64.09 144.38 57.15 Favored 'General case' 0 C--N 1.346 0.454 0 O-C-N 116.877 -3.639 . . . . 0.0 102.792 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.7 OUTLIER -104.33 -3.48 24.12 Favored 'General case' 0 CA--C 1.471 -2.087 1 CA-C-O 131.673 5.511 . . . . 0.0 118.689 -177.83 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 116.08 -13.51 16.7 Favored Glycine 0 C--O 1.198 -2.126 1 N-CA-C 102.883 -4.087 . . . . 0.0 102.883 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.473 ' O ' ' HB ' ' A' ' 93' ' ' THR . 1.1 p-10 179.33 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.609 1 O-C-N 131.325 4.78 . . . . 0.0 111.891 -179.979 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.645 HG23 ' CG2' ' A' ' 95' ' ' VAL 0.315 12.6 t 161.49 130.26 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 128.093 2.557 . . . . 0.0 116.386 179.448 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.576 ' N ' ' CZ3' ' A' ' 89' ' ' TRP . 6.4 tp -52.48 -38.16 58.83 Favored 'General case' 0 CA--C 1.482 -1.66 0 N-CA-C 118.63 2.826 . . . . 0.0 118.63 -177.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.645 ' CG2' HG23 ' A' ' 93' ' ' THR . 18.1 t 28.7 120.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.285 0 N-CA-C 120.63 3.567 . . . . 0.0 120.63 -178.082 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.607 ' HB2' HG22 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -139.52 137.79 35.77 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 103.416 -2.809 . . . . 0.0 103.416 179.314 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.41 ' O ' ' N ' ' A' ' 99' ' ' LYS . 3.5 t -119.93 96.57 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 119.439 3.125 . . . . 0.0 119.439 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.571 ' OE1' HG11 ' A' ' 83' ' ' VAL . 5.1 mm-40 -66.0 94.12 0.22 Allowed 'General case' 0 C--N 1.364 1.215 0 CA-C-O 123.992 1.853 . . . . 0.0 106.504 178.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' A' ' 97' ' ' VAL . 3.4 tttp -91.59 -56.19 3.21 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 110.036 -3.257 . . . . 0.0 114.404 -178.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.556 ' O ' HG22 ' A' ' 83' ' ' VAL . . . -49.58 146.13 7.56 Favored Glycine 0 C--O 1.206 -1.612 0 CA-C-O 124.426 2.125 . . . . 0.0 112.599 -179.217 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 69.98 165.79 0.28 Allowed 'General case' 0 CA--C 1.498 -1.046 1 CA-C-N 107.808 -4.196 . . . . 0.0 108.865 179.8 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.43 ' HD2' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -43.57 -48.68 7.56 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.468 2.307 . . . . 0.0 113.09 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.43 ' N ' ' HD2' ' A' ' 102' ' ' LYS . 3.3 mm-40 -42.27 147.72 0.24 Allowed 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 109.964 -3.289 . . . . 0.0 116.147 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.411 ' O ' ' HB ' ' A' ' 121' ' ' THR . 2.8 m120 -125.15 71.4 1.19 Allowed 'General case' 0 N--CA 1.492 1.632 1 CA-C-N 106.451 -4.886 . . . . 0.0 101.971 179.573 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 28.8 mmm-85 -88.65 1.85 54.3 Favored 'General case' 0 C--O 1.204 -1.326 1 O-C-N 131.749 5.656 . . . . 0.0 114.045 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.412 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.65 98.43 0.01 OUTLIER Glycine 0 N--CA 1.43 -1.764 2 O-C-N 134.256 7.222 . . . . 0.0 116.596 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.609 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.283 0.0 OUTLIER -108.89 126.92 53.58 Favored 'General case' 0 C--O 1.214 -0.764 1 O-C-N 131.074 4.632 . . . . 0.0 109.068 178.725 . . . . . . . . 5 4 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.543 ' HG3' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -162.48 178.57 8.49 Favored 'General case' 0 C--O 1.209 -1.055 1 O-C-N 130.877 5.111 . . . . 0.0 112.81 -179.074 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.589 HE22 ' HG ' ' A' ' 118' ' ' LEU 0.286 0.0 OUTLIER -133.28 -177.22 4.42 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 112.985 -3.388 . . . . 0.0 107.644 -179.825 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.543 ' CZ3' ' HG3' ' A' ' 108' ' ' LYS . 0.6 OUTLIER 174.93 92.66 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.416 1 O-C-N 131.445 5.466 . . . . 0.0 118.183 178.221 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.405 ' CG2' ' HA ' ' A' ' 4' ' ' ASP 0.277 77.5 t -31.64 100.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.783 0 O-C-N 119.134 -2.229 . . . . 0.0 115.774 179.714 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.546 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -101.41 4.05 41.03 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 112.348 -2.205 . . . . 0.0 116.617 -179.595 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 151.0 -94.08 0.15 Allowed Glycine 0 N--CA 1.435 -1.368 0 O-C-N 120.767 -1.208 . . . . 0.0 113.789 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -118.62 24.66 10.76 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 117.692 2.479 . . . . 0.0 117.692 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.429 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -172.79 153.38 2.68 Favored 'General case' 0 CA--C 1.508 -0.654 1 O-C-N 129.931 4.519 . . . . 0.0 110.477 -179.792 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.778 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 2.3 mt -96.26 112.53 24.24 Favored 'General case' 0 C--O 1.199 -1.565 1 O-C-N 129.386 4.179 . . . . 0.0 114.667 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.546 ' CD1' ' HB2' ' A' ' 112' ' ' GLU . 17.6 m-85 -74.0 98.11 2.99 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 114.596 -2.842 . . . . 0.0 115.661 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.589 ' HG ' HE22 ' A' ' 109' ' ' GLN . 0.2 OUTLIER -80.27 79.14 6.89 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 128.73 3.769 . . . . 0.0 108.047 179.786 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -93.88 122.34 36.28 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 125.373 1.671 . . . . 0.0 109.783 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.444 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -134.03 150.47 51.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 126.363 2.29 . . . . 0.0 109.025 179.856 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.439 HG23 HG22 ' A' ' 126' ' ' VAL . 2.5 m -106.24 168.04 9.41 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.472 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -162.72 41.91 0.12 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 125.991 2.805 . . . . 0.0 115.618 -179.704 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 76.06 70.62 1.25 Allowed Glycine 0 C--O 1.218 -0.876 0 CA-C-N 109.547 -3.478 . . . . 0.0 111.731 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 102.72 -50.01 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.977 0 C-N-CA 129.088 2.955 . . . . 0.0 110.672 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.502 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 3.3 mm-40 -73.64 143.38 46.32 Favored 'General case' 0 C--O 1.217 -0.657 1 O-C-N 129.197 4.061 . . . . 0.0 108.562 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.439 HG22 HG23 ' A' ' 121' ' ' THR . 94.9 t -124.81 87.02 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 O-C-N 128.114 3.384 . . . . 0.0 112.523 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.9 t -56.83 143.46 37.05 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.416 ' HB3' ' HB3' ' A' ' 15' ' ' GLU . 4.8 ttp180 -127.51 135.68 50.7 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 128.495 3.622 . . . . 0.0 110.467 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -124.42 135.56 53.36 Favored 'General case' 0 N--CA 1.481 1.122 1 O-C-N 129.157 4.036 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.452 ' O ' HG12 ' A' ' 130' ' ' VAL . 54.1 t -127.99 74.74 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.202 -1.445 0 N-CA-C 102.996 -2.965 . . . . 0.0 102.996 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 2.5 m-85 -54.86 -176.34 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.807 2 CA-C-N 104.677 -5.692 . . . . 0.0 111.52 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -164.16 107.71 0.95 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 114.846 -2.502 . . . . 0.0 105.271 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.583 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -51.99 129.55 27.44 Favored 'General case' 0 N--CA 1.475 0.795 1 O-C-N 130.536 4.897 . . . . 0.0 108.682 178.521 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.423 ' HD3' ' HB ' ' A' ' 8' ' ' THR . 1.2 pttt . . . . . 0 CA--C 1.504 -0.819 0 N-CA-C 118.075 2.62 . . . . 0.0 118.075 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.424 ' HB2' ' HB2' ' A' ' 4' ' ' ASP . 0.5 OUTLIER . . . . . 0 N--CA 1.503 2.221 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -71.65 -42.79 67.11 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 117.291 -1.337 . . . . 0.0 111.559 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.486 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 0.0 OUTLIER -92.9 -13.72 28.57 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 127.184 2.802 . . . . 0.0 117.455 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.455 ' HA ' ' NE2' ' A' ' 45' ' ' GLN . 1.4 m-20 -77.09 132.19 38.75 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -154.3 66.4 0.7 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 116.938 -1.905 . . . . 0.0 107.62 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -44.31 146.3 0.69 Allowed 'General case' 0 N--CA 1.44 -0.959 1 O-C-N 129.96 4.538 . . . . 0.0 111.579 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.38 -169.81 33.87 Favored Glycine 0 C--O 1.207 -1.536 0 C-N-CA 117.546 -2.264 . . . . 0.0 111.993 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.474 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -127.64 147.98 50.37 Favored 'General case' 0 C--O 1.203 -1.381 1 O-C-N 131.954 5.149 . . . . 0.0 104.515 179.704 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.518 ' CZ3' ' HG3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.05 105.92 3.99 Favored 'General case' 0 C--N 1.32 -0.717 0 O-C-N 128.499 3.624 . . . . 0.0 116.705 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' N ' ' A' ' 12' ' ' GLU . 3.1 mt-10 -78.75 107.96 11.83 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 127.258 2.849 . . . . 0.0 108.997 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.428 ' HB3' ' HG2' ' A' ' 39' ' ' GLN 0.273 5.8 ttp -64.08 85.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 103.507 -2.775 . . . . 0.0 103.507 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 10' ' ' GLU . 36.8 tt0 -45.24 -30.28 1.19 Allowed 'General case' 0 C--N 1.312 -1.042 1 O-C-N 130.988 5.18 . . . . 0.0 112.006 -179.955 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.1 m -144.7 149.53 35.78 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 113.377 -1.738 . . . . 0.0 111.447 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.421 ' ND2' ' CE ' ' A' ' 11' ' ' MET . 5.9 t-20 -128.59 110.18 12.02 Favored 'General case' 0 C--O 1.206 -1.236 1 O-C-N 129.503 4.252 . . . . 0.0 112.665 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -110.97 125.31 53.57 Favored 'General case' 0 CA--C 1.496 -1.103 1 O-C-N 131.348 5.405 . . . . 0.0 113.717 179.446 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 57.66 85.97 0.08 Allowed 'General case' 0 C--O 1.209 -1.07 0 CA-C-O 122.277 1.037 . . . . 0.0 109.393 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.678 ' CE2' HG22 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -105.4 -29.36 10.29 Favored 'General case' 0 CA--C 1.487 -1.449 0 CA-C-O 124.944 2.307 . . . . 0.0 109.148 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.451 ' HG3' ' HB3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -78.7 -48.68 14.5 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 114.982 -2.437 . . . . 0.0 110.601 179.154 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -59.58 -20.88 53.29 Favored Glycine 0 N--CA 1.475 1.241 0 O-C-N 128.43 3.581 . . . . 0.0 111.214 178.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.44 -38.69 48.95 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-O 127.434 3.492 . . . . 0.0 105.611 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.451 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -69.12 -36.3 77.35 Favored 'General case' 0 C--O 1.214 -0.789 0 CA-C-N 111.194 -2.73 . . . . 0.0 109.617 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.82 -22.57 60.78 Favored 'General case' 0 C--O 1.207 -1.164 1 O-C-N 134.03 7.081 . . . . 0.0 114.617 -179.328 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.14 -27.65 61.79 Favored 'General case' 0 N--CA 1.477 0.924 2 O-C-N 132.082 5.864 . . . . 0.0 109.11 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.729 HD12 ' HB ' ' A' ' 26' ' ' ILE . 0.6 OUTLIER -122.95 25.53 8.54 Favored 'General case' 0 CA--C 1.542 0.651 1 O-C-N 130.362 4.789 . . . . 0.0 105.484 179.775 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.402 ' C ' ' N ' ' A' ' 27' ' ' ASP . 1.6 m-20 57.72 -73.72 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.646 0 C-N-CA 130.826 3.65 . . . . 0.0 111.786 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.729 ' HB ' HD12 ' A' ' 24' ' ' LEU . 4.5 tt 28.54 49.8 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.046 3 CA-C-O 130.333 4.873 . . . . 0.0 106.84 179.557 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -67.87 62.41 0.08 Allowed 'General case' 0 N--CA 1.49 1.552 1 CA-C-N 107.992 -4.186 . . . . 0.0 113.844 -177.454 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.488 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 2.8 m-30 -106.72 -43.14 4.77 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 118.153 2.649 . . . . 0.0 118.153 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' A' ' 28' ' ' PHE . . . 158.36 155.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 104.328 -2.471 . . . . 0.0 104.328 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.769 HG23 ' O ' ' A' ' 34' ' ' ALA . 2.4 m 154.04 -50.26 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.099 1 O-C-N 131.148 5.28 . . . . 0.0 110.392 -178.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -50.36 -32.66 17.97 Favored 'General case' 0 N--CA 1.472 0.632 1 O-C-N 132.597 6.186 . . . . 0.0 106.288 179.234 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.48 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.6 OUTLIER -82.89 -45.69 13.9 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 127.807 3.192 . . . . 0.0 106.493 178.366 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.547 HD13 ' HA ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -172.76 97.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.383 0 CA-C-O 128.245 3.878 . . . . 0.0 115.948 177.305 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.769 ' O ' HG23 ' A' ' 30' ' ' THR . . . 169.25 46.25 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.543 0 CA-C-O 127.697 3.618 . . . . 0.0 107.732 175.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.678 HG22 ' CE2' ' A' ' 17' ' ' PHE . 58.6 t -62.03 -25.93 38.68 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.622 1 CA-C-N 106.932 -4.667 . . . . 0.0 108.282 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.537 ' C ' HD12 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 174.84 -80.83 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.868 1 CA-C-N 107.917 -4.22 . . . . 0.0 108.421 177.133 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.75 HD23 ' CD1' ' A' ' 58' ' ' PHE . 0.0 OUTLIER 123.1 2.09 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.035 1 O-C-N 132.613 6.196 . . . . 0.0 110.977 178.3 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.462 ' N ' HD13 ' A' ' 37' ' ' LEU . 1.3 m 157.85 -70.34 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.309 1 O-C-N 129.871 4.482 . . . . 0.0 112.675 179.359 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.497 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 0.5 OUTLIER 57.56 101.14 0.02 OUTLIER 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -121.44 75.22 1.16 Allowed 'General case' 0 C--O 1.2 -1.539 1 O-C-N 131.44 5.462 . . . . 0.0 109.712 179.122 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.411 ' HD3' ' C ' ' A' ' 41' ' ' LYS . 0.1 OUTLIER -56.82 138.0 54.02 Favored 'General case' 0 N--CA 1.49 1.564 1 O-C-N 132.373 6.046 . . . . 0.0 106.823 -179.646 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.531 ' HB ' ' HD3' ' A' ' 53' ' ' LYS . 5.3 mt -136.46 109.1 8.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 O-C-N 127.509 3.005 . . . . 0.0 111.901 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.499 HD11 ' HB2' ' A' ' 45' ' ' GLN 0.262 0.3 OUTLIER -83.97 118.62 31.65 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.672 1 CA-C-N 106.922 -4.672 . . . . 0.0 110.157 -179.432 . . . . . . . . 5 4 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 45' ' ' GLN . 0.9 OUTLIER -95.84 -40.77 11.19 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.485 0 CA-C-N 112.047 -2.342 . . . . 0.0 112.939 -179.143 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.499 ' HB2' HD11 ' A' ' 43' ' ' ILE . 47.3 tt0 18.4 102.7 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.523 0 O-C-N 127.936 3.272 . . . . 0.0 117.617 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -118.86 23.95 11.13 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-N 111.124 -2.762 . . . . 0.0 117.017 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.31 106.01 2.24 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-O 116.601 -2.222 . . . . 0.0 109.904 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 68.37 -68.13 0.18 Allowed 'General case' 0 C--O 1.211 -0.962 0 O-C-N 128.509 3.123 . . . . 0.0 109.454 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -71.63 99.29 2.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 112.833 -3.461 . . . . 0.0 107.58 178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.489 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 2.3 t80 -122.55 102.88 8.33 Favored 'General case' 0 CA--C 1.484 -1.576 1 O-C-N 130.444 4.84 . . . . 0.0 113.509 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 93.03 3.95 Favored 'General case' 0 C--O 1.194 -1.835 0 O-C-N 128.375 3.547 . . . . 0.0 115.198 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 62' ' ' ASP . 0.3 OUTLIER -69.21 155.19 40.81 Favored 'General case' 0 CA--C 1.499 -0.984 0 O-C-N 127.248 2.842 . . . . 0.0 107.322 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HD3' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -168.58 143.46 3.36 Favored 'General case' 0 CA--C 1.485 -1.52 0 C-N-CA 115.843 -2.343 . . . . 0.0 112.551 -179.712 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.7 t -90.1 175.06 7.3 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 112.905 -1.952 . . . . 0.0 108.218 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.85 23.58 2.62 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.657 ' CB ' HD11 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -36.48 -64.88 0.31 Allowed 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.572 5.545 . . . . 0.0 110.187 179.969 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.414 ' HB ' ' O ' ' A' ' 56' ' ' SER . 1.4 t 118.62 -36.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 O-C-N 130.076 4.61 . . . . 0.0 103.02 -179.747 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.75 ' CD1' HD23 ' A' ' 37' ' ' LEU . 2.2 m-85 -58.55 -64.83 0.79 Allowed 'General case' 0 C--O 1.241 0.632 0 O-C-N 126.849 2.593 . . . . 0.0 110.987 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.79 106.76 4.14 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 127.788 3.18 . . . . 0.0 110.291 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -99.4 64.92 1.36 Allowed 'General case' 0 C--O 1.21 -0.992 1 O-C-N 129.286 4.116 . . . . 0.0 107.508 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.76 77.89 1.74 Allowed 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 128.957 3.911 . . . . 0.0 108.692 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB3' HG22 ' A' ' 52' ' ' THR . 0.2 OUTLIER -101.83 -65.73 0.96 Allowed 'General case' 0 C--O 1.204 -1.331 0 O-C-N 126.632 2.457 . . . . 0.0 114.232 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.5 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 0.5 OUTLIER -149.41 103.86 3.33 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.916 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.442 ' C ' ' CD1' ' A' ' 65' ' ' PHE . 8.2 p-10 -126.23 70.76 1.24 Allowed 'General case' 0 CA--C 1.499 -1.018 0 C-N-CA 118.158 -1.417 . . . . 0.0 110.597 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.5 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -134.84 160.83 36.97 Favored 'General case' 0 C--N 1.353 0.743 1 CA-C-O 129.205 4.336 . . . . 0.0 111.02 179.842 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.429 HG22 HG23 ' A' ' 69' ' ' VAL . 1.2 m -107.77 102.44 11.66 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 109.454 -3.521 . . . . 0.0 102.862 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.525 HG11 ' CD1' ' A' ' 89' ' ' TRP . 14.1 t -33.52 129.39 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.489 -1.379 1 O-C-N 129.568 4.293 . . . . 0.0 115.97 -179.258 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.61 -18.39 56.58 Favored Glycine 0 N--CA 1.481 1.638 0 CA-C-N 111.517 -2.583 . . . . 0.0 112.968 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 69' ' ' VAL . 97.2 t -88.38 79.03 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 119.136 -1.025 . . . . 0.0 109.486 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.777 ' HG3' HD12 ' A' ' 86' ' ' LEU . 4.8 tt0 -38.04 105.45 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.501 2 O-C-N 132.871 6.357 . . . . 0.0 110.611 179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.491 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -64.86 92.5 0.1 Allowed 'General case' 0 CA--C 1.51 -0.569 0 O-C-N 129.043 3.964 . . . . 0.0 114.314 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -58.22 70.77 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 0 O-C-N 126.656 2.473 . . . . 0.0 113.125 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.598 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 13.9 mt-10 54.51 -165.79 0.09 Allowed 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 123.274 1.511 . . . . 0.0 110.688 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 72.84 86.31 0.11 Allowed 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 110.307 -3.133 . . . . 0.0 114.513 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.455 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 14.4 p -94.98 -70.88 0.69 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.4 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.455 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 43.54 140.62 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.954 2 O-C-N 130.218 4.699 . . . . 0.0 116.781 179.666 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.02 -15.77 61.1 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.644 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.497 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 8.2 tp -153.1 53.24 0.75 Allowed 'General case' 0 C--N 1.347 0.459 0 O-C-N 128.994 3.408 . . . . 0.0 116.028 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.5 t0 141.63 -67.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 O-C-N 128.568 3.667 . . . . 0.0 110.22 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.05 82.6 0.32 Allowed Glycine 0 C--O 1.213 -1.185 0 CA-C-N 110.073 -3.239 . . . . 0.0 110.557 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.97 -125.36 0.14 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 108.512 -3.844 . . . . 0.0 113.803 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER 178.68 93.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 120.455 1.48 . . . . 0.0 107.476 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.46 HG13 ' N ' ' A' ' 99' ' ' LYS . 68.0 t -128.88 151.6 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 O-C-N 127.8 3.187 . . . . 0.0 118.445 -178.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.492 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.3 OUTLIER -78.24 95.65 5.04 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.064 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.491 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 76.7 m -99.84 81.74 2.49 Favored 'General case' 0 C--O 1.202 -1.439 0 CA-C-N 109.41 -3.541 . . . . 0.0 116.566 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.777 HD12 ' HG3' ' A' ' 70' ' ' GLU . 0.6 OUTLIER -82.12 141.93 32.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 108.684 -3.871 . . . . 0.0 113.437 179.853 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.426 HG21 ' CD2' ' A' ' 65' ' ' PHE . 39.1 t -131.02 131.37 64.07 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 125.699 1.6 . . . . 0.0 108.673 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.441 HG22 ' N ' ' A' ' 89' ' ' TRP 0.261 99.2 m -156.42 170.73 21.64 Favored 'General case' 0 CA--C 1.476 -1.89 0 CA-C-N 113.02 -1.9 . . . . 0.0 111.412 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.68 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 31.1 m95 -100.37 143.54 30.43 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 129.134 2.973 . . . . 0.0 106.61 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.538 ' CG ' HG21 ' A' ' 95' ' ' VAL . 0.9 OUTLIER -99.07 -12.49 20.49 Favored 'General case' 0 CA--C 1.477 -1.852 0 CA-C-O 127.237 3.399 . . . . 0.0 113.286 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 128.31 -29.61 4.04 Favored Glycine 0 C--O 1.196 -2.264 0 CA-C-N 109.961 -3.29 . . . . 0.0 105.226 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -150.11 24.15 0.83 Allowed 'General case' 0 N--CA 1.434 -1.257 1 O-C-N 130.041 4.024 . . . . 0.0 111.841 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.507 HG22 ' CB ' ' A' ' 90' ' ' GLU . 5.3 t -174.01 163.48 4.01 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.562 2.43 . . . . 0.0 117.562 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.436 ' N ' ' OG1' ' A' ' 93' ' ' THR . 1.1 tp -92.99 98.41 11.33 Favored 'General case' 0 C--O 1.209 -1.046 0 CA-C-O 125.332 2.491 . . . . 0.0 114.343 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.538 HG21 ' CG ' ' A' ' 90' ' ' GLU 0.271 90.6 t -100.0 112.2 31.83 Favored 'Isoleucine or valine' 0 C--N 1.363 1.159 0 CA-C-N 110.406 -3.088 . . . . 0.0 112.623 179.672 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.416 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -139.42 150.04 44.78 Favored 'General case' 0 C--O 1.196 -1.726 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.36 139.48 43.66 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 128.102 3.376 . . . . 0.0 114.489 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.524 ' CD ' ' HB3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -111.07 107.69 17.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.328 1.851 . . . . 0.0 107.266 179.065 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.46 ' N ' HG13 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.69 98.92 3.5 Favored 'General case' 0 C--O 1.201 -1.464 0 C-N-CA 115.203 -2.599 . . . . 0.0 112.797 -179.329 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -165.92 57.36 0.25 Allowed Glycine 0 C--O 1.212 -1.239 0 CA-C-O 124.428 2.127 . . . . 0.0 111.95 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 62.3 145.65 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.188 1 CA-C-N 106.365 -4.918 . . . . 0.0 113.916 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.406 ' HD3' ' C ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER 99.17 -49.71 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 110.94 -2.846 . . . . 0.0 116.348 179.357 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -156.11 -177.87 6.9 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 108.46 -3.973 . . . . 0.0 114.899 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -128.22 88.63 2.78 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 113.633 -3.079 . . . . 0.0 104.107 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.651 ' NH1' HD22 ' A' ' 24' ' ' LEU . 10.3 mmm-85 -68.59 -9.27 48.6 Favored 'General case' 0 C--O 1.201 -1.468 1 O-C-N 130.508 4.88 . . . . 0.0 113.345 179.419 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.435 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -33.43 114.85 0.11 Allowed Glycine 0 C--N 1.352 1.441 1 O-C-N 130.483 4.864 . . . . 0.0 116.983 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.416 ' CZ2' ' SG ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -123.1 142.34 50.99 Favored 'General case' 0 C--N 1.32 -0.693 1 O-C-N 132.051 5.207 . . . . 0.0 109.878 178.738 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -165.27 170.85 14.29 Favored 'General case' 0 CA--C 1.505 -0.786 1 O-C-N 129.442 4.214 . . . . 0.0 112.697 -179.292 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.453 ' C ' ' CG ' ' A' ' 110' ' ' TRP . 3.9 mp0 -132.71 -178.35 4.9 Favored 'General case' 0 C--N 1.365 1.265 0 C-N-CA 115.989 -2.284 . . . . 0.0 108.616 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.453 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.0 OUTLIER -159.67 15.75 0.15 Allowed 'General case' 0 CA--C 1.501 -0.925 1 O-C-N 129.279 4.112 . . . . 0.0 118.063 -179.823 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.3 t 39.87 71.13 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.628 0 CA-C-O 125.821 2.724 . . . . 0.0 115.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.439 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 2.8 mm-40 -97.02 84.8 3.6 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-O 125.924 2.773 . . . . 0.0 117.308 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.58 87.79 0.01 OUTLIER Glycine 0 C--O 1.197 -2.206 0 O-C-N 119.048 -2.283 . . . . 0.0 117.347 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 41.16 51.79 3.44 Favored 'General case' 0 CA--C 1.501 -0.936 0 C-N-CA 128.576 2.75 . . . . 0.0 118.39 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 6.4 pttt 177.14 146.12 0.1 Allowed 'General case' 0 C--N 1.32 -0.713 0 O-C-N 129.057 3.973 . . . . 0.0 109.982 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.406 HD13 ' CH2' ' A' ' 9' ' ' TRP . 4.9 mp -105.3 104.56 14.32 Favored 'General case' 0 C--O 1.199 -1.563 0 O-C-N 128.308 3.505 . . . . 0.0 118.605 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.479 ' HE1' HG13 ' A' ' 130' ' ' VAL . 6.8 m-30 -70.2 93.27 0.82 Allowed 'General case' 0 C--O 1.203 -1.369 0 O-C-N 127.988 3.305 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.811 HD12 ' CZ ' ' A' ' 131' ' ' PHE . 1.2 mt -82.73 69.4 9.51 Favored 'General case' 0 C--N 1.346 0.449 1 CA-C-N 108.356 -4.02 . . . . 0.0 107.338 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -73.88 111.01 8.62 Favored 'General case' 0 CA--C 1.501 -0.938 1 O-C-N 129.316 4.135 . . . . 0.0 110.26 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.44 160.13 23.73 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 126.821 2.576 . . . . 0.0 113.46 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.23 160.4 36.25 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 127.006 2.691 . . . . 0.0 105.175 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.429 ' HB3' ' CD ' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -163.95 70.57 0.21 Allowed 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 125.197 2.427 . . . . 0.0 110.952 -179.647 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.2 -57.59 0.44 Allowed Glycine 0 CA--C 1.525 0.708 0 CA-C-N 111.76 -2.473 . . . . 0.0 108.769 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.8 t0 166.8 53.05 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 125.933 1.693 . . . . 0.0 106.549 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -119.8 10.23 11.57 Favored 'General case' 0 N--CA 1.475 0.776 1 O-C-N 129.259 4.099 . . . . 0.0 109.06 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.533 HG13 ' O ' ' A' ' 126' ' ' VAL . 12.6 p 4.39 72.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.967 1 O-C-N 130.082 4.614 . . . . 0.0 116.761 179.914 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 64.1 m -64.33 133.44 52.67 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 119.744 -1.847 . . . . 0.0 112.019 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.28 93.32 4.43 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 128.241 3.463 . . . . 0.0 113.701 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -84.54 157.07 21.38 Favored 'General case' 0 CA--C 1.499 -1.001 0 C-N-CA 116.12 -2.232 . . . . 0.0 115.311 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.479 HG13 ' HE1' ' A' ' 117' ' ' TYR . 74.3 t -140.43 123.54 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 126.482 3.039 . . . . 0.0 106.958 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.811 ' CZ ' HD12 ' A' ' 118' ' ' LEU . 4.3 m-85 -100.74 -177.75 3.57 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 110.226 -3.17 . . . . 0.0 115.82 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.464 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.257 0.0 OUTLIER -157.89 124.29 4.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 110.751 -2.931 . . . . 0.0 103.885 179.895 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.518 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 30.6 tttt -75.66 113.77 13.48 Favored 'General case' 0 C--O 1.198 -1.643 1 O-C-N 129.147 4.029 . . . . 0.0 112.406 179.609 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt . . . . . 0 CA--C 1.498 -1.039 0 N-CA-C 116.547 2.055 . . . . 0.0 116.547 -179.968 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.5 mmm . . . . . 0 N--CA 1.498 1.928 0 N-CA-C 105.844 -1.91 . . . . 0.0 105.844 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.69 -50.84 3.45 Favored 'General case' 0 C--O 1.202 -1.433 0 O-C-N 125.303 1.627 . . . . 0.0 109.453 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 89' ' ' TRP . 9.4 mttm -93.37 -137.17 0.19 Allowed 'General case' 0 CA--C 1.504 -0.822 0 C-N-CA 118.331 -1.348 . . . . 0.0 113.96 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.752 ' HA ' HG21 ' A' ' 111' ' ' VAL . 83.8 m-20 -80.52 -97.32 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 102.704 -3.073 . . . . 0.0 102.704 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -175.28 -94.18 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 113.506 -3.14 . . . . 0.0 107.692 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 158.25 112.83 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.018 1 O-C-N 130.116 4.635 . . . . 0.0 111.771 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 177.65 -141.17 5.1 Favored Glycine 0 C--O 1.209 -1.456 0 CA-C-O 117.057 -1.968 . . . . 0.0 114.967 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.728 HG23 ' CG1' ' A' ' 42' ' ' ILE . 63.2 m -147.31 148.86 31.83 Favored 'General case' 0 C--O 1.215 -0.715 1 O-C-N 130.193 4.114 . . . . 0.0 104.003 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.536 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.258 0.0 OUTLIER -139.26 118.06 12.38 Favored 'General case' 0 CA--C 1.508 -0.65 1 O-C-N 130.128 4.642 . . . . 0.0 111.594 -179.112 . . . . . . . . 5 4 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.94 -6.29 32.0 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 126.891 2.62 . . . . 0.0 115.581 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.421 ' O ' ' HA ' ' A' ' 131' ' ' PHE . 1.9 ttm 83.56 -79.91 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 112.857 -3.449 . . . . 0.0 107.219 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 11' ' ' MET . 0.5 OUTLIER 123.8 -28.23 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.069 0 O-C-N 128.875 3.859 . . . . 0.0 106.62 -179.236 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.288 3.1 p 164.18 160.97 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 110.872 -2.876 . . . . 0.0 110.182 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -121.67 136.23 54.95 Favored 'General case' 0 CA--C 1.486 -1.514 0 O-C-N 128.55 3.656 . . . . 0.0 115.96 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -87.45 -137.38 0.09 Allowed 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 110.902 -2.863 . . . . 0.0 111.279 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -41.34 95.81 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.186 0 C-N-CA 124.37 1.068 . . . . 0.0 113.077 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -111.07 -36.92 5.5 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-O 126.646 3.117 . . . . 0.0 110.454 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.47 ' HG3' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.04 -29.39 60.77 Favored 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 119.758 -1.838 . . . . 0.0 115.455 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.47 ' N ' ' HG3' ' A' ' 18' ' ' GLU . . . -78.29 -23.78 64.89 Favored Glycine 0 N--CA 1.485 1.909 0 O-C-N 127.723 3.14 . . . . 0.0 109.194 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -71.79 -20.37 61.87 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 123.747 1.737 . . . . 0.0 107.966 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.503 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -78.52 -34.68 47.08 Favored 'General case' 0 CA--C 1.488 -1.417 0 C-N-CA 116.705 -1.998 . . . . 0.0 109.237 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' HD3' ' HB3' ' A' ' 28' ' ' PHE . 2.7 mtmt -71.61 -27.74 63.32 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-N 109.668 -3.424 . . . . 0.0 115.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.661 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -66.87 -31.64 72.38 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 108.764 -3.835 . . . . 0.0 111.369 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.746 HD23 ' N ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -93.36 -24.61 18.04 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 128.462 3.601 . . . . 0.0 107.579 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t0 65.7 74.88 0.36 Allowed 'General case' 0 C--O 1.2 -1.534 1 O-C-N 129.4 4.188 . . . . 0.0 105.38 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.722 HD12 HD12 ' A' ' 78' ' ' LEU . 2.1 tt -104.64 -54.88 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 CA-C-N 109.426 -3.534 . . . . 0.0 115.316 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.432 ' N ' HG23 ' A' ' 26' ' ' ILE . 1.4 t0 -167.2 32.44 0.03 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 115.138 -2.363 . . . . 0.0 113.874 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.418 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -16.99 129.35 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 O-C-N 127.975 3.297 . . . . 0.0 117.916 179.568 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 92.91 66.53 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 127.66 3.1 . . . . 0.0 107.745 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -119.69 -47.5 2.42 Favored 'General case' 0 C--O 1.218 -0.598 2 CA-C-N 105.576 -5.284 . . . . 0.0 112.949 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.51 113.51 0.46 Allowed 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 129.691 4.369 . . . . 0.0 107.805 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttt 179.62 -47.76 0.01 OUTLIER 'General case' 0 CA--C 1.491 -1.319 0 O-C-N 127.892 3.245 . . . . 0.0 110.23 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.702 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.2 OUTLIER -124.11 -11.18 6.54 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.241 0 O-C-N 126.987 2.68 . . . . 0.0 112.894 -179.831 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -101.61 19.09 18.69 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-O 124.071 1.891 . . . . 0.0 112.091 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.4 t -49.27 -37.34 10.36 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.374 0 CA-C-N 109.519 -3.491 . . . . 0.0 109.386 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.766 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -171.38 151.01 2.97 Favored 'General case' 0 C--O 1.21 -0.991 1 CA-C-N 106.42 -4.9 . . . . 0.0 112.123 179.833 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.112 HD11 ' CE1' ' A' ' 58' ' ' PHE . 2.5 pt? 153.99 -19.12 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.991 2 O-C-N 134.88 7.613 . . . . 0.0 106.282 177.026 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.51 ' HA ' ' HB2' ' A' ' 56' ' ' SER . 16.1 m -46.36 -29.46 1.69 Allowed 'General case' 0 N--CA 1.485 1.281 1 O-C-N 132.269 5.981 . . . . 0.0 109.455 175.231 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.557 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.0 OUTLIER 42.57 -171.66 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 118.556 2.798 . . . . 0.0 118.556 179.313 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.557 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 57.5 m -20.13 90.99 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 131.575 3.95 . . . . 0.0 115.522 178.243 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.534 ' HE3' ' CD1' ' A' ' 9' ' ' TRP 0.262 0.0 OUTLIER -75.33 161.28 29.42 Favored 'General case' 0 N--CA 1.492 1.631 1 O-C-N 129.414 4.196 . . . . 0.0 101.889 178.94 . . . . . . . . 5 4 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.728 ' CG1' HG23 ' A' ' 8' ' ' THR . 11.6 mt -137.72 164.34 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.282 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.482 ' N ' HG22 ' A' ' 42' ' ' ILE . 5.8 tt -140.02 150.02 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.485 0 O-C-N 127.489 2.993 . . . . 0.0 108.932 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.3 t -130.62 -46.67 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 C-N-CA 115.014 -2.674 . . . . 0.0 115.973 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.428 ' HB3' ' CD2' ' A' ' 50' ' ' PHE . 2.5 pp0? 32.47 101.53 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 126.052 2.834 . . . . 0.0 115.205 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.18 51.88 1.75 Allowed 'General case' 0 CA--C 1.494 -1.179 0 CA-C-N 110.465 -3.061 . . . . 0.0 114.021 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.06 98.28 0.01 OUTLIER Glycine 0 N--CA 1.475 1.267 0 CA-C-N 115.349 -0.841 . . . . 0.0 115.028 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.518 ' O ' HG23 ' A' ' 67' ' ' VAL . 0.2 OUTLIER 84.16 -60.49 0.11 Allowed 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 127.645 2.615 . . . . 0.0 110.935 -179.649 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.37 124.45 33.4 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 128.541 3.651 . . . . 0.0 107.755 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.654 ' CD1' ' CZ ' ' A' ' 65' ' ' PHE . 3.3 t80 -125.12 138.37 54.17 Favored 'General case' 0 CA--C 1.484 -1.583 1 O-C-N 131.059 5.224 . . . . 0.0 117.796 -178.56 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.408 ' HD3' ' HB3' ' A' ' 64' ' ' ASP . 54.0 mttt -145.15 100.32 3.45 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 178.137 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.577 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -84.52 160.66 20.46 Favored 'General case' 0 N--CA 1.473 0.694 1 O-C-N 129.568 4.292 . . . . 0.0 106.251 177.176 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.551 ' HG2' HD12 ' A' ' 42' ' ' ILE . 20.1 tttt -158.91 137.72 11.1 Favored 'General case' 0 CA--C 1.481 -1.696 0 C-N-CA 114.119 -3.032 . . . . 0.0 112.327 -177.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.569 HG22 ' HB3' ' A' ' 56' ' ' SER . 0.9 OUTLIER -86.94 123.39 32.0 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 110.343 -3.117 . . . . 0.0 108.877 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.436 ' O ' ' NE2' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -102.41 11.59 37.79 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 113.849 -2.977 . . . . 0.0 114.883 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.569 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.6 p -39.6 173.31 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.695 1 O-C-N 133.288 6.617 . . . . 0.0 112.385 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.72 6.08 25.37 Favored 'General case' 0 N--CA 1.48 1.031 1 CA-C-N 107.16 -4.564 . . . . 0.0 102.801 178.886 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 1.112 ' CE1' HD11 ' A' ' 37' ' ' LEU . 2.6 m-30 -121.57 -78.81 0.6 Allowed 'General case' 0 C--N 1.357 0.905 0 O-C-N 126.831 2.582 . . . . 0.0 116.659 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.459 ' NH1' HD22 ' A' ' 78' ' ' LEU . 5.2 mtt180 -106.85 123.55 48.32 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 109.073 -3.694 . . . . 0.0 116.143 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.37 62.35 1.52 Allowed 'General case' 0 C--O 1.198 -1.62 1 O-C-N 129.76 4.412 . . . . 0.0 105.792 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -95.75 16.29 17.87 Favored 'General case' 0 N--CA 1.448 -0.553 2 O-C-N 131.458 5.474 . . . . 0.0 111.271 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 1.89 126.42 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.131 1 O-C-N 133.076 6.485 . . . . 0.0 117.156 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.806 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 4.2 tp -78.17 61.81 2.76 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.751 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.408 ' HB3' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -101.37 101.12 11.7 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 126.354 2.284 . . . . 0.0 111.112 -179.788 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.785 ' CD2' HG21 ' A' ' 87' ' ' VAL . 17.2 p90 -133.29 -152.38 0.49 Allowed 'General case' 0 CA--C 1.486 -1.5 0 CA-C-O 124.991 2.329 . . . . 0.0 107.527 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.625 HG22 ' HB ' ' A' ' 69' ' ' VAL . 0.9 OUTLIER -159.08 141.47 13.95 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 118.408 -2.683 . . . . 0.0 104.582 -179.759 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.838 HG11 ' CD1' ' A' ' 89' ' ' TRP . 2.5 t -65.25 131.24 31.05 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.836 0 O-C-N 128.771 3.794 . . . . 0.0 115.823 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 61.92 24.73 65.09 Favored Glycine 0 N--CA 1.474 1.18 0 CA-C-N 112.188 -2.278 . . . . 0.0 116.398 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.625 ' HB ' HG22 ' A' ' 66' ' ' THR 0.316 1.8 p -93.77 -16.5 7.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 O-C-N 126.013 1.655 . . . . 0.0 110.918 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 72.88 107.37 0.07 Allowed 'General case' 0 C--N 1.355 0.814 1 O-C-N 129.405 4.19 . . . . 0.0 108.195 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.595 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.7 t80 -97.71 31.63 2.56 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 128.11 3.382 . . . . 0.0 113.649 -178.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -16.8 103.08 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.3 0 C-N-CA 127.245 2.218 . . . . 0.0 116.416 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.409 ' HG3' ' CB ' ' A' ' 82' ' ' ASN . 2.7 tt0 69.92 -168.58 0.17 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-O 124.533 2.111 . . . . 0.0 112.254 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 82.39 85.83 0.04 OUTLIER 'General case' 0 C--O 1.21 -1.002 0 CA-C-O 125.6 2.619 . . . . 0.0 116.798 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.252 0.6 OUTLIER -114.96 -52.11 2.71 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 110.525 -3.034 . . . . 0.0 111.99 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.8 pttt -27.18 111.72 0.05 OUTLIER 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 128.633 3.708 . . . . 0.0 115.302 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 155.41 -33.97 0.64 Allowed Glycine 0 C--O 1.212 -1.223 0 CA-C-N 110.993 -2.821 . . . . 0.0 112.624 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.722 HD12 HD12 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -115.02 -52.04 2.7 Favored 'General case' 0 N--CA 1.474 0.747 1 CA-C-N 106.896 -4.652 . . . . 0.0 115.587 -179.866 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.601 ' HB2' HD13 ' A' ' 24' ' ' LEU . 58.6 t0 -109.84 -60.33 1.8 Allowed 'General case' 0 C--O 1.215 -0.756 0 O-C-N 120.035 -1.666 . . . . 0.0 112.85 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.02 75.05 1.22 Allowed Glycine 0 N--CA 1.477 1.403 0 CA-C-O 126.336 3.187 . . . . 0.0 110.7 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -142.0 -130.2 0.1 Allowed 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 108.807 -3.697 . . . . 0.0 113.2 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.409 ' CB ' ' HG3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -176.3 111.39 0.1 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 120.006 1.276 . . . . 0.0 110.931 -179.865 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.492 HG22 ' HA3' ' A' ' 100' ' ' GLY . 58.8 t -137.59 144.58 31.01 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.174 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -35.77 -75.94 0.03 OUTLIER 'General case' 0 CA--C 1.507 -0.703 1 O-C-N 130.108 4.63 . . . . 0.0 110.69 -179.589 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.595 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 7.7 m 71.23 61.56 0.17 Allowed 'General case' 0 CA--C 1.497 -1.067 0 C-N-CA 128.758 2.823 . . . . 0.0 112.878 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 1.4 tp -82.23 136.38 35.1 Favored 'General case' 0 N--CA 1.43 -1.459 1 CA-C-N 107.723 -4.308 . . . . 0.0 110.44 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.785 HG21 ' CD2' ' A' ' 65' ' ' PHE . 47.8 t -108.83 147.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 125.244 1.418 . . . . 0.0 108.449 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.259 53.3 m -161.12 152.35 18.85 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 111.419 -2.628 . . . . 0.0 112.07 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.838 ' CD1' HG11 ' A' ' 67' ' ' VAL 0.268 19.1 m95 -92.47 121.97 34.45 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 127.341 2.256 . . . . 0.0 105.043 179.738 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HB2' HG23 ' A' ' 95' ' ' VAL . 3.4 tt0 -88.22 -148.75 0.16 Allowed 'General case' 0 CA--C 1.477 -1.864 0 CA-C-O 126.381 2.991 . . . . 0.0 112.189 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -42.22 95.86 Favored Glycine 0 N--CA 1.488 2.119 0 N-CA-C 103.342 -3.903 . . . . 0.0 103.342 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -169.8 67.35 0.05 Allowed 'General case' 0 C--O 1.21 -1.008 1 O-C-N 130.04 4.023 . . . . 0.0 110.809 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.42 ' O ' ' CE3' ' A' ' 89' ' ' TRP . 1.7 t 176.15 169.9 0.42 Allowed 'General case' 0 C--O 1.2 -1.549 0 N-CA-C 117.19 2.293 . . . . 0.0 117.19 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.589 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -96.8 94.22 7.14 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 129.103 2.961 . . . . 0.0 113.921 179.364 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.408 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.319 50.5 t -103.75 141.28 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.898 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 179.776 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.1 OUTLIER -143.81 127.77 17.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 125.433 1.708 . . . . 0.0 107.705 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.425 HG22 ' H ' ' A' ' 97' ' ' VAL . 35.4 m -104.63 98.8 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.442 0 CA-C-O 127.234 3.397 . . . . 0.0 118.437 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.47 ' CB ' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -73.75 92.24 1.99 Allowed 'General case' 0 C--N 1.355 0.826 0 O-C-N 117.594 -3.191 . . . . 0.0 109.045 179.683 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.424 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.5 OUTLIER -97.41 87.29 4.09 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 108.649 -3.887 . . . . 0.0 111.403 -179.761 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.492 ' HA3' HG22 ' A' ' 83' ' ' VAL . . . -145.59 91.83 0.16 Allowed Glycine 0 C--O 1.211 -1.306 0 C-N-CA 117.16 -2.448 . . . . 0.0 113.571 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 49.63 -70.78 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 110.712 -2.744 . . . . 0.0 115.401 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.431 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -100.45 -73.44 0.64 Allowed 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -179.004 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -48.78 160.21 0.2 Allowed 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -128.84 76.91 1.75 Allowed 'General case' 0 N--CA 1.491 1.599 2 O-C-N 131.759 5.662 . . . . 0.0 102.344 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.406 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 13.7 mmm-85 -87.13 -3.7 59.08 Favored 'General case' 0 C--O 1.212 -0.901 0 O-C-N 127.637 3.086 . . . . 0.0 114.383 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -34.86 86.21 0.01 OUTLIER Glycine 0 CA--C 1.535 1.322 2 CA-C-N 105.796 -5.184 . . . . 0.0 117.24 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.806 ' CZ2' HD21 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -84.66 132.44 34.47 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 127.275 2.397 . . . . 0.0 110.289 178.892 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.422 ' C ' ' NE2' ' A' ' 109' ' ' GLN . 0.3 OUTLIER -159.78 168.87 24.87 Favored 'General case' 0 C--O 1.2 -1.511 1 O-C-N 129.403 4.189 . . . . 0.0 118.458 -179.558 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.55 ' HB3' HD21 ' A' ' 116' ' ' LEU . 8.8 mm-40 -128.78 169.61 14.33 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 110.152 -3.204 . . . . 0.0 110.125 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.445 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.2 OUTLIER -166.46 14.39 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.074 1 O-C-N 129.351 4.157 . . . . 0.0 118.565 179.263 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.752 HG21 ' HA ' ' A' ' 4' ' ' ASP . 25.4 t 29.86 105.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.475 -1.912 0 CA-C-O 127.72 3.628 . . . . 0.0 119.673 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -123.05 49.64 1.63 Allowed 'General case' 0 N--CA 1.484 1.271 0 O-C-N 118.479 -2.638 . . . . 0.0 114.033 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.33 -132.82 6.38 Favored Glycine 0 C--O 1.202 -1.854 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.429 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.94 38.59 1.61 Allowed 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 127.677 2.391 . . . . 0.0 114.113 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.451 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 54.9 pttt -168.2 162.17 12.7 Favored 'General case' 0 CA--C 1.515 -0.384 1 O-C-N 130.747 5.029 . . . . 0.0 110.129 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.59 HD12 HG22 ' A' ' 111' ' ' VAL . 1.4 tt -118.8 104.59 10.71 Favored 'General case' 0 C--O 1.207 -1.165 0 O-C-N 126.285 2.241 . . . . 0.0 114.371 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -57.94 110.35 0.9 Allowed 'General case' 0 C--O 1.201 -1.491 1 O-C-N 129.554 4.283 . . . . 0.0 115.343 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -98.37 71.52 2.05 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 127.803 3.19 . . . . 0.0 106.533 179.89 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.445 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.3 mt-10 -83.5 105.58 14.55 Favored 'General case' 0 CA--C 1.484 -1.564 1 O-C-N 130.294 4.746 . . . . 0.0 112.277 -179.883 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.772 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -109.15 155.57 20.87 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 114.151 -1.386 . . . . 0.0 108.376 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.772 ' O ' HD12 ' A' ' 120' ' ' LEU . 1.9 m -109.9 161.48 15.44 Favored 'General case' 0 CA--C 1.489 -1.391 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.661 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -161.45 72.39 0.41 Allowed 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 121.259 1.845 . . . . 0.0 115.008 -179.957 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 34.6 67.1 0.28 Allowed Glycine 0 N--CA 1.435 -1.374 0 C-N-CA 126.397 1.951 . . . . 0.0 114.557 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 119.43 -56.15 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.342 0 O-C-N 128.888 3.346 . . . . 0.0 109.85 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.429 ' C ' HG23 ' A' ' 126' ' ' VAL . 32.2 mm-40 -75.44 162.13 28.61 Favored 'General case' 0 C--N 1.352 0.683 0 O-C-N 127.972 3.295 . . . . 0.0 107.627 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.429 HG23 ' C ' ' A' ' 125' ' ' GLN . 7.7 t -146.18 82.7 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 CA-C-N 109.214 -3.63 . . . . 0.0 113.335 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 38.8 t -51.26 144.53 9.46 Favored 'General case' 0 CA--C 1.504 -0.805 0 O-C-N 124.644 1.215 . . . . 0.0 109.614 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -135.39 63.79 1.6 Allowed 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 116.953 -1.498 . . . . 0.0 113.215 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -48.18 168.07 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.727 1 O-C-N 129.767 4.417 . . . . 0.0 115.484 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.35 120.73 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 102.71 -3.071 . . . . 0.0 102.71 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 30.8 m-85 -102.12 178.87 4.48 Favored 'General case' 0 CA--C 1.475 -1.934 0 CA-C-O 127.098 3.332 . . . . 0.0 118.538 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.451 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.1 OUTLIER -168.85 117.78 0.69 Allowed 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 110.593 -3.003 . . . . 0.0 108.947 -179.55 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.465 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 28.2 ttpt -59.38 108.07 0.66 Allowed 'General case' 0 CA--C 1.488 -1.421 0 O-C-N 128.104 3.377 . . . . 0.0 116.156 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.501 -0.91 0 CA-C-O 114.786 -2.53 . . . . 0.0 113.489 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.885 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.667 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.8 m 66.21 -62.91 0.25 Allowed 'General case' 0 C--O 1.202 -1.417 0 O-C-N 125.712 1.882 . . . . 0.0 110.82 179.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.551 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 0.5 OUTLIER -78.61 -52.43 8.47 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 119.32 3.081 . . . . 0.0 119.32 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.32 122.2 27.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -134.05 31.38 3.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 113.744 -3.026 . . . . 0.0 108.621 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.438 ' HA ' HG23 ' A' ' 43' ' ' ILE . 2.4 m120 -24.41 128.16 0.03 OUTLIER 'General case' 0 C--O 1.236 0.381 1 O-C-N 130.136 4.648 . . . . 0.0 110.63 179.568 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 42' ' ' ILE . . . -175.37 -118.15 0.51 Allowed Glycine 0 C--O 1.221 -0.693 0 C-N-CA 115.746 -3.121 . . . . 0.0 114.511 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.565 ' CG2' HG23 ' A' ' 40' ' ' THR . 98.4 m 177.67 144.54 0.11 Allowed 'General case' 0 N--CA 1.476 0.85 1 O-C-N 132.504 5.473 . . . . 0.0 106.018 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.56 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -144.5 90.07 2.06 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -179.727 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -57.69 100.75 0.06 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 128.493 3.621 . . . . 0.0 106.779 179.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.403 ' O ' ' CB ' ' A' ' 12' ' ' GLU . 32.2 ttm -32.61 -59.89 0.31 Allowed 'General case' 0 N--CA 1.479 0.99 0 O-C-N 129.099 4.0 . . . . 0.0 109.611 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.403 ' CB ' ' O ' ' A' ' 11' ' ' MET . 1.9 tt0 98.58 -44.54 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.012 0 O-C-N 125.946 2.029 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.25 15.7 m -174.62 149.41 1.25 Allowed 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 110.015 -3.266 . . . . 0.0 113.711 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -125.38 139.62 53.51 Favored 'General case' 0 C--O 1.213 -0.867 2 O-C-N 129.816 4.447 . . . . 0.0 110.495 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -71.08 -95.53 0.01 OUTLIER 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 109.375 -3.557 . . . . 0.0 111.31 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 5.1 p30 -83.94 147.18 27.62 Favored 'General case' 0 C--O 1.204 -1.297 0 O-C-N 119.225 -2.172 . . . . 0.0 109.004 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -116.8 -68.39 0.92 Allowed 'General case' 0 C--O 1.204 -1.316 0 O-C-N 127.041 2.713 . . . . 0.0 111.263 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 -46.73 87.01 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 117.747 2.499 . . . . 0.0 117.747 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.495 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.18 -25.36 25.11 Favored Glycine 0 CA--C 1.491 -1.415 0 O-C-N 128.786 3.804 . . . . 0.0 113.308 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.506 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -75.14 -43.18 54.05 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 104.734 -2.321 . . . . 0.0 104.734 179.399 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.407 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -72.12 -21.54 61.46 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 116.487 -2.085 . . . . 0.0 112.302 -179.728 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.495 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 1.3 ttmt -76.87 -40.92 45.86 Favored 'General case' 0 C--O 1.207 -1.135 0 O-C-N 129.023 3.952 . . . . 0.0 113.084 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.405 ' CB ' ' HB2' ' A' ' 122' ' ' CYS . . . -56.3 -44.38 79.83 Favored 'General case' 0 C--O 1.214 -0.815 0 O-C-N 128.905 3.878 . . . . 0.0 115.222 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.064 HD11 ' HB2' ' A' ' 79' ' ' ASP . 0.1 OUTLIER -88.96 1.6 55.21 Favored 'General case' 0 N--CA 1.491 1.576 2 O-C-N 130.76 5.038 . . . . 0.0 109.177 -178.661 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 50.22 82.92 0.05 OUTLIER 'General case' 0 CA--C 1.48 -1.726 0 CA-C-O 127.83 3.681 . . . . 0.0 114.447 178.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.413 HG21 HD13 ' A' ' 26' ' ' ILE . 2.2 tt -110.8 -33.56 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.632 0 CA-C-N 110.946 -2.843 . . . . 0.0 111.873 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 179.82 127.59 0.08 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.539 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -79.18 12.88 2.08 Favored 'General case' 0 CA--C 1.5 -0.946 0 C-N-CA 116.162 -2.215 . . . . 0.0 116.485 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -172.61 75.05 0.04 OUTLIER 'General case' 0 C--O 1.208 -1.102 0 CA-C-O 123.09 1.424 . . . . 0.0 110.712 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.66 -31.67 6.1 Favored 'General case' 0 C--N 1.353 0.724 2 CA-C-N 106.348 -4.933 . . . . 0.0 115.872 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.418 ' CG ' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -57.04 -164.57 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.963 1 O-C-N 129.654 4.346 . . . . 0.0 112.514 -179.775 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' A' ' 31' ' ' ARG . 14.5 tttm 67.76 39.61 2.63 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 125.658 1.849 . . . . 0.0 108.58 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.502 HG22 ' N ' ' A' ' 34' ' ' ALA . 0.4 OUTLIER -166.0 -49.78 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.93 2 O-C-N 130.095 4.622 . . . . 0.0 111.534 179.934 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.502 ' N ' HG22 ' A' ' 33' ' ' ILE . . . -93.14 18.55 9.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.657 -1.902 . . . . 0.0 113.912 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.6 t -40.31 -36.35 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.278 0 CA-C-O 124.231 1.967 . . . . 0.0 110.372 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.684 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -154.69 153.86 31.99 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 109.831 -3.349 . . . . 0.0 107.687 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.701 HD13 ' CZ ' ' A' ' 58' ' ' PHE . 2.1 pt? 148.79 -18.21 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 2 O-C-N 135.608 8.068 . . . . 0.0 110.811 178.755 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.695 ' HA ' ' HB3' ' A' ' 56' ' ' SER 0.265 0.5 OUTLIER -77.13 51.32 0.81 Allowed 'General case' 0 CA--C 1.48 -1.728 0 C-N-CA 130.547 3.539 . . . . 0.0 119.063 -176.837 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.431 ' HG2' ' N ' ' A' ' 40' ' ' THR . 26.6 tt0 -122.42 144.25 49.16 Favored 'General case' 0 CA--C 1.493 -1.224 0 O-C-N 119.106 -2.246 . . . . 0.0 116.69 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.566 HG22 ' O ' ' A' ' 40' ' ' THR . 99.6 m 97.85 64.5 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.327 0 C-N-CA 130.352 3.461 . . . . 0.0 111.072 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.499 ' HD3' ' C ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -76.46 150.07 36.73 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 108.406 -3.997 . . . . 0.0 101.93 179.752 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.551 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.3 mt -143.0 158.5 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 125.65 1.844 . . . . 0.0 109.246 179.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.551 ' N ' HG22 ' A' ' 42' ' ' ILE 0.292 18.2 tt -132.95 148.17 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 1 O-C-N 129.399 4.187 . . . . 0.0 111.428 -179.685 . . . . . . . . 4 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 44' ' ' VAL . 77.7 t -154.95 85.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.658 0 CA-C-N 111.93 -2.395 . . . . 0.0 110.066 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.74 84.72 6.3 Favored 'General case' 0 CA--C 1.485 -1.519 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.07 -13.7 59.92 Favored 'General case' 0 C--N 1.364 1.198 0 O-C-N 126.933 2.646 . . . . 0.0 117.985 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 146.33 -103.3 0.27 Allowed Glycine 0 C--O 1.212 -1.273 0 N-CA-C 111.432 -0.667 . . . . 0.0 111.432 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.07 40.24 1.36 Allowed 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 124.58 0.812 . . . . 0.0 110.776 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -176.29 86.39 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 O-C-N 127.048 2.717 . . . . 0.0 109.318 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.515 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 1.8 t80 -99.19 135.12 41.06 Favored 'General case' 0 CA--C 1.486 -1.499 1 O-C-N 131.187 5.304 . . . . 0.0 112.105 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -144.48 90.53 2.1 Favored 'General case' 0 CA--C 1.481 -1.71 0 O-C-N 128.63 3.706 . . . . 0.0 117.421 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.584 ' HB ' HD23 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -70.75 120.06 15.8 Favored 'General case' 0 CA--C 1.501 -0.917 0 O-C-N 128.276 3.485 . . . . 0.0 106.907 179.728 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.53 ' HD2' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.83 146.17 49.4 Favored 'General case' 0 CA--C 1.49 -1.344 0 C-N-CA 117.407 -1.717 . . . . 0.0 107.967 -178.605 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.468 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 5.7 t -105.95 175.18 5.58 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.147 1.529 . . . . 0.0 113.22 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -148.96 37.53 0.79 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.695 ' HB3' ' HA ' ' A' ' 38' ' ' THR . 1.1 p -62.54 142.15 58.11 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 128.513 2.725 . . . . 0.0 108.314 179.618 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 37' ' ' LEU 0.254 0.1 OUTLIER -39.45 -50.56 2.13 Favored 'General case' 0 N--CA 1.489 1.518 1 O-C-N 130.608 4.942 . . . . 0.0 106.669 -179.952 . . . . . . . . 5 4 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.701 ' CZ ' HD13 ' A' ' 37' ' ' LEU . 12.2 p90 -166.57 76.38 0.19 Allowed 'General case' 0 C--N 1.366 1.318 0 O-C-N 126.967 2.667 . . . . 0.0 115.203 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.62 51.29 0.0 OUTLIER 'General case' 0 C--N 1.363 1.186 1 CA-C-N 107.298 -4.501 . . . . 0.0 111.235 179.788 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.468 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 15.6 m-80 -86.59 107.17 18.03 Favored 'General case' 0 C--O 1.219 -0.543 2 CA-C-N 107.799 -4.273 . . . . 0.0 112.777 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -124.94 98.3 5.63 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 127.943 3.277 . . . . 0.0 106.816 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.63 152.68 41.56 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.495 2.997 . . . . 0.0 115.552 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.584 HD23 ' HB ' ' A' ' 52' ' ' THR . 11.9 tp -117.8 47.17 1.6 Allowed 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 112.95 -1.932 . . . . 0.0 111.456 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -87.1 94.37 9.62 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 124.479 2.085 . . . . 0.0 112.544 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -140.05 -153.01 0.44 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 126.103 1.761 . . . . 0.0 106.528 179.447 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.417 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -151.03 -178.63 6.72 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-O 116.873 -1.537 . . . . 0.0 108.017 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.417 ' N ' ' OG1' ' A' ' 66' ' ' THR . 63.4 t -80.64 119.24 29.81 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.642 1 O-C-N 133.74 6.9 . . . . 0.0 112.597 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.52 9.48 55.42 Favored Glycine 0 N--CA 1.484 1.885 0 CA-C-N 109.451 -3.522 . . . . 0.0 117.447 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.608 HG13 ' N ' ' A' ' 71' ' ' PHE 0.285 14.0 p -59.78 -17.79 13.91 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 O-C-N 124.902 1.001 . . . . 0.0 111.312 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.445 ' HG2' HD12 ' A' ' 86' ' ' LEU . 0.0 OUTLIER 61.61 63.17 1.2 Allowed 'General case' 0 CA--C 1.543 0.681 0 O-C-N 128.546 3.654 . . . . 0.0 107.433 -179.013 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.608 ' N ' HG13 ' A' ' 69' ' ' VAL . 12.0 t80 -64.85 141.46 58.77 Favored 'General case' 0 CA--C 1.494 -1.211 2 CA-C-N 106.33 -4.941 . . . . 0.0 118.954 -178.164 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -100.32 104.15 15.59 Favored 'General case' 0 C--O 1.21 -1.026 0 O-C-N 119.347 -2.096 . . . . 0.0 110.225 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -72.11 74.32 0.93 Allowed 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 125.336 2.493 . . . . 0.0 109.642 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -80.24 116.59 20.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 109.509 -3.496 . . . . 0.0 112.008 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.469 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.2 OUTLIER -157.66 -179.47 8.19 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 114.013 -1.449 . . . . 0.0 113.04 -179.62 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.469 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -150.54 -52.2 0.14 Allowed 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 127.185 3.374 . . . . 0.0 110.43 179.51 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -44.65 -32.88 3.1 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 108.793 -3.821 . . . . 0.0 108.261 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.0 tp -124.05 79.89 1.77 Allowed 'General case' 0 CA--C 1.529 0.165 0 O-C-N 129.22 3.541 . . . . 0.0 115.536 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 1.064 ' HB2' HD11 ' A' ' 24' ' ' LEU . 17.7 t70 85.82 -63.81 0.05 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.807 3.192 . . . . 0.0 110.333 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.83 119.58 2.46 Favored Glycine 0 C--O 1.213 -1.177 0 CA-C-N 109.02 -3.718 . . . . 0.0 115.868 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.02 -123.55 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 O-C-N 126.818 2.128 . . . . 0.0 113.413 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.0 p30 168.8 63.44 0.0 OUTLIER 'General case' 0 C--O 1.197 -1.698 0 CA-C-N 119.923 1.238 . . . . 0.0 112.417 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.782 HG12 ' O ' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -90.84 158.93 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.027 0 CA-C-O 116.418 -1.753 . . . . 0.0 112.717 179.948 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 99' ' ' LYS . 7.8 mmpt? -68.28 169.0 11.29 Favored 'General case' 0 C--N 1.326 -0.44 1 O-C-N 129.392 4.183 . . . . 0.0 107.053 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 85' ' ' THR . 1.2 m -171.32 77.3 0.06 Allowed 'General case' 0 C--O 1.194 -1.823 1 O-C-N 131.11 5.256 . . . . 0.0 111.107 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.445 HD12 ' HG2' ' A' ' 70' ' ' GLU . 2.1 tt -68.38 141.52 55.7 Favored 'General case' 0 N--CA 1.431 -1.398 1 CA-C-N 105.975 -5.102 . . . . 0.0 109.886 179.647 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.1 t -129.91 144.43 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.069 1.347 . . . . 0.0 108.446 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.674 HG23 ' HB ' ' A' ' 95' ' ' VAL . 2.9 t -163.49 177.26 9.0 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 126.378 2.99 . . . . 0.0 110.482 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.658 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 65.3 m95 -102.12 133.99 46.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 128.484 2.714 . . . . 0.0 110.236 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.435 ' HG2' HG21 ' A' ' 95' ' ' VAL . 1.0 OUTLIER -88.1 -37.82 15.91 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-O 131.651 5.501 . . . . 0.0 111.605 179.871 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.08 65.32 0.32 Allowed Glycine 0 N--CA 1.481 1.655 2 CA-C-N 106.429 -4.896 . . . . 0.0 102.226 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 149.26 -36.2 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 132.888 5.699 . . . . 0.0 111.007 -179.87 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.46 174.55 10.5 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 119.19 3.033 . . . . 0.0 119.19 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.87 82.6 2.27 Favored 'General case' 0 CA--C 1.485 -1.548 0 C-N-CA 129.596 3.159 . . . . 0.0 115.766 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.674 ' HB ' HG23 ' A' ' 88' ' ' THR 0.339 97.9 t -77.19 131.53 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-N 108.888 -3.778 . . . . 0.0 113.188 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.546 ' CB ' ' CZ2' ' A' ' 107' ' ' TRP . 0.5 OUTLIER -141.39 134.17 28.77 Favored 'General case' 0 C--O 1.201 -1.449 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -131.63 123.2 51.7 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.107 0 CA-C-N 109.58 -3.463 . . . . 0.0 116.035 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.582 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 1.4 tt0 -85.37 98.67 10.69 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 126.747 3.165 . . . . 0.0 110.382 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.782 ' O ' HG12 ' A' ' 83' ' ' VAL . 7.4 mttm -81.65 158.79 24.17 Favored 'General case' 0 C--O 1.205 -1.251 1 CA-C-N 108.11 -4.132 . . . . 0.0 106.846 -179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.4 138.93 5.85 Favored Glycine 0 C--O 1.211 -1.306 0 O-C-N 126.947 2.654 . . . . 0.0 107.212 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.471 ' HG2' ' N ' ' A' ' 102' ' ' LYS . 71.2 tt0 63.24 163.26 0.11 Allowed 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 109.48 -3.36 . . . . 0.0 108.718 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.471 ' N ' ' HG2' ' A' ' 101' ' ' GLU . 0.1 OUTLIER -39.96 -58.48 1.4 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 112.114 -2.312 . . . . 0.0 111.548 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.17 146.22 0.93 Allowed 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 111.128 -2.76 . . . . 0.0 113.192 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -127.17 64.55 1.32 Allowed 'General case' 0 N--CA 1.483 1.22 2 O-C-N 130.141 4.65 . . . . 0.0 103.576 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.582 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 3.6 mmm180 -67.33 69.73 0.1 Allowed 'General case' 0 N--CA 1.478 0.972 0 O-C-N 128.127 3.392 . . . . 0.0 113.853 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -114.08 95.92 0.76 Allowed Glycine 0 C--O 1.205 -1.67 0 CA-C-O 113.689 -3.84 . . . . 0.0 111.769 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.546 ' CZ2' ' CB ' ' A' ' 96' ' ' CYS . 9.3 p90 -88.71 1.8 54.48 Favored 'General case' 0 C--O 1.195 -1.791 2 O-C-N 134.226 6.486 . . . . 0.0 115.656 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.47 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 7.0 ptpt -24.5 141.63 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.359 2 O-C-N 130.482 4.864 . . . . 0.0 113.819 -179.338 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.511 ' HG3' ' CD2' ' A' ' 118' ' ' LEU 0.287 1.5 mp0 -102.96 169.98 8.25 Favored 'General case' 0 C--N 1.362 1.147 0 CA-C-N 112.539 -2.119 . . . . 0.0 109.793 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.489 ' C ' HG23 ' A' ' 111' ' ' VAL . 19.0 m95 -127.11 -57.93 1.3 Allowed 'General case' 0 C--O 1.208 -1.11 1 O-C-N 129.587 4.304 . . . . 0.0 116.968 179.47 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.489 HG23 ' C ' ' A' ' 110' ' ' TRP . 21.2 t 93.05 68.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-O 127.635 3.588 . . . . 0.0 108.654 -175.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.21 120.27 40.19 Favored 'General case' 0 CA--C 1.478 -1.818 1 CA-C-N 108.069 -4.15 . . . . 0.0 118.302 -176.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 14.79 83.73 0.01 OUTLIER Glycine 0 C--O 1.215 -1.073 0 C-N-CA 127.289 2.376 . . . . 0.0 116.183 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 49.38 81.11 0.06 Allowed 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 115.81 -2.043 . . . . 0.0 116.239 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.467 ' HB2' ' HB3' ' A' ' 131' ' ' PHE . 0.4 OUTLIER 148.13 -167.77 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.132 1 O-C-N 133.79 6.931 . . . . 0.0 110.46 -179.855 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.472 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -145.99 71.26 1.26 Allowed 'General case' 0 CA--C 1.493 -1.245 0 O-C-N 128.938 3.899 . . . . 0.0 115.589 -179.936 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -44.67 126.23 5.42 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 126.727 2.517 . . . . 0.0 116.255 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.511 ' CD2' ' HG3' ' A' ' 109' ' ' GLN . 28.4 mt -110.24 117.7 34.37 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 111.396 -2.638 . . . . 0.0 106.578 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.37 105.22 13.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 115.728 -2.082 . . . . 0.0 106.198 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.13 118.96 34.83 Favored 'General case' 0 N--CA 1.489 1.487 1 O-C-N 131.328 5.392 . . . . 0.0 114.023 -179.739 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.2 m -96.72 145.81 25.46 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 110.643 -2.981 . . . . 0.0 103.758 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.505 ' HB3' ' HD3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -133.62 39.68 3.18 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 125.382 2.515 . . . . 0.0 111.295 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 114.06 -80.97 0.29 Allowed Glycine 0 C--O 1.218 -0.851 0 CA-C-N 113.428 -1.715 . . . . 0.0 109.96 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.24 -18.77 13.52 Favored 'General case' 0 CA--C 1.494 -1.202 0 C-N-CA 125.547 1.539 . . . . 0.0 111.876 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -103.55 159.93 15.17 Favored 'General case' 0 C--O 1.198 -1.643 0 O-C-N 125.855 1.972 . . . . 0.0 107.611 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.45 ' O ' HG23 ' A' ' 126' ' ' VAL . 11.0 m -134.01 131.53 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 CA-C-N 109.215 -3.629 . . . . 0.0 112.542 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.7 m -117.86 119.64 35.49 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 116.297 -1.811 . . . . 0.0 110.006 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.24 102.95 12.64 Favored 'General case' 0 N--CA 1.484 1.269 1 O-C-N 129.258 4.099 . . . . 0.0 110.885 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -68.4 167.17 15.19 Favored 'General case' 0 CA--C 1.491 -1.309 0 C-N-CA 114.121 -3.032 . . . . 0.0 116.049 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.3 t -141.8 81.07 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.605 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.467 ' HB3' ' HB2' ' A' ' 115' ' ' LYS . 16.2 m-85 -66.92 175.58 2.42 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 109.968 -3.287 . . . . 0.0 117.976 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.258 4.3 tptt -159.93 99.7 1.39 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 109.036 -3.711 . . . . 0.0 107.872 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.529 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 28.1 ttpt -57.56 110.03 0.8 Allowed 'General case' 0 C--O 1.218 -0.585 0 CA-C-O 115.539 -2.172 . . . . 0.0 109.904 178.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.492 -1.262 0 N-CA-C 118.756 2.873 . . . . 0.0 118.756 -178.65 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ttt . . . . . 0 N--CA 1.503 2.192 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.818 HG21 ' HB3' ' A' ' 92' ' ' ASN . 0.2 OUTLIER -70.08 149.98 47.06 Favored 'General case' 0 C--N 1.353 0.748 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.508 179.75 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.539 ' HE2' ' CE3' ' A' ' 89' ' ' TRP . 1.4 mtmt 63.07 176.97 0.15 Allowed 'General case' 0 N--CA 1.439 -1.015 0 O-C-N 126.437 2.335 . . . . 0.0 116.166 179.907 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 29.2 t0 44.9 71.37 0.27 Allowed 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 124.501 2.096 . . . . 0.0 107.759 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -97.57 -75.88 0.53 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.205 -179.498 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.424 ' OD1' ' N ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 47.26 135.05 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.629 1 O-C-N 131.897 5.748 . . . . 0.0 114.473 -176.677 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.3 -133.87 1.63 Allowed Glycine 0 C--O 1.206 -1.603 0 CA-C-N 109.874 -3.33 . . . . 0.0 114.431 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.9 t -174.47 62.36 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.321 1 O-C-N 131.476 4.868 . . . . 0.0 108.129 -179.023 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.621 ' CZ2' HD13 ' A' ' 116' ' ' LEU 0.253 0.0 OUTLIER -51.82 106.77 0.16 Allowed 'General case' 0 CA--C 1.507 -0.675 1 O-C-N 130.677 4.986 . . . . 0.0 115.595 -179.495 . . . . . . . . 5 4 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -48.8 -25.81 2.05 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 116.966 -1.493 . . . . 0.0 114.162 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.5 ttp 83.65 -74.39 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.9 1 O-C-N 129.609 4.318 . . . . 0.0 105.744 -179.855 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 102.1 -48.08 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.527 0 O-C-N 128.028 3.33 . . . . 0.0 111.773 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.6 137.13 28.12 Favored 'General case' 0 C--N 1.361 1.087 0 CA-C-N 110.143 -3.208 . . . . 0.0 110.006 -179.803 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -121.01 100.23 6.95 Favored 'General case' 0 C--O 1.197 -1.686 0 N-CA-C 117.942 2.571 . . . . 0.0 117.942 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.518 ' HB3' ' C ' ' A' ' 128' ' ' ARG . 15.9 pt-20 5.37 -133.5 0.0 OUTLIER 'General case' 0 CA--C 1.473 -1.987 2 O-C-N 136.34 8.525 . . . . 0.0 117.005 178.402 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 0.3 OUTLIER -112.64 137.25 51.18 Favored 'General case' 0 C--O 1.203 -1.354 1 O-C-N 114.651 -5.031 . . . . 0.0 106.755 -179.519 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.515 ' CE2' HG22 ' A' ' 35' ' ' VAL . 1.9 p90 -118.19 -30.15 5.37 Favored 'General case' 0 CA--C 1.487 -1.469 0 O-C-N 127.565 3.041 . . . . 0.0 114.908 -178.563 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 22' ' ' LYS . 12.3 tt0 -74.78 -53.84 8.44 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 115.778 -2.058 . . . . 0.0 110.551 179.757 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.52 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -59.3 -24.35 58.9 Favored Glycine 0 N--CA 1.474 1.217 1 O-C-N 132.869 6.356 . . . . 0.0 111.479 178.741 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -70.77 -46.74 62.38 Favored 'General case' 0 C--O 1.195 -1.767 0 CA-C-O 125.752 2.692 . . . . 0.0 106.047 179.676 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.9 mmt -73.35 -23.71 60.25 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.495 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.52 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -78.99 -28.06 43.41 Favored 'General case' 0 C--O 1.206 -1.231 0 O-C-N 127.901 3.251 . . . . 0.0 110.124 -179.862 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -63.9 -37.62 88.06 Favored 'General case' 0 C--O 1.208 -1.097 1 O-C-N 129.517 4.26 . . . . 0.0 111.734 -179.778 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.862 HD12 ' HB2' ' A' ' 79' ' ' ASP 0.361 1.5 mm? -81.45 -56.23 4.17 Favored 'General case' 0 C--O 1.208 -1.128 2 CA-C-N 105.517 -5.31 . . . . 0.0 108.501 179.98 . . . . . . . . 4 3 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.291 19.3 t0 83.71 79.01 0.02 OUTLIER 'General case' 0 CA--C 1.484 -1.577 3 O-C-N 133.48 6.738 . . . . 0.0 107.258 -179.523 . . . . . . . . 3 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.645 HD12 ' O ' ' A' ' 78' ' ' LEU . 14.0 tt -102.29 41.13 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 128.397 3.951 . . . . 0.0 110.052 179.926 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.04 164.35 0.28 Allowed 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 109.701 -3.409 . . . . 0.0 111.641 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -87.45 84.69 7.13 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 118.812 0.733 . . . . 0.0 112.422 179.759 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 169.53 156.61 0.05 Allowed 'General case' 0 C--N 1.364 1.231 0 O-C-N 126.382 2.301 . . . . 0.0 106.07 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.274 0.4 OUTLIER 101.06 -19.22 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.847 1 O-C-N 130.876 5.11 . . . . 0.0 113.935 179.669 . . . . . . . . 4 3 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.6 162.16 15.99 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 130.562 3.545 . . . . 0.0 108.865 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 84.36 3.14 0.79 Allowed 'General case' 0 C--N 1.31 -1.139 0 O-C-N 128.431 3.582 . . . . 0.0 111.827 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 mp -128.87 -33.82 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.137 1 O-C-N 130.191 4.682 . . . . 0.0 111.404 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.48 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -99.52 16.05 24.54 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.914 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.515 HG22 ' CE2' ' A' ' 17' ' ' PHE . 12.1 t -26.78 -52.23 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.2 -1.547 0 O-C-N 127.167 2.792 . . . . 0.0 111.0 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.99 117.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 2 O-C-N 131.132 5.27 . . . . 0.0 109.144 179.674 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.92 HD12 ' N ' ' A' ' 38' ' ' THR . 2.5 pp -87.3 -45.01 10.99 Favored 'General case' 0 N--CA 1.433 -1.288 1 O-C-N 129.406 4.191 . . . . 0.0 110.664 -179.923 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.92 ' N ' HD12 ' A' ' 37' ' ' LEU . 1.3 m 145.64 117.31 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.206 1 O-C-N 134.569 7.418 . . . . 0.0 116.915 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.588 ' HG2' ' N ' ' A' ' 56' ' ' SER . 5.4 tp60 -158.12 -98.94 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 115.677 -2.409 . . . . 0.0 116.456 179.148 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.53 ' N ' ' HG3' ' A' ' 39' ' ' GLN . 1.9 m 157.72 151.55 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.597 1 O-C-N 132.633 6.208 . . . . 0.0 111.768 -175.359 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.554 ' HE3' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -110.27 131.93 54.62 Favored 'General case' 0 N--CA 1.492 1.649 1 O-C-N 129.791 4.432 . . . . 0.0 101.656 177.979 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.516 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.2 mp -107.8 164.43 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 126.333 2.271 . . . . 0.0 111.19 179.511 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.516 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -141.94 143.59 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.407 0 CA-C-N 112.386 -2.188 . . . . 0.0 106.855 179.789 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 45' ' ' GLN . 4.9 t -117.15 -66.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.223 0 C-N-CA 115.735 -2.386 . . . . 0.0 109.844 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.442 ' N ' HG12 ' A' ' 44' ' ' VAL . 1.0 OUTLIER 57.84 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 117.156 2.28 . . . . 0.0 117.156 -179.88 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -121.43 29.11 7.39 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 127.209 2.818 . . . . 0.0 116.685 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 117.57 -74.52 0.28 Allowed Glycine 0 C--O 1.213 -1.17 0 CA-C-O 118.698 -1.056 . . . . 0.0 111.914 -179.799 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.683 ' O ' HG12 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -111.23 -37.62 5.25 Favored 'General case' 0 N--CA 1.438 -1.037 0 O-C-N 126.463 1.92 . . . . 0.0 112.753 -179.828 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -83.75 85.43 7.29 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.519 1.928 . . . . 0.0 111.915 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.863 ' CD2' HD22 ' A' ' 94' ' ' LEU . 76.7 t80 -86.96 79.89 8.61 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 127.293 2.871 . . . . 0.0 112.315 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -95.96 77.13 3.15 Favored 'General case' 0 CA--C 1.481 -1.7 1 O-C-N 129.678 4.361 . . . . 0.0 118.807 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.534 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -65.37 168.92 6.45 Favored 'General case' 0 C--N 1.367 1.332 0 O-C-N 128.221 3.451 . . . . 0.0 107.319 179.812 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.521 ' N ' ' CG2' ' A' ' 52' ' ' THR 0.279 13.1 ttpt -160.3 164.99 32.14 Favored 'General case' 0 N--CA 1.488 1.473 1 O-C-N 129.125 4.016 . . . . 0.0 111.369 -175.856 . . . . . . . . 4 3 . 1 . 021 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.426 HG22 ' O ' ' A' ' 59' ' ' ARG . 1.4 m -140.45 103.31 4.53 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 110.386 -3.097 . . . . 0.0 107.233 178.882 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -78.01 -20.17 53.01 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 111.374 -2.648 . . . . 0.0 116.187 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.588 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 2.6 t -31.17 117.96 0.19 Allowed 'General case' 0 N--CA 1.469 0.505 1 O-C-N 132.649 6.218 . . . . 0.0 106.156 -179.838 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.651 HG22 ' CD2' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -52.85 -27.16 17.13 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 129.085 3.991 . . . . 0.0 108.396 -179.775 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.86 ' CD1' HD23 ' A' ' 37' ' ' LEU . 0.4 OUTLIER -61.49 -80.88 0.02 OUTLIER 'General case' 0 C--N 1.355 0.813 0 O-C-N 126.298 2.249 . . . . 0.0 111.297 179.907 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' O ' HG22 ' A' ' 54' ' ' THR . 0.0 OUTLIER -124.48 110.01 13.96 Favored 'General case' 0 C--N 1.368 1.373 0 O-C-N 126.842 2.589 . . . . 0.0 112.534 -179.849 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.18 83.82 1.98 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 128.421 3.576 . . . . 0.0 108.599 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.23 -27.95 29.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.812 3.195 . . . . 0.0 111.427 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 155.35 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 127.665 3.103 . . . . 0.0 115.257 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.989 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 8.6 tp -121.16 45.28 2.31 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.371 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -81.44 99.51 8.77 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 126.28 2.238 . . . . 0.0 110.736 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.542 ' CZ ' HG11 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -149.34 173.76 13.17 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 112.831 -1.986 . . . . 0.0 107.367 179.657 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.532 ' N ' ' CG ' ' A' ' 65' ' ' PHE . 2.1 m -132.13 135.07 46.14 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-O 117.099 -1.429 . . . . 0.0 107.683 179.65 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 48' ' ' ASP . 2.1 p -49.22 146.65 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.674 0 O-C-N 126.947 2.655 . . . . 0.0 114.705 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 65.79 16.01 63.07 Favored Glycine 0 N--CA 1.485 1.904 0 O-C-N 128.688 3.742 . . . . 0.0 115.952 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.305 1.2 t -86.06 -23.44 6.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.71 -179.642 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 72.97 72.1 0.13 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 128.559 3.662 . . . . 0.0 108.204 -178.832 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.551 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -58.28 94.8 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.723 1 CA-C-N 107.107 -4.588 . . . . 0.0 116.014 -179.662 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.25 96.22 2.76 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.894 -179.854 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.26 107.93 15.32 Favored 'General case' 0 CA--C 1.498 -1.028 0 CA-C-O 122.535 1.16 . . . . 0.0 111.827 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -75.11 -24.07 58.01 Favored 'General case' 0 C--O 1.215 -0.741 0 C-N-CA 117.539 -1.664 . . . . 0.0 110.985 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.5 m 47.75 62.9 2.24 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 112.56 -2.109 . . . . 0.0 114.501 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.58 -34.54 10.54 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 128.014 3.769 . . . . 0.0 114.318 -179.961 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.81 -20.84 76.3 Favored Glycine 0 C--O 1.209 -1.416 0 CA-C-N 109.903 -3.317 . . . . 0.0 113.175 -179.76 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.645 ' O ' HD12 ' A' ' 26' ' ' ILE . 5.2 tp -112.81 -11.02 13.53 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 128.103 2.884 . . . . 0.0 115.33 -179.939 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.862 ' HB2' HD12 ' A' ' 24' ' ' LEU . 2.7 t70 -173.78 -73.82 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.856 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.613 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.61 76.35 0.26 Allowed Glycine 0 N--CA 1.472 1.047 0 C-N-CA 128.17 2.795 . . . . 0.0 110.681 -179.596 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -116.1 -127.86 0.29 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 109.768 -3.216 . . . . 0.0 109.977 -179.648 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 165.55 61.14 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.24 1.382 . . . . 0.0 110.887 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.464 HG12 ' H ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -93.27 179.41 0.52 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-N 111.909 -2.405 . . . . 0.0 114.628 -179.812 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.464 ' H ' HG12 ' A' ' 83' ' ' VAL . 0.6 OUTLIER -126.2 151.71 47.01 Favored 'General case' 0 C--N 1.314 -0.949 1 O-C-N 133.682 6.864 . . . . 0.0 107.521 179.525 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.698 HG21 ' CZ3' ' A' ' 107' ' ' TRP . 24.2 m -149.01 74.16 1.24 Allowed 'General case' 0 C--O 1.203 -1.353 1 O-C-N 129.171 4.044 . . . . 0.0 113.603 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 132.64 54.43 Favored 'General case' 0 N--CA 1.428 -1.529 2 CA-C-N 106.524 -4.853 . . . . 0.0 109.691 -179.614 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.542 HG11 ' CZ ' ' A' ' 65' ' ' PHE . 2.0 t -122.77 155.35 28.17 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.139 0 CA-C-O 123.705 1.717 . . . . 0.0 110.606 -179.734 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.471 HG23 ' HB ' ' A' ' 95' ' ' VAL . 1.7 t -162.68 157.86 22.35 Favored 'General case' 0 CA--C 1.493 -1.247 0 CA-C-N 109.188 -3.642 . . . . 0.0 111.742 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.673 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.266 26.4 m95 -83.38 128.09 34.21 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-O 114.743 -2.551 . . . . 0.0 105.295 179.863 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.663 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.2 OUTLIER -81.59 -5.74 58.33 Favored 'General case' 0 CA--C 1.474 -1.955 1 CA-C-O 130.227 4.822 . . . . 0.0 114.223 -179.644 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 105.86 -3.63 38.88 Favored Glycine 0 C--O 1.197 -2.184 1 N-CA-C 103.098 -4.001 . . . . 0.0 103.098 -179.758 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.818 ' HB3' HG21 ' A' ' 2' ' ' THR . 0.2 OUTLIER 179.17 78.68 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.46 0 O-C-N 127.026 2.251 . . . . 0.0 107.568 179.831 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.561 HG22 ' HB2' ' A' ' 90' ' ' GLU . 4.3 t 124.46 163.86 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.361 0 C-N-CA 129.612 3.165 . . . . 0.0 116.944 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.863 HD22 ' CD2' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -103.32 78.15 1.59 Allowed 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 127.641 3.088 . . . . 0.0 116.913 179.989 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.663 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.4 98.7 t -71.55 128.83 35.07 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.254 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.455 ' SG ' HG13 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -125.7 134.61 51.75 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 120.764 1.62 . . . . 0.0 106.668 -179.943 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.9 t -117.64 119.15 60.78 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.475 0 CA-C-O 127.783 3.658 . . . . 0.0 115.413 -179.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.503 ' HG3' ' N ' ' A' ' 106' ' ' GLY 0.301 16.7 mm100 -78.43 98.67 6.11 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 111.49 -2.595 . . . . 0.0 115.736 179.929 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.6 ttmm -85.95 66.98 9.86 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 115.045 -2.662 . . . . 0.0 109.826 179.741 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -108.82 -156.4 17.81 Favored Glycine 0 C--O 1.203 -1.806 0 CA-C-O 126.051 3.028 . . . . 0.0 113.71 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.1 tm-20 -159.0 140.24 13.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 108.266 -3.967 . . . . 0.0 107.752 179.879 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 95.0 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 128.352 2.661 . . . . 0.0 111.737 -179.469 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -157.42 170.31 22.74 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 125.156 2.408 . . . . 0.0 113.401 179.839 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -120.02 95.48 4.78 Favored 'General case' 0 CA--C 1.515 -0.389 1 CA-C-N 106.277 -4.965 . . . . 0.0 104.469 179.973 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.492 ' CA ' ' HG3' ' A' ' 98' ' ' GLN . 5.7 mmm-85 -72.66 -8.48 55.5 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 128.276 3.485 . . . . 0.0 113.969 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.538 ' O ' HG22 ' A' ' 121' ' ' THR . . . -10.7 95.79 0.01 OUTLIER Glycine 0 N--CA 1.431 -1.687 1 O-C-N 133.467 6.729 . . . . 0.0 114.591 179.436 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.989 ' CZ2' HD21 ' A' ' 63' ' ' LEU 0.278 0.0 OUTLIER -116.03 116.15 27.39 Favored 'General case' 0 C--O 1.194 -1.825 0 O-C-N 128.308 3.005 . . . . 0.0 109.235 179.317 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -149.72 170.28 19.09 Favored 'General case' 0 C--O 1.211 -0.957 1 O-C-N 130.353 4.783 . . . . 0.0 112.238 -179.198 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.404 ' HG3' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -132.82 171.82 13.4 Favored 'General case' 0 C--N 1.366 1.285 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.771 179.974 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -176.27 93.83 0.05 Allowed 'General case' 0 C--N 1.311 -1.077 1 O-C-N 131.332 5.395 . . . . 0.0 117.24 179.32 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 49.0 t -39.07 107.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 C-N-CA 126.969 2.108 . . . . 0.0 113.029 179.473 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.23 88.88 3.01 Favored 'General case' 0 CA--C 1.488 -1.433 0 CA-C-N 109.981 -3.281 . . . . 0.0 114.208 -179.966 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.48 -112.97 3.75 Favored Glycine 0 C--O 1.2 -2.023 0 N-CA-C 117.524 1.769 . . . . 0.0 117.524 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -122.57 39.85 3.82 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 125.241 1.417 . . . . 0.0 113.74 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.49 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -178.44 162.53 1.48 Allowed 'General case' 0 C--N 1.313 -1.015 1 O-C-N 130.091 4.619 . . . . 0.0 109.407 -179.767 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.621 HD13 ' CZ2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -92.96 173.21 7.86 Favored 'General case' 0 CA--C 1.482 -1.669 0 O-C-N 128.656 3.722 . . . . 0.0 115.607 -179.617 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -142.42 80.72 1.71 Allowed 'General case' 0 C--N 1.366 1.292 1 CA-C-N 107.74 -4.3 . . . . 0.0 114.27 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.88 87.56 4.72 Favored 'General case' 0 CA--C 1.516 -0.346 1 CA-C-N 107.648 -4.342 . . . . 0.0 108.342 -179.851 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -94.7 124.96 39.04 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 127.955 3.284 . . . . 0.0 106.689 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.673 HD12 ' N ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -136.72 145.55 44.8 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 125.001 1.438 . . . . 0.0 108.875 -179.749 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.673 ' N ' HD12 ' A' ' 120' ' ' LEU . 1.5 t -127.55 174.27 9.19 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 125.227 1.579 . . . . 0.0 108.703 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 36.5 t -169.01 84.57 0.15 Allowed 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 125.052 1.47 . . . . 0.0 112.345 -179.818 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.49 -83.37 1.23 Allowed Glycine 0 N--CA 1.442 -0.934 0 O-C-N 127.993 3.308 . . . . 0.0 112.809 179.885 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -113.04 -20.04 11.66 Favored 'General case' 0 CA--C 1.497 -1.064 0 O-C-N 126.736 2.08 . . . . 0.0 112.082 179.887 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 54.8 mm-40 -91.73 163.65 14.0 Favored 'General case' 0 C--O 1.201 -1.488 0 O-C-N 126.995 2.684 . . . . 0.0 110.435 179.721 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.523 HG13 ' O ' ' A' ' 126' ' ' VAL . 4.6 p -142.8 94.86 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.794 0 CA-C-N 110.006 -3.27 . . . . 0.0 112.077 179.923 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 32.0 m -82.67 135.06 35.13 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-O 117.201 -1.38 . . . . 0.0 112.064 -179.763 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.518 ' C ' ' HB3' ' A' ' 15' ' ' GLU . 1.5 ttp180 -117.93 113.49 21.79 Favored 'General case' 0 CA--C 1.486 -1.492 0 O-C-N 128.276 3.485 . . . . 0.0 115.902 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -88.25 157.52 18.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 115.977 -2.289 . . . . 0.0 112.037 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.5 t -140.13 131.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 N-CA-C 103.01 -2.959 . . . . 0.0 103.01 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.577 ' CD2' ' CB ' ' A' ' 9' ' ' TRP 0.25 4.3 m-30 -119.73 -178.3 3.6 Favored 'General case' 0 CA--C 1.502 -0.89 1 O-C-N 129.247 4.092 . . . . 0.0 113.418 -179.981 . . . . . . . . 4 3 . 1 . 021 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.43 ' HE3' ' HB2' ' A' ' 132' ' ' LYS 0.274 0.0 OUTLIER -167.21 41.56 0.05 OUTLIER 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 114.558 -2.639 . . . . 0.0 104.479 179.516 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.597 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 44.59 -151.87 0.04 OUTLIER 'General case' 0 CA--C 1.49 -1.33 1 O-C-N 131.071 5.232 . . . . 0.0 112.881 -179.387 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.513 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.853 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.673 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 mmt . . . . . 0 N--CA 1.51 2.575 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 96.9 m -158.06 -53.41 0.07 Allowed 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 113.494 -1.685 . . . . 0.0 108.45 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.36 -179.84 8.11 Favored 'General case' 0 CA--C 1.496 -1.108 0 C-N-CA 117.891 -1.523 . . . . 0.0 113.917 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 56.63 77.53 0.25 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.97 98.61 3.2 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 116.17 -2.212 . . . . 0.0 109.426 179.895 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -65.77 153.66 41.2 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 130.242 3.417 . . . . 0.0 110.606 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 169.02 -148.46 12.27 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-O 114.41 -3.439 . . . . 0.0 109.796 -179.904 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.415 HG23 HG21 ' A' ' 40' ' ' THR . 0.4 OUTLIER -158.8 136.8 10.49 Favored 'General case' 0 C--N 1.315 -0.927 1 O-C-N 130.773 4.455 . . . . 0.0 103.695 179.919 . . . . . . . . 4 4 . 1 . 022 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.515 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.8 OUTLIER -120.99 124.84 45.84 Favored 'General case' 0 CA--C 1.495 -1.158 1 O-C-N 131.88 5.738 . . . . 0.0 117.854 -179.765 . . . . . . . . 4 4 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 132' ' ' LYS . 9.3 mt-10 -83.0 109.76 17.38 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 116.546 -2.062 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.278 8.4 ttm -67.69 81.62 0.18 Allowed 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 125.131 1.52 . . . . 0.0 108.266 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -37.42 -48.67 0.96 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.989 2.915 . . . . 0.0 110.187 179.802 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.276 4.0 m -165.8 153.84 10.89 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 108.663 -3.88 . . . . 0.0 110.532 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -105.62 137.93 42.65 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-N 110.31 -3.132 . . . . 0.0 114.293 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.41 -62.48 1.6 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 128.446 3.591 . . . . 0.0 111.562 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.433 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -135.71 138.69 43.0 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 125.623 1.569 . . . . 0.0 108.735 179.803 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 37.0 p90 -123.52 -41.88 2.25 Favored 'General case' 0 C--O 1.207 -1.148 0 CA-C-O 124.502 2.096 . . . . 0.0 112.002 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.574 ' N ' ' CD1' ' A' ' 17' ' ' PHE . 1.8 tm-20 -75.55 -34.06 60.7 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-O 115.065 -2.398 . . . . 0.0 112.216 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.551 ' HA2' ' CG ' ' A' ' 22' ' ' LYS . . . -63.96 -29.65 75.45 Favored Glycine 0 N--CA 1.48 1.578 1 O-C-N 133.469 6.73 . . . . 0.0 111.968 -179.941 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.447 ' CD1' HD21 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -80.05 -43.25 22.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-O 125.935 2.779 . . . . 0.0 109.945 179.716 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.568 ' C ' HG22 ' A' ' 26' ' ' ILE . 19.5 mtt -55.66 -42.95 75.8 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 113.812 -1.54 . . . . 0.0 113.685 -179.579 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.551 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.36 -20.38 59.02 Favored 'General case' 0 C--O 1.213 -0.827 1 O-C-N 129.828 4.455 . . . . 0.0 114.768 179.131 . . . . . . . . 4 4 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -65.44 -42.46 92.4 Favored 'General case' 0 C--O 1.212 -0.897 1 O-C-N 132.304 6.003 . . . . 0.0 113.314 -179.979 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.744 HD12 ' O ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -89.12 -10.62 46.62 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 108.897 -3.774 . . . . 0.0 106.656 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 66.52 72.71 0.37 Allowed 'General case' 0 N--CA 1.436 -1.14 0 C-N-CA 129.805 3.242 . . . . 0.0 112.973 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.568 HG22 ' C ' ' A' ' 21' ' ' MET . 8.2 tp -107.48 13.62 8.32 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-O 128.475 3.988 . . . . 0.0 109.456 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -50.25 100.38 0.02 OUTLIER 'General case' 0 C--N 1.357 0.915 0 CA-C-N 109.696 -3.411 . . . . 0.0 111.148 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -144.12 24.67 1.62 Allowed 'General case' 0 CA--C 1.501 -0.907 0 O-C-N 126.604 2.44 . . . . 0.0 112.263 179.71 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.38 49.88 8.31 Favored 'General case' 0 C--O 1.201 -1.481 0 O-C-N 126.966 2.666 . . . . 0.0 110.018 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.57 -26.77 13.72 Favored 'General case' 0 N--CA 1.48 1.032 2 CA-C-N 105.782 -5.19 . . . . 0.0 110.307 -179.855 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -166.99 0.46 Allowed 'General case' 0 C--N 1.315 -0.918 1 O-C-N 129.83 4.456 . . . . 0.0 109.695 -179.763 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 90.06 -28.06 0.04 OUTLIER 'General case' 0 C--O 1.202 -1.431 1 O-C-N 130.084 4.615 . . . . 0.0 113.676 179.815 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -131.37 8.1 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 O-C-N 127.629 3.081 . . . . 0.0 110.317 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.72 37.08 2.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.102 179.657 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 66.9 t -50.04 -48.75 22.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 126.257 2.223 . . . . 0.0 109.57 179.665 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.561 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 6.8 tpp85 -141.89 144.09 33.64 Favored 'General case' 0 C--O 1.211 -0.938 2 O-C-N 129.908 4.505 . . . . 0.0 108.29 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.637 ' O ' ' N ' ' A' ' 39' ' ' GLN . 1.2 mp -89.02 96.08 10.58 Favored 'General case' 0 C--O 1.209 -1.046 2 O-C-N 132.892 6.37 . . . . 0.0 103.736 177.06 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.689 HG21 ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER 5.23 -51.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 1 O-C-N 137.34 9.15 . . . . 0.0 109.865 -177.879 . . . . . . . . 4 4 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.637 ' N ' ' O ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.72 -166.42 2.52 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 118.96 2.948 . . . . 0.0 118.96 179.658 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.579 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 17.6 m -42.26 149.08 0.17 Allowed 'General case' 0 N--CA 1.426 -1.659 1 C-N-CA 132.782 4.433 . . . . 0.0 115.359 179.293 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.499 ' HD3' ' C ' ' A' ' 41' ' ' LYS 0.289 0.1 OUTLIER -109.28 149.86 28.81 Favored 'General case' 0 N--CA 1.49 1.529 2 O-C-N 131.27 5.356 . . . . 0.0 101.421 178.185 . . . . . . . . 5 4 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.527 ' HB ' ' O ' ' A' ' 53' ' ' LYS . 2.3 mp -127.02 163.14 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 125.102 1.501 . . . . 0.0 111.534 179.342 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.496 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -132.77 143.16 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 CA-C-N 111.181 -2.736 . . . . 0.0 109.568 179.615 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.265 86.9 t -151.77 118.12 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 116.612 -2.035 . . . . 0.0 111.286 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.504 ' HG2' ' CD1' ' A' ' 50' ' ' PHE . 36.9 mt-30 -118.62 111.56 18.71 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -100.32 26.53 6.49 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 128.856 3.847 . . . . 0.0 111.37 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 109.51 -121.59 6.15 Favored Glycine 0 C--O 1.213 -1.156 0 O-C-N 120.844 -1.16 . . . . 0.0 115.345 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -59.69 -27.25 66.27 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 117.469 -1.692 . . . . 0.0 113.883 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -100.79 109.99 22.03 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 128.855 3.847 . . . . 0.0 110.593 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.541 ' C ' ' CD1' ' A' ' 50' ' ' PHE . 0.5 OUTLIER -113.61 111.95 22.7 Favored 'General case' 0 C--N 1.311 -1.088 1 O-C-N 129.119 4.012 . . . . 0.0 110.78 179.9 . . . . . . . . 4 4 . 1 . 022 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -123.48 102.28 7.79 Favored 'General case' 0 C--O 1.196 -1.754 1 O-C-N 129.473 4.233 . . . . 0.0 117.8 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.518 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.3 160.71 28.64 Favored 'General case' 0 N--CA 1.473 0.676 1 O-C-N 130.256 4.722 . . . . 0.0 106.176 179.172 . . . . . . . . 4 4 . 1 . 022 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.527 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -166.16 146.56 6.38 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 179.738 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.488 ' HA ' HD12 ' A' ' 42' ' ' ILE . 9.8 t -111.64 162.91 14.68 Favored 'General case' 0 C--N 1.31 -1.131 0 O-C-N 126.707 2.504 . . . . 0.0 113.406 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.515 ' HB2' HD11 ' A' ' 42' ' ' ILE . 1.7 t-20 -106.8 -12.42 15.51 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 115.622 -2.132 . . . . 0.0 112.287 -179.764 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.484 ' HB2' HD23 ' A' ' 37' ' ' LEU . 98.8 p -23.61 120.36 0.04 OUTLIER 'General case' 0 CA--C 1.509 -0.63 1 O-C-N 131.634 5.584 . . . . 0.0 107.687 178.409 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.689 ' HB ' HG21 ' A' ' 38' ' ' THR . 0.6 OUTLIER -51.31 -31.3 21.09 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 128.031 3.332 . . . . 0.0 107.472 179.816 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.5 ' CG ' ' HG ' ' A' ' 37' ' ' LEU . 13.6 m-85 -57.09 -73.45 0.07 Allowed 'General case' 0 C--N 1.351 0.658 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 179.931 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.406 ' NH1' HD21 ' A' ' 37' ' ' LEU . 0.6 OUTLIER -155.78 129.93 8.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 113.415 -1.721 . . . . 0.0 111.084 -179.655 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -105.53 54.75 0.7 Allowed 'General case' 0 C--O 1.211 -0.942 0 O-C-N 127.82 3.2 . . . . 0.0 111.992 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -75.02 73.93 2.2 Favored 'General case' 0 N--CA 1.47 0.556 1 O-C-N 129.766 4.416 . . . . 0.0 106.85 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.435 ' HA ' ' HA ' ' A' ' 53' ' ' LYS . 5.0 p30 -45.54 114.22 0.72 Allowed 'General case' 0 C--O 1.202 -1.412 0 O-C-N 128.379 3.549 . . . . 0.0 116.05 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.568 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 4.0 tp -65.86 79.69 0.08 Allowed 'General case' 0 C--O 1.214 -0.791 1 O-C-N 129.65 4.344 . . . . 0.0 110.579 179.32 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.413 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 5.7 m-20 -111.01 96.95 6.46 Favored 'General case' 0 CA--C 1.486 -1.483 0 C-N-CA 115.917 -2.313 . . . . 0.0 113.568 -178.348 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.568 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -130.12 -176.05 3.82 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 125.875 2.75 . . . . 0.0 106.5 178.665 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.645 HG22 HG23 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -137.33 156.01 48.74 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.421 ' HA ' ' CG1' ' A' ' 87' ' ' VAL . 20.5 t -64.5 149.26 11.24 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.203 0 O-C-N 128.923 3.889 . . . . 0.0 115.515 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 32.53 31.93 0.01 OUTLIER Glycine 0 N--CA 1.468 0.803 1 O-C-N 130.445 4.841 . . . . 0.0 117.359 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.645 HG23 HG22 ' A' ' 66' ' ' THR . 0.9 OUTLIER -91.14 -16.38 8.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.609 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 68.03 90.91 0.09 Allowed 'General case' 0 C--N 1.355 0.816 1 O-C-N 129.121 4.013 . . . . 0.0 109.787 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.522 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.1 OUTLIER -80.46 82.22 6.54 Favored 'General case' 0 CA--C 1.494 -1.194 0 O-C-N 127.13 2.769 . . . . 0.0 114.882 179.834 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.04 88.58 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 113.618 -1.628 . . . . 0.0 111.33 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.467 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 60.8 161.76 0.06 Allowed 'General case' 0 C--O 1.209 -1.055 0 C-N-CA 126.638 1.975 . . . . 0.0 112.821 179.994 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 149.8 73.58 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 128.387 3.554 . . . . 0.0 113.983 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.295 0.8 OUTLIER -132.3 97.27 4.07 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 116.072 -1.918 . . . . 0.0 109.504 179.931 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -151.01 124.62 9.03 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 128.684 3.74 . . . . 0.0 111.776 179.396 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.44 -41.09 1.89 Allowed Glycine 0 C--O 1.216 -1.027 0 CA-C-N 109.717 -3.401 . . . . 0.0 112.889 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.744 ' O ' HD12 ' A' ' 24' ' ' LEU . 6.1 tp -106.01 -9.45 17.05 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 129.619 3.776 . . . . 0.0 114.629 -179.851 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.527 ' OD2' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -149.18 -62.74 0.23 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.824 -179.85 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.75 52.18 3.59 Favored Glycine 0 C--O 1.214 -1.132 0 CA-C-O 126.442 3.246 . . . . 0.0 112.611 -179.91 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.98 -156.86 0.71 Allowed 'General case' 0 C--N 1.354 0.792 0 CA-C-N 110.616 -2.792 . . . . 0.0 113.847 -179.773 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.467 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -151.92 109.58 3.63 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.805 1.288 . . . . 0.0 107.88 178.265 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.859 HG11 ' HB3' ' A' ' 98' ' ' GLN . 72.6 t -140.48 127.78 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.524 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -176.811 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -59.79 88.28 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 112.467 -2.152 . . . . 0.0 109.608 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.522 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 52.5 m -85.88 67.22 9.95 Favored 'General case' 0 C--O 1.196 -1.711 0 O-C-N 128.504 3.628 . . . . 0.0 116.214 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.476 HD21 ' OG1' ' A' ' 88' ' ' THR . 1.2 tt -58.59 146.97 34.01 Favored 'General case' 0 C--O 1.211 -0.925 1 CA-C-N 107.713 -4.312 . . . . 0.0 115.73 -179.744 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.464 ' N ' ' HG ' ' A' ' 86' ' ' LEU . 59.7 t -130.54 132.4 64.55 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.29 0 C-N-CA 127.499 2.32 . . . . 0.0 107.268 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.672 HG22 ' H ' ' A' ' 89' ' ' TRP 0.358 27.8 m -142.57 -156.62 0.7 Allowed 'General case' 0 CA--C 1.48 -1.729 0 CA-C-N 112.698 -2.046 . . . . 0.0 105.698 -179.554 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.705 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.279 10.9 m95 -154.18 143.51 21.38 Favored 'General case' 0 CA--C 1.51 -0.595 0 O-C-N 118.349 -2.72 . . . . 0.0 105.492 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -111.21 -146.38 0.41 Allowed 'General case' 0 CA--C 1.483 -1.605 0 O-C-N 126.583 2.427 . . . . 0.0 111.268 179.39 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -74.28 -30.93 59.92 Favored Glycine 0 N--CA 1.487 2.072 1 N-CA-C 101.144 -4.782 . . . . 0.0 101.144 179.741 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.29 69.3 0.18 Allowed 'General case' 0 C--O 1.197 -1.695 1 O-C-N 133.2 5.883 . . . . 0.0 111.625 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.645 ' O ' ' N ' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.94 133.09 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 119.395 3.109 . . . . 0.0 119.395 178.049 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.954 HD21 ' HG2' ' A' ' 109' ' ' GLN . 0.5 OUTLIER -61.06 10.84 0.02 OUTLIER 'General case' 0 CA--C 1.478 -1.807 0 N-CA-C 120.246 3.424 . . . . 0.0 120.246 -178.293 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.0 t 3.92 114.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.482 -1.656 0 N-CA-C 119.318 3.081 . . . . 0.0 119.318 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.432 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 7.0 p -132.94 140.39 47.81 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 124.847 2.26 . . . . 0.0 108.313 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.421 ' O ' ' N ' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -135.32 80.75 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 CA-C-N 110.013 -3.267 . . . . 0.0 116.533 179.794 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.859 ' HB3' HG11 ' A' ' 83' ' ' VAL . 10.8 mt-30 -50.21 93.8 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 123.937 1.827 . . . . 0.0 108.358 -179.942 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.574 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -88.98 106.7 18.6 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 109.258 -3.61 . . . . 0.0 111.395 -179.767 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.434 ' CA ' HG22 ' A' ' 83' ' ' VAL . . . -105.57 -83.98 1.7 Allowed Glycine 0 C--O 1.197 -2.188 1 CA-C-O 127.9 4.056 . . . . 0.0 110.141 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -176.4 -54.2 0.01 OUTLIER 'General case' 0 C--N 1.355 0.819 1 CA-C-N 107.051 -4.575 . . . . 0.0 112.765 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -87.25 -52.62 5.29 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 125.971 2.796 . . . . 0.0 115.666 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -102.28 158.76 15.96 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 110.362 -3.108 . . . . 0.0 116.424 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -117.2 85.08 2.26 Favored 'General case' 0 N--CA 1.49 1.565 1 CA-C-N 107.309 -4.496 . . . . 0.0 102.158 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.488 ' HB3' ' CZ ' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -79.13 7.4 7.57 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 126.366 2.291 . . . . 0.0 115.921 -179.188 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 120' ' ' LEU . . . -49.75 131.62 27.27 Favored Glycine 0 C--O 1.204 -1.756 1 O-C-N 129.372 4.17 . . . . 0.0 110.582 179.25 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.551 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE . 6.5 p90 -117.17 8.78 13.34 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 129.723 3.837 . . . . 0.0 119.387 -179.593 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -28.47 142.81 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 1 CA-C-N 108.26 -4.064 . . . . 0.0 112.757 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.954 ' HG2' HD21 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -123.16 148.65 45.52 Favored 'General case' 0 C--N 1.362 1.127 0 CA-C-O 113.709 -3.043 . . . . 0.0 108.954 179.876 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -145.64 84.6 1.68 Allowed 'General case' 0 C--N 1.303 -1.44 1 O-C-N 132.097 5.873 . . . . 0.0 115.066 179.59 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.468 ' O ' HG12 ' A' ' 111' ' ' VAL . 18.5 t -22.75 104.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.491 -1.311 0 C-N-CA 126.671 1.988 . . . . 0.0 115.802 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -134.85 153.77 51.91 Favored 'General case' 0 CA--C 1.481 -1.678 0 CA-C-N 111.137 -2.756 . . . . 0.0 118.183 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 50.29 -93.14 0.01 OUTLIER Glycine 0 C--O 1.198 -2.1 0 CA-C-O 123.599 1.666 . . . . 0.0 113.813 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -147.63 31.86 0.88 Allowed 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.18 -169.23 2.86 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 128.164 3.415 . . . . 0.0 111.189 -179.611 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' A' ' 116' ' ' LEU . 37.1 tp -128.62 88.06 2.68 Favored 'General case' 0 C--O 1.201 -1.493 0 CA-C-O 127.226 3.393 . . . . 0.0 111.435 179.795 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -44.86 97.11 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.731 1 CA-C-N 107.823 -4.262 . . . . 0.0 117.383 -179.177 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.408 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -78.87 120.63 23.76 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 113.545 -3.121 . . . . 0.0 105.403 178.26 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -134.13 85.63 2.21 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 126.923 2.639 . . . . 0.0 106.682 -178.825 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 106' ' ' GLY . 0.1 OUTLIER -98.48 148.04 24.14 Favored 'General case' 0 CA--C 1.483 -1.61 1 O-C-N 129.757 4.41 . . . . 0.0 108.857 -179.956 . . . . . . . . 4 4 . 1 . 022 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -110.09 160.54 16.37 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 111.429 -2.623 . . . . 0.0 105.135 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.603 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -159.96 47.24 0.26 Allowed 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 125.899 2.761 . . . . 0.0 112.275 179.845 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.13 -98.33 1.96 Allowed Glycine 0 N--CA 1.438 -1.195 0 CA-C-N 111.739 -2.482 . . . . 0.0 110.709 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -83.61 -29.61 27.6 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 109.305 -3.448 . . . . 0.0 111.026 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -103.15 160.45 14.64 Favored 'General case' 0 C--O 1.207 -1.174 0 O-C-N 127.531 3.02 . . . . 0.0 109.75 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.57 101.14 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.5 -0.97 1 CA-C-N 108.303 -4.044 . . . . 0.0 112.327 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.2 m -79.67 149.7 31.16 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 113.307 -1.769 . . . . 0.0 109.726 179.789 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -140.58 76.14 1.54 Allowed 'General case' 0 N--CA 1.476 0.866 0 O-C-N 127.74 3.15 . . . . 0.0 110.491 179.953 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.86 176.1 0.58 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 117.747 -1.581 . . . . 0.0 114.501 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.259 83.9 t -149.64 87.55 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.563 0 CA-C-O 125.037 2.351 . . . . 0.0 105.624 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 3.4 m-85 -70.57 -178.67 1.86 Allowed 'General case' 0 CA--C 1.486 -1.496 0 CA-C-N 109.015 -3.72 . . . . 0.0 117.625 -179.991 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 10' ' ' GLU . 0.8 OUTLIER -163.96 117.01 1.43 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 111.461 -2.609 . . . . 0.0 108.067 -179.907 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.648 ' HD3' ' C ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -56.14 49.85 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 119.918 3.303 . . . . 0.0 119.918 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.424 ' CB ' ' O ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.788 0 CA-C-O 113.062 -3.351 . . . . 0.0 118.352 -178.697 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mtp . . . . . 0 N--CA 1.501 2.11 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.1 m -70.58 -23.71 62.64 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 179.867 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm -102.47 10.87 38.65 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 -179.962 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -96.82 84.45 3.6 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 116.577 -1.678 . . . . 0.0 107.284 -179.853 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.438 ' HG3' HG11 ' A' ' 111' ' ' VAL . 1.3 tm0? -117.79 145.85 44.24 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 103.85 -2.648 . . . . 0.0 103.85 -179.893 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -154.54 149.35 26.61 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 129.43 3.092 . . . . 0.0 110.933 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.64 -173.56 44.09 Favored Glycine 0 C--O 1.21 -1.349 0 CA-C-O 116.15 -2.472 . . . . 0.0 110.722 179.788 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.687 HG22 ' HG2' ' A' ' 134' ' ' LYS . 5.6 t -139.29 22.2 2.57 Favored 'General case' 0 C--O 1.208 -1.114 0 O-C-N 129.859 3.917 . . . . 0.0 109.83 179.858 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.628 ' HB2' ' CD1' ' A' ' 131' ' ' PHE 0.291 0.0 OUTLIER -23.66 124.45 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.443 1 O-C-N 133.768 6.917 . . . . 0.0 112.081 179.552 . . . . . . . . 5 4 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -74.09 -3.21 28.11 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -179.172 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.516 ' HG3' HG21 ' A' ' 130' ' ' VAL 0.313 1.0 OUTLIER 49.59 35.97 9.56 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 114.074 -2.87 . . . . 0.0 103.269 179.707 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.484 ' HB2' ' HB2' ' A' ' 132' ' ' LYS . 4.8 tt0 -26.77 -46.92 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.256 2 O-C-N 132.542 6.152 . . . . 0.0 113.919 -178.876 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.689 ' O ' HG12 ' A' ' 130' ' ' VAL . 3.2 t -121.72 -152.22 0.5 Allowed 'General case' 0 C--O 1.245 0.817 0 C-N-CA 117.894 -1.522 . . . . 0.0 112.312 -178.522 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.802 ' HB2' HG12 ' A' ' 130' ' ' VAL . 2.4 t-20 157.34 136.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 O-C-N 125.371 1.669 . . . . 0.0 111.797 179.437 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.573 ' HB2' ' HB3' ' A' ' 128' ' ' ARG . 8.5 mm-40 -91.71 -70.16 0.7 Allowed 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 127.795 3.184 . . . . 0.0 108.16 179.505 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -96.15 157.74 15.76 Favored 'General case' 0 C--O 1.202 -1.413 0 O-C-N 120.812 -1.18 . . . . 0.0 112.872 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -149.01 -48.39 0.15 Allowed 'General case' 0 C--O 1.22 -0.49 0 O-C-N 125.257 1.598 . . . . 0.0 111.284 -179.942 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.474 ' CG ' ' HB2' ' A' ' 31' ' ' ARG . 1.3 mt-10 -67.58 -45.69 74.83 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 111.924 -2.398 . . . . 0.0 115.848 179.782 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.23 -22.92 65.76 Favored Glycine 0 N--CA 1.483 1.77 0 O-C-N 129.1 4.0 . . . . 0.0 111.345 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.524 ' CD1' HD21 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -78.78 -43.67 24.96 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-O 124.962 2.315 . . . . 0.0 107.666 179.992 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 17.8 mtt -66.42 -33.08 74.9 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.69 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -73.4 -25.54 60.59 Favored 'General case' 0 C--O 1.214 -0.773 0 O-C-N 128.053 3.346 . . . . 0.0 114.436 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.34 -52.49 32.77 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.968 3.918 . . . . 0.0 111.029 179.923 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.524 HD21 ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -86.18 -6.39 59.0 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 110.056 -3.247 . . . . 0.0 108.633 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 39.64 73.91 0.11 Allowed 'General case' 0 CA--C 1.484 -1.566 0 O-C-N 127.653 3.095 . . . . 0.0 108.115 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.643 ' CD1' HD12 ' A' ' 78' ' ' LEU . 10.8 tt -65.68 -26.34 38.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.029 1 CA-C-N 108.191 -4.095 . . . . 0.0 109.069 -179.964 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.447 ' OD1' HG23 ' A' ' 26' ' ' ILE . 21.9 p-10 145.97 134.58 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 111.277 -2.692 . . . . 0.0 109.208 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.442 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.3 OUTLIER -94.45 87.61 5.22 Favored 'General case' 0 N--CA 1.483 1.182 1 O-C-N 129.913 4.508 . . . . 0.0 108.477 179.358 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 28' ' ' PHE . . . 150.31 65.84 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 1 O-C-N 129.493 4.246 . . . . 0.0 104.229 -179.363 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.557 ' O ' HG22 ' A' ' 30' ' ' THR . 2.8 m 142.28 66.58 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.247 2 O-C-N 132.815 6.322 . . . . 0.0 109.009 -179.894 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HB2' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -138.08 -56.24 0.66 Allowed 'General case' 0 N--CA 1.447 -0.61 2 O-C-N 130.254 4.721 . . . . 0.0 108.987 -179.711 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.567 ' C ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -88.44 1.27 55.11 Favored 'General case' 0 C--O 1.205 -1.255 0 O-C-N 127.156 2.785 . . . . 0.0 113.715 179.886 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.657 ' N ' HD12 ' A' ' 33' ' ' ILE . 1.7 mp -108.23 -47.63 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 2 O-C-N 129.394 4.184 . . . . 0.0 114.681 -179.621 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.476 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -54.73 -44.42 73.53 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 122.491 1.139 . . . . 0.0 113.214 179.807 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.421 HG12 ' N ' ' A' ' 36' ' ' ARG . 78.4 t 25.81 -74.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.204 -1.342 0 CA-C-N 110.388 -3.096 . . . . 0.0 115.123 -179.806 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 34' ' ' ALA . 2.8 tmm_? -176.3 100.56 0.06 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.683 -1.599 . . . . 0.0 111.012 179.856 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.646 HD23 ' CE2' ' A' ' 58' ' ' PHE . 0.8 OUTLIER -94.84 -0.6 53.94 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 129.05 3.969 . . . . 0.0 110.59 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.524 ' N ' HD12 ' A' ' 37' ' ' LEU . 16.6 m 133.84 88.33 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.752 1 O-C-N 132.964 6.415 . . . . 0.0 111.503 -179.662 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.468 ' HG3' ' HG2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -88.25 -179.05 6.06 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 116.288 -2.165 . . . . 0.0 115.581 -179.584 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.6 m -178.6 137.39 0.16 Allowed 'General case' 0 N--CA 1.431 -1.384 1 O-C-N 129.913 4.508 . . . . 0.0 112.498 179.583 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.586 ' HD2' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -122.54 157.13 32.73 Favored 'General case' 0 N--CA 1.489 1.494 1 O-C-N 129.321 4.138 . . . . 0.0 102.523 179.694 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.51 ' N ' ' O ' ' A' ' 53' ' ' LYS . 6.7 mt -149.82 104.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.433 0 O-C-N 127.547 3.03 . . . . 0.0 112.287 -178.76 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.403 ' CD1' ' CE1' ' A' ' 50' ' ' PHE 0.258 0.1 OUTLIER -83.39 135.4 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 2 CA-C-N 106.444 -4.889 . . . . 0.0 110.525 -179.855 . . . . . . . . 5 4 . 1 . 023 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -143.95 96.58 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 CA-C-N 111.77 -2.468 . . . . 0.0 116.419 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.479 ' HG2' ' HB2' ' A' ' 50' ' ' PHE . 36.5 mt-30 -94.84 126.73 40.35 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.154 179.211 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -132.83 31.85 3.88 Favored 'General case' 0 CA--C 1.49 -1.328 1 O-C-N 130.373 4.795 . . . . 0.0 111.99 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.85 120.36 0.66 Allowed Glycine 0 C--O 1.204 -1.764 0 O-C-N 126.061 2.101 . . . . 0.0 112.685 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 70.43 -69.69 0.17 Allowed 'General case' 0 C--O 1.212 -0.869 0 CA-C-O 116.683 -1.627 . . . . 0.0 112.015 179.854 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.2 m-20 -95.91 114.14 25.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 128.074 3.359 . . . . 0.0 111.493 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.622 ' CD2' HD13 ' A' ' 94' ' ' LEU . 3.0 t80 -115.39 139.98 49.53 Favored 'General case' 0 CA--C 1.489 -1.385 1 O-C-N 129.52 4.262 . . . . 0.0 114.968 -179.806 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.522 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 67.5 mttt -144.86 102.19 3.75 Favored 'General case' 0 CA--C 1.489 -1.378 0 N-CA-C 118.952 2.945 . . . . 0.0 118.952 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.775 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.29 160.96 28.35 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 128.652 3.72 . . . . 0.0 105.67 178.449 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 42' ' ' ILE 0.25 0.0 OUTLIER -158.03 127.4 5.82 Favored 'General case' 0 CA--C 1.482 -1.669 1 O-C-N 130.449 4.843 . . . . 0.0 112.08 -175.681 . . . . . . . . 5 4 . 1 . 023 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.408 HG22 ' N ' ' A' ' 61' ' ' TYR 0.283 0.4 OUTLIER -94.88 147.65 23.14 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 124.277 1.989 . . . . 0.0 112.853 179.708 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -132.36 59.33 1.72 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 110.282 -3.145 . . . . 0.0 116.958 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 m -93.85 -176.39 4.02 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 130.695 3.598 . . . . 0.0 106.214 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.501 ' HB ' HD21 ' A' ' 37' ' ' LEU . 92.2 m -113.27 -50.39 2.87 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 128.902 3.876 . . . . 0.0 107.659 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.646 ' CE2' HD23 ' A' ' 37' ' ' LEU . 9.0 m-85 -50.06 -57.36 7.79 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 128.579 3.675 . . . . 0.0 110.368 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -154.34 105.82 2.71 Favored 'General case' 0 C--O 1.213 -0.836 1 O-C-N 130.812 5.07 . . . . 0.0 114.112 -179.729 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -86.63 80.84 8.45 Favored 'General case' 0 C--O 1.205 -1.276 1 O-C-N 130.563 4.915 . . . . 0.0 112.066 -179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.408 ' N ' HG22 ' A' ' 54' ' ' THR . 5.5 t80 -68.06 166.86 15.11 Favored 'General case' 0 C--O 1.219 -0.521 0 O-C-N 128.79 3.806 . . . . 0.0 107.174 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -140.2 89.37 2.29 Favored 'General case' 0 C--O 1.207 -1.145 1 O-C-N 129.819 4.45 . . . . 0.0 113.014 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.775 ' HB2' HG22 ' A' ' 52' ' ' THR . 4.6 tp -72.85 64.35 0.67 Allowed 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.62 -1.627 . . . . 0.0 112.4 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.516 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 2.9 t0 -95.5 104.9 16.82 Favored 'General case' 0 C--O 1.21 -0.983 0 CA-C-N 112.636 -2.075 . . . . 0.0 105.551 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.506 ' HB3' HG21 ' A' ' 87' ' ' VAL . 9.6 m-85 -123.03 -178.48 3.97 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.354 2.262 . . . . 0.0 110.716 179.824 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.458 ' CG2' HG23 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -150.68 133.3 15.73 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 179.34 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.56 HG21 ' HE1' ' A' ' 89' ' ' TRP . 54.8 t -52.75 137.77 12.36 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 O-C-N 126.994 2.684 . . . . 0.0 114.973 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 33.12 45.23 0.26 Allowed Glycine 0 N--CA 1.468 0.831 1 O-C-N 130.969 5.168 . . . . 0.0 117.363 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.458 HG23 ' CG2' ' A' ' 66' ' ' THR 0.319 0.4 OUTLIER -88.72 -14.04 9.58 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.62 179.928 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 65.41 71.33 0.44 Allowed 'General case' 0 C--N 1.364 1.235 1 O-C-N 129.568 4.293 . . . . 0.0 109.547 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -65.46 72.22 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.86 2 O-C-N 130.835 5.085 . . . . 0.0 112.763 -179.805 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.43 101.72 0.05 OUTLIER 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 113.127 -1.851 . . . . 0.0 115.427 179.784 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.488 ' HG3' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 63.07 -164.26 0.26 Allowed 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 123.694 1.712 . . . . 0.0 113.224 179.328 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 75.28 88.23 0.09 Allowed 'General case' 0 C--O 1.203 -1.378 0 CA-C-N 109.086 -3.688 . . . . 0.0 113.411 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.26 72.8 p -116.67 -8.38 11.45 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 111.132 -2.758 . . . . 0.0 116.1 -179.74 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.36 151.67 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.925 1 O-C-N 129.214 4.071 . . . . 0.0 116.411 -179.684 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.19 -55.04 4.93 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 110.165 -3.198 . . . . 0.0 113.565 179.712 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.643 HD12 ' CD1' ' A' ' 26' ' ' ILE . 12.9 tp -80.93 -47.88 13.09 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.017 2.834 . . . . 0.0 113.158 179.911 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -112.56 -58.97 2.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 125.772 2.701 . . . . 0.0 112.142 179.847 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.59 49.6 5.69 Favored Glycine 0 C--O 1.207 -1.593 0 CA-C-N 111.748 -2.478 . . . . 0.0 111.968 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.44 ' CG ' ' N ' ' A' ' 82' ' ' ASN . 2.0 ttm-85 -121.04 -104.58 0.39 Allowed 'General case' 0 C--N 1.366 1.315 0 CA-C-N 109.968 -3.116 . . . . 0.0 114.644 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.488 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 6.5 m-20 156.02 103.31 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.836 0 O-C-N 125.729 1.893 . . . . 0.0 108.341 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.579 HG13 ' HA3' ' A' ' 100' ' ' GLY . 1.5 t -153.72 145.31 14.47 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.372 0 O-C-N 126.852 2.595 . . . . 0.0 117.267 -179.332 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -56.17 161.24 2.53 Favored 'General case' 0 C--O 1.235 0.335 1 O-C-N 129.455 4.222 . . . . 0.0 106.87 178.791 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.2 m -161.28 95.23 1.02 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-O 126.389 2.995 . . . . 0.0 110.77 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tp -101.7 111.76 24.12 Favored 'General case' 0 N--CA 1.429 -1.483 1 CA-C-N 108.106 -4.134 . . . . 0.0 116.993 -179.176 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.506 HG21 ' HB3' ' A' ' 65' ' ' PHE . 81.0 t -82.5 144.48 10.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 179.272 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.423 ' CG2' ' N ' ' A' ' 89' ' ' TRP 0.315 1.1 m -162.17 168.75 21.97 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-O 126.734 3.159 . . . . 0.0 110.732 -179.774 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.729 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 56.4 m95 -98.17 139.4 34.02 Favored 'General case' 0 C--N 1.361 1.078 0 CA-C-O 114.755 -2.545 . . . . 0.0 106.658 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.667 ' HB2' HG22 ' A' ' 93' ' ' THR . 0.0 OUTLIER -85.53 -49.49 8.01 Favored 'General case' 0 CA--C 1.483 -1.609 1 CA-C-O 132.231 5.777 . . . . 0.0 112.41 179.797 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -170.56 -56.4 0.04 OUTLIER Glycine 0 C--O 1.213 -1.189 1 CA-C-N 108.119 -4.128 . . . . 0.0 103.285 -179.763 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -141.38 49.37 1.63 Allowed 'General case' 0 N--CA 1.444 -0.731 1 O-C-N 131.949 5.147 . . . . 0.0 109.694 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.667 HG22 ' HB2' ' A' ' 90' ' ' GLU . 1.1 t -176.45 155.99 1.48 Allowed 'General case' 0 C--O 1.203 -1.385 0 N-CA-C 118.063 2.616 . . . . 0.0 118.063 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.622 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -85.6 98.83 10.87 Favored 'General case' 0 CA--C 1.487 -1.47 0 O-C-N 127.907 3.254 . . . . 0.0 115.168 -179.798 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.497 HG13 ' HE2' ' A' ' 108' ' ' LYS . 49.9 t -99.68 120.96 49.78 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.377 0 CA-C-N 110.897 -2.865 . . . . 0.0 114.017 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.588 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 12.1 m -132.5 134.26 44.8 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 103.373 -2.825 . . . . 0.0 103.373 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -120.1 116.3 49.96 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 108.715 -3.857 . . . . 0.0 119.268 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.99 109.26 19.69 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-N 112.459 -2.155 . . . . 0.0 107.436 179.556 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.12 116.18 27.98 Favored 'General case' 0 C--O 1.195 -1.773 0 O-C-N 128.05 3.344 . . . . 0.0 113.619 -179.017 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.579 ' HA3' HG13 ' A' ' 83' ' ' VAL . . . 172.41 176.5 41.19 Favored Glycine 0 C--O 1.199 -2.062 0 CA-C-N 113.172 -1.831 . . . . 0.0 112.402 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.404 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 4.5 tt0 3.45 -61.15 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.275 2 O-C-N 130.996 4.586 . . . . 0.0 114.537 179.645 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER -149.51 -37.21 0.16 Allowed 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 179.474 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -52.19 124.39 12.98 Favored 'General case' 0 N--CA 1.441 -0.918 0 O-C-N 126.544 2.403 . . . . 0.0 116.349 -179.771 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -112.02 67.97 0.66 Allowed 'General case' 0 N--CA 1.484 1.268 2 O-C-N 130.039 4.587 . . . . 0.0 102.148 179.781 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.461 ' HD2' ' HA ' ' A' ' 105' ' ' ARG . 23.5 mmm-85 -94.84 36.73 1.17 Allowed 'General case' 0 C--O 1.203 -1.364 1 O-C-N 129.321 4.138 . . . . 0.0 110.167 179.772 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -77.58 67.82 2.81 Favored Glycine 0 N--CA 1.445 -0.759 0 O-C-N 128.297 3.498 . . . . 0.0 111.445 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.588 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -80.98 141.65 34.22 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 129.699 3.823 . . . . 0.0 110.553 179.397 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.497 ' HE2' HG13 ' A' ' 95' ' ' VAL . 3.0 ptpt -164.61 165.78 20.76 Favored 'General case' 0 N--CA 1.443 -0.786 1 O-C-N 129.265 4.103 . . . . 0.0 114.159 -178.728 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -116.28 175.27 5.63 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 109.729 -3.396 . . . . 0.0 106.415 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.471 ' C ' HG23 ' A' ' 111' ' ' VAL . 15.0 m95 -125.78 -56.24 1.48 Allowed 'General case' 0 C--N 1.306 -1.311 1 O-C-N 130.659 4.974 . . . . 0.0 116.242 179.713 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.506 ' HA ' ' HB3' ' A' ' 116' ' ' LEU . 4.9 t 78.31 44.27 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-O 127.453 3.501 . . . . 0.0 108.485 -176.06 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.603 ' HG3' ' CZ ' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -103.07 129.88 50.03 Favored 'General case' 0 CA--C 1.477 -1.841 1 CA-C-N 107.081 -4.6 . . . . 0.0 110.823 -178.388 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 113' ' ' GLY . . . . . 0.423 ' O ' ' NZ ' ' A' ' 115' ' ' LYS . . . 48.14 67.42 1.61 Allowed Glycine 0 C--O 1.194 -2.352 0 C-N-CA 125.026 1.298 . . . . 0.0 115.711 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 72.67 -43.4 0.56 Allowed 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 129.027 2.931 . . . . 0.0 118.679 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.513 ' HG3' ' CD1' ' A' ' 117' ' ' TYR . 4.6 ptpp? -100.78 -174.91 2.74 Favored 'General case' 0 C--N 1.312 -1.062 0 O-C-N 128.831 3.832 . . . . 0.0 108.064 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.638 HD12 ' CG ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -138.09 62.24 1.57 Allowed 'General case' 0 C--O 1.194 -1.838 0 O-C-N 126.914 2.634 . . . . 0.0 108.672 178.928 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.776 ' HB3' ' HB3' ' A' ' 129' ' ' GLN . 0.0 OUTLIER -32.27 131.81 0.14 Allowed 'General case' 0 C--N 1.365 1.258 1 O-C-N 130.521 4.888 . . . . 0.0 116.005 -177.093 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.631 ' HB2' ' CE2' ' A' ' 131' ' ' PHE . 0.7 OUTLIER -87.83 65.84 8.53 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 128.661 3.726 . . . . 0.0 111.628 -178.87 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -77.8 122.5 25.5 Favored 'General case' 0 CA--C 1.485 -1.541 0 O-C-N 127.692 3.12 . . . . 0.0 108.014 -179.629 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 121' ' ' THR . 0.9 OUTLIER -146.15 -179.79 6.97 Favored 'General case' 0 CA--C 1.486 -1.512 0 C-N-CA 117.213 -1.795 . . . . 0.0 114.092 -179.791 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.479 ' O ' HD12 ' A' ' 120' ' ' LEU . 44.8 m -128.36 160.89 30.8 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . 0.263 0.3 OUTLIER -173.6 107.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.953 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 12.12 76.9 0.01 OUTLIER Glycine 0 C--O 1.218 -0.849 1 O-C-N 129.896 4.498 . . . . 0.0 114.725 179.593 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 38.9 m-20 101.15 -53.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.391 0 O-C-N 129.048 3.44 . . . . 0.0 111.032 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -77.35 171.06 15.45 Favored 'General case' 0 C--O 1.2 -1.543 1 O-C-N 130.611 4.944 . . . . 0.0 110.323 -179.8 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.1 m -145.17 102.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 1 CA-C-N 107.28 -4.509 . . . . 0.0 111.31 179.454 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.45 175.18 1.43 Allowed 'General case' 0 CA--C 1.494 -1.208 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 -179.625 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.573 ' HB3' ' HB2' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -142.04 64.63 1.38 Allowed 'General case' 0 C--N 1.346 0.446 0 C-N-CA 114.165 -3.014 . . . . 0.0 116.679 179.647 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.776 ' HB3' ' HB3' ' A' ' 117' ' ' TYR . 8.9 mt-30 57.24 -169.09 0.11 Allowed 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 120.815 3.635 . . . . 0.0 120.815 175.616 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 14' ' ' ASN 0.256 1.5 m -173.5 -46.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 O-C-N 126.568 2.418 . . . . 0.0 113.448 -178.775 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.638 ' CG ' HD12 ' A' ' 116' ' ' LEU . 43.7 m-85 -29.94 158.94 0.0 OUTLIER 'General case' 0 CA--C 1.477 -1.853 0 N-CA-C 120.929 3.677 . . . . 0.0 120.929 -174.913 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 12' ' ' GLU 0.338 0.0 OUTLIER -169.46 108.67 0.42 Allowed 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 108.729 -3.85 . . . . 0.0 104.964 -178.86 . . . . . . . . 4 4 . 1 . 023 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.497 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 31.6 ttpt -64.93 73.01 0.04 OUTLIER 'General case' 0 CA--C 1.478 -1.79 0 C-N-CA 117.717 -1.593 . . . . 0.0 113.7 -179.331 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.687 ' HG2' HG22 ' A' ' 8' ' ' THR . 14.9 mttt . . . . . 0 CA--C 1.496 -1.119 0 O-C-N 119.981 -1.699 . . . . 0.0 114.782 179.812 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 N--CA 1.505 2.284 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 95.9 m -158.1 -47.93 0.06 Allowed 'General case' 0 C--O 1.207 -1.175 0 CA-C-O 123.539 1.637 . . . . 0.0 109.41 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.59 -157.04 0.02 OUTLIER 'General case' 0 CA--C 1.493 -1.22 0 C-N-CA 117.573 -1.651 . . . . 0.0 114.604 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.68 -173.73 0.8 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.87 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -122.39 -144.2 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 104.368 -2.456 . . . . 0.0 104.368 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.47 131.72 12.8 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 128.317 2.647 . . . . 0.0 110.713 179.713 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 178.16 -119.43 0.67 Allowed Glycine 0 C--O 1.22 -0.758 0 C-N-CA 115.832 -3.08 . . . . 0.0 115.864 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.446 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -179.75 151.07 0.42 Allowed 'General case' 0 C--O 1.211 -0.926 1 O-C-N 133.457 6.034 . . . . 0.0 105.441 -178.85 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.553 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -145.12 114.14 6.94 Favored 'General case' 0 CA--C 1.495 -1.153 1 O-C-N 129.298 4.124 . . . . 0.0 116.117 -179.446 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.413 ' HA ' ' HA ' ' A' ' 40' ' ' THR . 0.8 OUTLIER -82.61 95.08 7.67 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 114.846 -2.742 . . . . 0.0 106.94 179.643 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.509 ' HB3' ' HG2' ' A' ' 39' ' ' GLN . 32.5 ttm -28.28 -46.54 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 O-C-N 128.351 3.532 . . . . 0.0 107.148 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 93.35 -63.34 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.728 1 O-C-N 129.301 4.125 . . . . 0.0 111.729 179.291 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.98 -178.53 4.93 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 108.901 -3.772 . . . . 0.0 111.416 -179.568 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.475 ' ND2' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -165.5 154.94 12.43 Favored 'General case' 0 C--O 1.2 -1.51 0 O-C-N 126.289 2.243 . . . . 0.0 115.799 179.975 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.501 ' HG3' ' N ' ' A' ' 16' ' ' ASN . 3.1 tt0 -125.7 145.48 50.16 Favored 'General case' 0 N--CA 1.476 0.854 2 O-C-N 132.825 6.328 . . . . 0.0 110.738 -179.986 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.501 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 53.3 t30 36.82 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.138 0 CA-C-O 124.252 1.977 . . . . 0.0 115.744 -179.713 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -112.43 -39.5 4.37 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 111.636 -2.529 . . . . 0.0 109.562 -179.933 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -75.17 -35.02 61.62 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.956 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.02 -27.15 58.81 Favored Glycine 0 C--N 1.351 1.379 0 O-C-N 128.909 3.881 . . . . 0.0 107.028 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.497 ' CE1' HD11 ' A' ' 120' ' ' LEU . 2.1 t80 -72.31 -29.6 64.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 123.483 1.611 . . . . 0.0 108.576 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.432 ' HG2' HG21 ' A' ' 26' ' ' ILE . 9.8 mtt -77.76 -25.31 49.06 Favored 'General case' 0 CA--C 1.494 -1.208 0 C-N-CA 116.594 -2.042 . . . . 0.0 111.004 179.901 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -75.5 -27.01 58.6 Favored 'General case' 0 C--O 1.204 -1.304 0 O-C-N 127.799 3.187 . . . . 0.0 115.02 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.905 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -71.48 -44.93 63.82 Favored 'General case' 0 C--O 1.215 -0.718 1 O-C-N 134.461 7.351 . . . . 0.0 112.807 -179.859 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.859 HD11 ' HB ' ' A' ' 26' ' ' ILE . 2.6 pp -90.46 -6.05 55.33 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 110.24 -3.164 . . . . 0.0 108.202 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.6 t0 32.12 91.28 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 127.606 3.574 . . . . 0.0 113.01 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.859 ' HB ' HD11 ' A' ' 24' ' ' LEU . 9.9 tt -106.03 41.11 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.959 1 CA-C-N 107.472 -4.422 . . . . 0.0 111.17 179.69 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 80.47 134.54 0.06 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 109.887 -3.324 . . . . 0.0 113.323 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.454 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 43.0 m-85 -67.59 137.03 55.36 Favored 'General case' 0 CA--C 1.505 -0.751 0 O-C-N 125.626 1.829 . . . . 0.0 111.795 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 73.99 74.29 0.12 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 125.811 2.72 . . . . 0.0 109.155 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.429 ' O ' HG22 ' A' ' 30' ' ' THR . 34.1 m -140.76 40.73 1.84 Allowed 'General case' 0 N--CA 1.478 0.974 1 CA-C-N 106.85 -4.704 . . . . 0.0 110.794 179.939 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.79 -170.21 3.47 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 111.231 -2.713 . . . . 0.0 109.329 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.495 ' C ' ' CG1' ' A' ' 33' ' ' ILE . 4.6 tttp 76.38 30.69 0.65 Allowed 'General case' 0 C--N 1.314 -0.96 1 O-C-N 129.498 4.249 . . . . 0.0 112.425 -179.62 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.495 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -162.11 -55.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 2 O-C-N 129.834 4.459 . . . . 0.0 111.539 -179.959 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -87.62 50.3 1.97 Allowed 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 124.887 2.28 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.0 t -71.76 -44.21 68.78 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.578 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.186 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.907 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 160.04 132.51 0.0 OUTLIER 'General case' 0 N--CA 1.433 -1.299 1 O-C-N 130.684 4.99 . . . . 0.0 111.664 179.706 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.928 HD12 ' CG2' ' A' ' 57' ' ' THR . 0.1 OUTLIER -150.11 117.35 6.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 108.738 -3.847 . . . . 0.0 106.351 -179.981 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.426 ' HB ' ' HB ' ' A' ' 57' ' ' THR . 7.8 m 47.32 46.57 16.93 Favored 'General case' 0 CA--C 1.506 -0.742 1 O-C-N 131.096 5.247 . . . . 0.0 112.755 179.872 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.509 ' HG2' ' HB3' ' A' ' 11' ' ' MET . 0.4 OUTLIER -56.84 123.23 14.32 Favored 'General case' 0 CA--C 1.494 -1.174 0 O-C-N 125.135 1.522 . . . . 0.0 113.555 179.873 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.502 HG22 ' O ' ' A' ' 40' ' ' THR . 45.3 m -147.95 67.85 1.1 Allowed 'General case' 0 C--N 1.313 -0.994 1 O-C-N 130.114 4.634 . . . . 0.0 117.457 -179.114 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.648 ' HA ' ' CB ' ' A' ' 55' ' ' ASN . 0.1 OUTLIER -66.47 144.82 56.26 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 115.29 -2.29 . . . . 0.0 104.921 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.661 HD13 ' HB ' ' A' ' 54' ' ' THR . 2.6 mt -125.83 166.17 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 1 O-C-N 131.806 5.692 . . . . 0.0 113.263 -177.343 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.532 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.274 0.5 OUTLIER -149.85 143.37 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-N 110.829 -2.896 . . . . 0.0 112.484 179.405 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.501 HG12 ' N ' ' A' ' 45' ' ' GLN . 41.1 t -111.68 -71.1 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.322 0 CA-C-N 111.799 -2.455 . . . . 0.0 114.445 -179.786 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.501 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.4 OUTLIER 60.8 116.5 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 124.099 1.905 . . . . 0.0 113.206 -179.899 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -137.98 -4.12 1.76 Allowed 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 110.365 -3.107 . . . . 0.0 116.326 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.72 114.24 3.39 Favored Glycine 0 CA--C 1.493 -1.343 0 CA-C-N 121.16 1.8 . . . . 0.0 112.2 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 52.46 30.6 8.54 Favored 'General case' 0 C--O 1.212 -0.876 0 O-C-N 125.39 1.288 . . . . 0.0 111.693 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.5 t30 177.79 90.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.504 2.322 . . . . 0.0 109.218 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.689 ' CD2' HD13 ' A' ' 94' ' ' LEU . 32.9 t80 -103.3 95.4 6.07 Favored 'General case' 0 CA--C 1.482 -1.657 1 O-C-N 130.25 4.719 . . . . 0.0 116.648 -179.551 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -106.9 173.29 6.39 Favored 'General case' 0 C--O 1.197 -1.66 0 C-N-CA 114.899 -2.72 . . . . 0.0 111.438 178.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -138.28 136.79 36.82 Favored 'General case' 0 N--CA 1.472 0.647 2 O-C-N 132.542 6.151 . . . . 0.0 104.921 177.592 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.603 ' CE ' ' O ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -156.42 115.38 3.43 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 127.722 3.139 . . . . 0.0 113.887 -176.704 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.705 ' HA ' ' HB3' ' A' ' 60' ' ' ASN . 3.0 m 96.93 147.08 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 130.033 3.333 . . . . 0.0 105.276 177.393 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.648 ' CB ' ' HA ' ' A' ' 41' ' ' LYS . 1.2 p-10 -171.76 47.2 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.378 1 O-C-N 129.667 4.354 . . . . 0.0 116.513 -176.832 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 m 148.5 168.46 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 O-C-N 128.867 3.855 . . . . 0.0 107.884 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.928 ' CG2' HD12 ' A' ' 37' ' ' LEU . 5.1 t -83.1 -36.97 24.42 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 111.853 -2.431 . . . . 0.0 106.204 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.912 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -61.15 -29.83 70.02 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 125.682 1.864 . . . . 0.0 110.622 -179.937 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.1 OUTLIER -178.2 162.4 1.56 Allowed 'General case' 0 CA--C 1.504 -0.818 1 O-C-N 131.375 5.422 . . . . 0.0 116.392 -179.938 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.705 ' HB3' ' HA ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -138.47 86.58 2.17 Favored 'General case' 0 CA--C 1.503 -0.853 2 O-C-N 130.778 5.049 . . . . 0.0 114.078 -177.546 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -81.53 93.03 6.6 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 127.186 2.804 . . . . 0.0 110.186 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -43.42 148.25 0.33 Allowed 'General case' 0 C--O 1.206 -1.206 1 O-C-N 129.877 4.486 . . . . 0.0 111.406 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.557 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 4.7 tp -128.9 62.25 1.5 Allowed 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.321 4.138 . . . . 0.0 110.791 179.903 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -79.97 94.24 5.86 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 127.748 3.155 . . . . 0.0 110.363 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.634 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 6.9 m-85 -129.59 137.75 50.89 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 127.103 3.335 . . . . 0.0 109.854 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.635 ' O ' HG23 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -125.4 108.8 12.03 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 109.039 -3.71 . . . . 0.0 103.027 179.594 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.909 HG21 ' CD1' ' A' ' 89' ' ' TRP . 12.5 t -41.77 129.79 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.419 1 O-C-N 130.854 5.096 . . . . 0.0 114.716 -179.771 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.18 12.81 69.9 Favored Glycine 0 N--CA 1.48 1.583 1 O-C-N 129.277 4.111 . . . . 0.0 116.287 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 66' ' ' THR 0.275 1.7 t -73.82 -34.01 39.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.864 -179.792 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 72' ' ' ASP . 27.2 tt0 65.43 73.81 0.39 Allowed 'General case' 0 C--N 1.366 1.306 0 C-N-CA 112.489 -3.685 . . . . 0.0 108.442 -179.374 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.678 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.2 OUTLIER -63.16 77.92 0.02 OUTLIER 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 126.905 3.24 . . . . 0.0 112.569 -179.488 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 70' ' ' GLU . 77.8 m-20 -61.72 78.21 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -179.82 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.531 ' HG2' ' CA ' ' A' ' 83' ' ' VAL . 21.4 mt-10 56.35 108.98 0.01 OUTLIER 'General case' 0 CA--C 1.49 -1.352 1 CA-C-O 129.061 4.267 . . . . 0.0 114.642 179.679 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.62 97.84 0.05 Allowed 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 109.772 -3.376 . . . . 0.0 115.641 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.92 130.8 5.75 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 111.391 -2.641 . . . . 0.0 111.336 -179.932 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.93 148.79 20.95 Favored 'General case' 0 CA--C 1.508 -0.656 0 O-C-N 128.448 3.592 . . . . 0.0 111.899 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.54 -3.99 72.41 Favored Glycine 0 C--O 1.21 -1.369 0 CA-C-N 109.405 -3.543 . . . . 0.0 113.067 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.498 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 0.9 OUTLIER -146.93 19.87 1.27 Allowed 'General case' 0 C--N 1.347 0.494 0 O-C-N 127.868 2.746 . . . . 0.0 116.982 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.7 t0 174.66 -59.5 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.53 0.519 . . . . 0.0 110.96 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.51 72.95 0.97 Allowed Glycine 0 CA--C 1.503 -0.668 0 CA-C-O 126.545 3.303 . . . . 0.0 111.989 -179.797 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.54 -177.63 3.87 Favored 'General case' 0 C--N 1.363 1.194 1 CA-C-N 107.965 -4.118 . . . . 0.0 111.239 179.954 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.444 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.11 82.68 1.2 Allowed 'General case' 0 C--O 1.202 -1.407 0 O-C-N 127.533 3.021 . . . . 0.0 108.145 179.643 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 99' ' ' LYS . 2.3 t -134.19 143.79 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 CA-C-N 111.194 -2.73 . . . . 0.0 117.926 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -50.89 155.3 1.22 Allowed 'General case' 0 N--CA 1.465 0.291 1 O-C-N 130.139 4.649 . . . . 0.0 106.999 179.299 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.678 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.1 m -158.47 78.46 0.79 Allowed 'General case' 0 C--O 1.194 -1.848 0 CA-C-O 127.764 3.65 . . . . 0.0 111.823 -179.452 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 7.5 tt -68.9 139.13 55.12 Favored 'General case' 0 N--CA 1.431 -1.381 1 CA-C-N 107.412 -4.449 . . . . 0.0 111.864 -179.953 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.427 HG13 ' HA ' ' A' ' 67' ' ' VAL . 14.8 p -132.73 132.45 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 C-N-CA 126.085 1.754 . . . . 0.0 110.759 179.883 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.728 ' HA ' HG13 ' A' ' 67' ' ' VAL . 1.4 t -155.21 175.13 14.24 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 126.886 3.231 . . . . 0.0 110.92 179.847 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 89' ' ' TRP . . . . . 0.909 ' CD1' HG21 ' A' ' 67' ' ' VAL . 42.0 m95 -96.22 144.25 26.6 Favored 'General case' 0 CA--C 1.506 -0.732 0 C-N-CA 127.569 2.347 . . . . 0.0 107.874 180.0 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.549 ' HB2' HG23 ' A' ' 95' ' ' VAL . 6.6 tp10 -91.98 -45.46 8.32 Favored 'General case' 0 C--O 1.21 -1.016 1 CA-C-O 131.706 5.527 . . . . 0.0 111.324 179.878 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -178.95 -49.21 0.08 OUTLIER Glycine 0 C--N 1.359 1.85 1 CA-C-N 105.586 -5.279 . . . . 0.0 105.405 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.64 30.42 1.7 Allowed 'General case' 0 C--O 1.212 -0.9 1 O-C-N 131.678 4.987 . . . . 0.0 111.225 179.912 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.433 HG22 ' CB ' ' A' ' 90' ' ' GLU . 2.6 t -161.54 154.05 20.16 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -179.964 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.689 HD13 ' CD2' ' A' ' 50' ' ' PHE . 2.0 tp -89.61 88.14 7.3 Favored 'General case' 0 CA--C 1.486 -1.496 0 O-C-N 129.048 3.968 . . . . 0.0 118.101 179.742 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.549 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.359 40.9 t -86.29 114.97 26.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.251 0 CA-C-N 110.403 -3.09 . . . . 0.0 112.556 179.681 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -138.55 137.4 37.0 Favored 'General case' 0 C--O 1.2 -1.532 0 CA-C-O 122.227 1.013 . . . . 0.0 108.362 -179.491 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.6 t -122.92 137.28 56.92 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 179.76 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.554 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -94.06 94.21 8.28 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 125.369 2.509 . . . . 0.0 107.921 179.399 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.546 ' O ' HG12 ' A' ' 83' ' ' VAL . 71.4 tttt -91.19 128.73 37.12 Favored 'General case' 0 C--O 1.201 -1.467 1 CA-C-N 107.501 -4.409 . . . . 0.0 113.236 -179.9 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 102' ' ' LYS . . . 157.4 171.26 23.2 Favored Glycine 0 C--O 1.203 -1.836 0 CA-C-N 112.964 -1.925 . . . . 0.0 108.538 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 14.09 -70.23 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.959 2 O-C-N 130.254 4.149 . . . . 0.0 114.414 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -153.1 -43.01 0.1 Allowed 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 127.37 2.268 . . . . 0.0 115.028 179.636 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.496 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 2.8 mp0 -35.91 105.96 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.221 3.045 . . . . 0.0 119.221 -179.527 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.49 ' O ' ' HB ' ' A' ' 121' ' ' THR . 5.9 m120 -94.52 71.57 3.68 Favored 'General case' 0 N--CA 1.492 1.671 3 CA-C-N 106.96 -4.655 . . . . 0.0 99.436 177.415 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 105' ' ' ARG . 14.5 tpt85 -107.17 12.64 28.16 Favored 'General case' 0 C--N 1.31 -1.136 1 O-C-N 134.314 7.259 . . . . 0.0 111.623 -176.908 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.554 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -75.52 141.71 28.02 Favored Glycine 0 C--O 1.203 -1.783 2 O-C-N 130.98 5.175 . . . . 0.0 111.42 179.949 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 107' ' ' TRP . . . . . 0.634 ' CH2' ' CE2' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -123.93 145.47 49.12 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 129.832 3.901 . . . . 0.0 111.112 179.532 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.404 ' HD2' ' CZ3' ' A' ' 110' ' ' TRP . 6.4 ptpp? -156.11 172.58 18.18 Favored 'General case' 0 C--O 1.202 -1.411 0 O-C-N 128.283 3.489 . . . . 0.0 111.975 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.53 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -133.54 175.47 9.39 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 110.279 -3.146 . . . . 0.0 109.565 -179.627 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.498 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -172.27 84.29 0.07 Allowed 'General case' 0 CA--C 1.502 -0.891 1 O-C-N 130.05 4.594 . . . . 0.0 115.208 179.73 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.5 t -37.32 90.8 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.83 0 CA-C-O 124.654 2.168 . . . . 0.0 111.859 179.399 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -91.87 47.49 1.35 Allowed 'General case' 0 CA--C 1.486 -1.492 0 CA-C-N 110.079 -3.237 . . . . 0.0 116.662 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.23 -103.36 1.22 Allowed Glycine 0 C--O 1.212 -1.239 0 O-C-N 121.034 -1.041 . . . . 0.0 115.483 179.752 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -100.08 -8.09 24.16 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.21 177.84 7.5 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 128.898 3.874 . . . . 0.0 108.345 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.614 HD23 ' O ' ' A' ' 116' ' ' LEU . 0.2 OUTLIER -138.12 117.99 13.28 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 126.734 2.521 . . . . 0.0 113.146 179.723 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.498 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.3 m-85 -71.06 151.36 44.62 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 111.514 -2.584 . . . . 0.0 114.432 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.491 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -121.18 52.53 1.2 Allowed 'General case' 0 CA--C 1.5 -0.946 2 O-C-N 131.729 5.643 . . . . 0.0 108.733 -179.991 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.91 146.29 32.62 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 127.876 2.47 . . . . 0.0 108.43 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.701 HD12 ' O ' ' A' ' 121' ' ' THR . 0.1 OUTLIER -156.5 162.14 39.97 Favored 'General case' 0 CA--C 1.486 -1.517 0 O-C-N 126.263 2.227 . . . . 0.0 111.231 -179.755 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.701 ' O ' HD12 ' A' ' 120' ' ' LEU . 1.2 m -118.15 162.98 17.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 127.52 3.012 . . . . 0.0 105.134 -179.661 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.475 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.6 OUTLIER -166.32 47.72 0.07 Allowed 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 126.245 2.926 . . . . 0.0 110.918 179.52 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.19 61.48 2.64 Favored Glycine 0 C--O 1.238 0.38 0 CA-C-N 110.269 -3.15 . . . . 0.0 110.952 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 66.36 41.83 3.19 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 128.112 2.89 . . . . 0.0 111.774 179.69 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.905 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 5.4 mm-40 -131.58 31.53 4.28 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.569 3.043 . . . . 0.0 104.586 179.828 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.587 HG13 ' NH1' ' A' ' 128' ' ' ARG . 9.7 p -22.44 75.32 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 O-C-N 127.739 3.149 . . . . 0.0 114.764 179.819 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 13.1 t -68.31 139.77 55.92 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 119.51 -1.994 . . . . 0.0 111.19 -179.847 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.587 ' NH1' HG13 ' A' ' 126' ' ' VAL . 0.3 OUTLIER -119.28 147.5 44.21 Favored 'General case' 0 N--CA 1.47 0.542 1 O-C-N 129.266 4.104 . . . . 0.0 110.667 179.657 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -132.48 178.87 6.5 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 128.267 3.479 . . . . 0.0 110.92 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.27 141.52 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 103.282 -2.858 . . . . 0.0 103.282 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.491 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 42.6 m-85 -127.18 171.04 11.78 Favored 'General case' 0 CA--C 1.486 -1.511 0 O-C-N 128.399 3.562 . . . . 0.0 114.861 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.42 ' HD2' ' N ' ' A' ' 133' ' ' LYS 0.322 0.1 OUTLIER -157.27 117.97 3.56 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 112.723 -3.513 . . . . 0.0 103.296 179.997 . . . . . . . . 4 4 . 1 . 024 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.553 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 10.9 pttt -52.94 130.61 34.05 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 130.292 4.745 . . . . 0.0 110.268 179.373 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.413 ' HG2' ' C ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.799 0 O-C-N 126.212 2.195 . . . . 0.0 115.902 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.508 -0.636 0 N-CA-C 117.851 2.537 . . . . 0.0 117.851 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -157.75 76.66 0.81 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -108.43 12.25 26.37 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 116.031 -1.938 . . . . 0.0 107.607 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -9.52 119.09 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.954 1 O-C-N 132.835 6.334 . . . . 0.0 115.382 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.494 ' O ' HG23 ' A' ' 8' ' ' THR . . . -170.26 -135.12 1.85 Allowed Glycine 0 C--O 1.21 -1.386 0 CA-C-O 116.693 -2.17 . . . . 0.0 110.259 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.494 HG23 ' O ' ' A' ' 7' ' ' GLY . 1.3 p -155.56 163.75 39.56 Favored 'General case' 0 C--O 1.208 -1.093 1 O-C-N 132.168 5.275 . . . . 0.0 107.201 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.514 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.254 0.0 OUTLIER -156.92 101.59 1.95 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 128.063 3.352 . . . . 0.0 111.391 179.965 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -56.48 -18.25 10.85 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.422 ' HG3' ' CE2' ' A' ' 131' ' ' PHE . 27.7 ttm 68.28 84.98 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 103.364 -2.828 . . . . 0.0 103.364 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.01 -29.67 0.62 Allowed 'General case' 0 C--N 1.312 -1.029 0 O-C-N 128.802 3.814 . . . . 0.0 111.698 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.265 1.5 m -176.15 162.9 2.55 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-N 113.718 -1.583 . . . . 0.0 112.052 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.434 ' H ' ' ND2' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.96 121.25 27.61 Favored 'General case' 0 CA--C 1.501 -0.94 0 CA-C-N 111.194 -2.73 . . . . 0.0 114.354 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -70.74 -63.45 1.09 Allowed 'General case' 0 CA--C 1.491 -1.325 1 O-C-N 129.654 4.346 . . . . 0.0 109.288 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -115.13 135.21 54.44 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -128.44 -56.42 1.23 Allowed 'General case' 0 CA--C 1.495 -1.173 0 CA-C-O 124.183 1.944 . . . . 0.0 110.936 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.578 ' HB2' ' CB ' ' A' ' 31' ' ' ARG . 5.3 tp10 -76.71 -37.02 56.81 Favored 'General case' 0 CA--C 1.499 -0.992 0 O-C-N 120.391 -1.443 . . . . 0.0 113.204 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.522 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.15 -25.01 46.03 Favored Glycine 0 CA--C 1.5 -0.882 0 O-C-N 128.537 3.648 . . . . 0.0 112.609 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -75.0 -37.79 61.76 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 119.136 1.468 . . . . 0.0 107.934 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 mtm -77.23 -20.95 54.54 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 112.368 -2.196 . . . . 0.0 107.628 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.522 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 3.0 ttmt -75.09 -38.42 61.23 Favored 'General case' 0 C--O 1.199 -1.572 0 C-N-CA 128.845 2.858 . . . . 0.0 114.595 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.0 -36.39 83.41 Favored 'General case' 0 C--O 1.203 -1.379 1 O-C-N 130.971 5.169 . . . . 0.0 114.163 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.69 HD11 ' HB ' ' A' ' 26' ' ' ILE . 3.7 pp -94.58 -2.48 51.41 Favored 'General case' 0 C--O 1.215 -0.763 1 O-C-N 129.364 4.165 . . . . 0.0 107.969 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.7 t0 45.7 79.53 0.05 Allowed 'General case' 0 CA--C 1.483 -1.631 0 CA-C-O 128.159 3.838 . . . . 0.0 111.093 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.69 ' HB ' HD11 ' A' ' 24' ' ' LEU . 15.6 tt -84.0 -50.15 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.685 0 CA-C-N 109.452 -3.522 . . . . 0.0 108.274 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.452 ' N ' HG23 ' A' ' 26' ' ' ILE . 3.8 t0 -175.94 26.23 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 115.016 -2.421 . . . . 0.0 112.678 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 31.79 37.47 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.303 0 O-C-N 126.308 2.255 . . . . 0.0 117.039 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.0 172.82 17.48 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 112.363 -2.199 . . . . 0.0 106.729 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.287 0.6 OUTLIER 97.71 -7.01 0.06 Allowed 'General case' 0 N--CA 1.484 1.235 1 O-C-N 131.126 5.266 . . . . 0.0 112.667 -179.749 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.578 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -75.51 -16.82 60.25 Favored 'General case' 0 C--O 1.238 0.451 1 O-C-N 131.594 5.559 . . . . 0.0 107.524 179.475 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.8 -11.85 17.31 Favored 'General case' 0 C--O 1.213 -0.854 0 O-C-N 127.534 3.021 . . . . 0.0 111.476 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.3 mp -116.1 -53.36 4.55 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.194 1 O-C-N 130.349 4.781 . . . . 0.0 114.121 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.432 ' HB1' ' CE2' ' A' ' 58' ' ' PHE . . . -67.78 -10.38 52.26 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.9 t -15.82 -48.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.557 0 N-CA-C 116.866 2.173 . . . . 0.0 116.866 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.664 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.1 OUTLIER 162.2 115.38 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.604 2 O-C-N 129.814 4.446 . . . . 0.0 115.311 179.762 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.664 HD23 ' C ' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -142.42 68.79 1.31 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 110.825 -2.898 . . . . 0.0 106.906 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.4 m 93.49 -17.96 0.11 Allowed 'General case' 0 C--O 1.24 0.557 0 O-C-N 128.357 3.535 . . . . 0.0 117.42 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -12.7 89.16 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.007 0 O-C-N 127.678 3.111 . . . . 0.0 117.695 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -111.21 102.16 10.61 Favored 'General case' 0 N--CA 1.434 -1.273 1 O-C-N 132.169 5.918 . . . . 0.0 111.815 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.476 ' CD ' ' CD1' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -75.18 141.98 43.55 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 128.196 3.435 . . . . 0.0 107.425 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.534 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.7 mt -140.01 160.17 26.39 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 CA-C-O 123.291 1.519 . . . . 0.0 111.779 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.534 ' N ' HG22 ' A' ' 42' ' ' ILE 0.316 9.1 tt -132.3 142.99 41.28 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.476 0 CA-C-N 110.989 -2.823 . . . . 0.0 107.652 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.676 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.1 t -115.98 -68.16 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 CA-C-N 113.888 -1.506 . . . . 0.0 114.661 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.676 ' N ' HG12 ' A' ' 44' ' ' VAL . 2.1 mt-30 69.12 133.19 0.03 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 O-C-N 124.832 1.332 . . . . 0.0 113.317 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -132.58 -24.51 1.99 Allowed 'General case' 0 C--N 1.359 0.98 1 O-C-N 130.213 4.696 . . . . 0.0 117.124 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.11 -69.85 0.4 Allowed Glycine 0 C--O 1.218 -0.905 0 CA-C-O 122.958 1.31 . . . . 0.0 111.243 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -102.61 -8.25 21.11 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-N 111.227 -2.487 . . . . 0.0 112.037 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -118.48 177.77 4.7 Favored 'General case' 0 C--N 1.354 0.793 0 CA-C-O 114.45 -2.69 . . . . 0.0 111.316 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.744 ' CD2' HD22 ' A' ' 94' ' ' LEU . 5.9 t80 -172.22 113.68 0.31 Allowed 'General case' 0 C--N 1.313 -1.01 1 O-C-N 132.062 5.851 . . . . 0.0 115.828 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.448 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -133.72 79.92 1.85 Allowed 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 118.594 2.813 . . . . 0.0 118.594 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 43' ' ' ILE . 0.7 OUTLIER -60.41 149.71 33.16 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 112.458 -2.155 . . . . 0.0 107.153 179.712 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -146.06 162.6 37.53 Favored 'General case' 0 CA--C 1.49 -1.365 0 O-C-N 127.259 2.849 . . . . 0.0 111.516 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.02 123.03 49.36 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 127.602 3.064 . . . . 0.0 107.647 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.441 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -91.68 29.35 1.55 Allowed 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.511 ' HB3' ' CD1' ' A' ' 58' ' ' PHE . 0.6 OUTLIER -53.08 157.74 1.7 Allowed 'General case' 0 C--O 1.209 -1.051 0 O-C-N 128.853 3.845 . . . . 0.0 105.792 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.411 ' HB ' HD12 ' A' ' 37' ' ' LEU . 46.2 m -84.54 -7.6 59.21 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 109.212 -3.631 . . . . 0.0 109.163 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.584 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -101.75 -39.12 7.57 Favored 'General case' 0 C--N 1.366 1.296 0 CA-C-O 125.095 2.379 . . . . 0.0 110.466 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.79 149.56 27.55 Favored 'General case' 0 C--N 1.361 1.083 1 CA-C-N 107.794 -4.276 . . . . 0.0 117.93 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 79.71 1.62 Allowed 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 109.185 -3.643 . . . . 0.0 109.295 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -170.95 71.49 0.05 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 108.932 -3.758 . . . . 0.0 107.477 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.443 ' HB3' ' HA ' ' A' ' 53' ' ' LYS . 2.8 t0 -106.57 -127.13 0.25 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.6 2.438 . . . . 0.0 115.648 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.741 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -56.07 101.52 0.06 Allowed 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.368 -179.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -132.2 88.91 2.6 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 127.086 2.741 . . . . 0.0 112.369 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.576 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -166.52 179.62 5.41 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 124.088 1.899 . . . . 0.0 112.785 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.59 152.23 30.6 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.808 HG21 ' CD1' ' A' ' 89' ' ' TRP . 0.3 OUTLIER -71.76 144.01 13.68 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.866 0 O-C-N 128.915 3.884 . . . . 0.0 115.202 -179.744 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.71 7.54 22.24 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 128.607 3.692 . . . . 0.0 116.936 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 1.1 t -72.84 -26.46 23.49 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.575 0 O-C-N 125.312 1.242 . . . . 0.0 109.136 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 65.68 89.86 0.09 Allowed 'General case' 0 C--O 1.212 -0.896 2 O-C-N 131.028 5.205 . . . . 0.0 109.383 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 3.4 t80 -74.89 67.35 1.65 Allowed 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 127.265 2.853 . . . . 0.0 112.258 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -50.01 79.12 0.0 OUTLIER 'General case' 0 CA--C 1.484 -1.591 0 CA-C-N 113.593 -1.64 . . . . 0.0 113.625 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.47 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 11.1 mt-10 52.89 -165.76 0.07 Allowed 'General case' 0 C--O 1.212 -0.89 0 C-N-CA 125.311 1.444 . . . . 0.0 111.848 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.5 t60 72.49 78.8 0.15 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 125.449 2.547 . . . . 0.0 115.843 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.41 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -122.82 170.28 10.25 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 111.925 -2.398 . . . . 0.0 112.945 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.41 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.15 138.22 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 O-C-N 128.34 3.525 . . . . 0.0 113.68 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 125.94 -17.41 6.76 Favored Glycine 0 C--O 1.213 -1.181 0 CA-C-N 112.165 -2.288 . . . . 0.0 110.067 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.482 ' O ' HD12 ' A' ' 26' ' ' ILE . 3.7 tp -122.75 -67.85 0.92 Allowed 'General case' 0 N--CA 1.469 0.503 2 CA-C-N 106.734 -4.733 . . . . 0.0 112.869 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.486 ' HA ' HD13 ' A' ' 24' ' ' LEU . 2.3 t70 -104.51 -72.62 0.7 Allowed 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.2 76.2 1.18 Allowed Glycine 0 C--O 1.217 -0.96 0 CA-C-O 124.676 2.265 . . . . 0.0 111.439 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.452 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 11.6 tpp180 -150.22 -117.77 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.228 1 CA-C-N 107.195 -4.503 . . . . 0.0 113.112 179.682 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.47 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.5 OUTLIER -172.57 97.37 0.14 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.828 1.194 . . . . 0.0 112.256 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 87.8 t -135.77 126.91 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 N-CA-C 117.959 2.577 . . . . 0.0 117.959 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.456 ' CB ' ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -51.8 122.25 7.93 Favored 'General case' 0 C--O 1.218 -0.601 0 O-C-N 128.782 3.801 . . . . 0.0 106.837 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.561 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 21.5 m -133.33 83.27 2.04 Favored 'General case' 0 C--O 1.196 -1.735 0 O-C-N 128.417 3.573 . . . . 0.0 112.952 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.451 ' HG ' ' N ' ' A' ' 87' ' ' VAL . 1.1 tp -82.73 138.66 33.98 Favored 'General case' 0 N--CA 1.438 -1.047 1 CA-C-N 107.033 -4.621 . . . . 0.0 111.595 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.545 HG12 HG23 ' A' ' 67' ' ' VAL . 97.3 t -123.31 140.22 47.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 124.888 1.275 . . . . 0.0 110.602 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.9 m -154.68 152.08 29.52 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 112.647 -2.069 . . . . 0.0 110.625 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.808 ' CD1' HG21 ' A' ' 67' ' ' VAL . 38.8 m95 -89.9 139.23 30.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 129.082 2.953 . . . . 0.0 106.847 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.452 ' CB ' HG22 ' A' ' 93' ' ' THR . 0.4 OUTLIER -91.29 -16.18 27.94 Favored 'General case' 0 CA--C 1.478 -1.811 1 CA-C-O 130.146 4.784 . . . . 0.0 114.925 179.893 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.68 -30.88 3.5 Favored Glycine 0 C--N 1.362 1.98 1 CA-C-N 107.542 -4.39 . . . . 0.0 103.411 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -156.16 91.0 1.23 Allowed 'General case' 0 N--CA 1.428 -1.569 1 O-C-N 132.906 5.709 . . . . 0.0 106.296 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.452 HG22 ' CB ' ' A' ' 90' ' ' GLU . 1.2 t 116.59 160.47 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 128.852 2.861 . . . . 0.0 118.029 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.744 HD22 ' CD2' ' A' ' 50' ' ' PHE . 6.1 tp -102.81 99.07 8.99 Favored 'General case' 0 CA--C 1.49 -1.339 0 CA-C-O 125.216 2.436 . . . . 0.0 117.326 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.462 HG13 ' NZ ' ' A' ' 108' ' ' LYS 0.357 66.9 t -92.66 121.55 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 114.83 -2.509 . . . . 0.0 112.547 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -136.39 140.9 43.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 124.189 1.947 . . . . 0.0 109.387 -179.445 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.4 t -107.83 102.94 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.967 0 CA-C-N 109.267 -3.606 . . . . 0.0 118.08 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.489 ' HG3' ' C ' ' A' ' 105' ' ' ARG . 5.0 mm100 -83.09 86.34 7.03 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.128 -1.608 . . . . 0.0 107.959 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.456 ' HB3' ' CB ' ' A' ' 84' ' ' LYS . 0.6 OUTLIER -76.16 100.25 4.95 Favored 'General case' 0 C--O 1.2 -1.526 0 CA-C-N 109.498 -3.501 . . . . 0.0 107.769 -179.321 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -98.68 177.47 30.59 Favored Glycine 0 C--O 1.214 -1.1 0 O-C-N 127.597 3.061 . . . . 0.0 112.271 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -107.96 -39.91 5.39 Favored 'General case' 0 CA--C 1.494 -1.2 1 CA-C-N 106.675 -4.762 . . . . 0.0 111.989 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.43 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -117.06 -41.85 2.98 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 125.067 2.365 . . . . 0.0 115.433 179.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' A' ' 105' ' ' ARG . 2.0 pp20? -113.78 167.24 10.79 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 126.582 3.087 . . . . 0.0 112.561 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -126.65 90.11 3.11 Favored 'General case' 0 N--CA 1.489 1.514 1 CA-C-N 107.346 -4.479 . . . . 0.0 102.415 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.489 ' C ' ' HG3' ' A' ' 98' ' ' GLN . 5.8 mmm180 -79.74 -7.76 58.82 Favored 'General case' 0 C--N 1.317 -0.806 1 O-C-N 129.448 4.218 . . . . 0.0 113.011 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.493 ' O ' HG22 ' A' ' 121' ' ' THR . . . -22.51 98.59 0.01 OUTLIER Glycine 0 N--CA 1.442 -0.936 1 O-C-N 133.71 6.881 . . . . 0.0 112.333 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.741 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.333 0.0 OUTLIER -116.79 125.27 51.35 Favored 'General case' 0 C--O 1.219 -0.536 1 O-C-N 132.415 5.42 . . . . 0.0 111.34 -179.197 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.479 ' HB2' ' CZ3' ' A' ' 110' ' ' TRP . 0.1 OUTLIER -151.19 153.61 35.28 Favored 'General case' 0 CA--C 1.507 -0.707 0 O-C-N 128.552 3.657 . . . . 0.0 116.318 -178.518 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.789 ' HG2' HD22 ' A' ' 118' ' ' LEU . 0.7 OUTLIER -116.53 167.51 10.99 Favored 'General case' 0 C--N 1.36 1.055 0 CA-C-N 109.725 -3.398 . . . . 0.0 110.248 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.479 ' CZ3' ' HB2' ' A' ' 108' ' ' LYS . 0.5 OUTLIER -177.36 99.34 0.05 OUTLIER 'General case' 0 C--O 1.211 -0.929 0 O-C-N 128.309 3.505 . . . . 0.0 114.87 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.0 t -47.23 97.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.825 0 CA-C-O 124.948 2.308 . . . . 0.0 112.988 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.475 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 9.2 mm-40 -94.21 50.91 1.42 Allowed 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 109.09 -3.687 . . . . 0.0 112.604 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.19 -130.14 9.14 Favored Glycine 0 C--O 1.201 -1.934 0 O-C-N 119.465 -2.022 . . . . 0.0 113.057 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -90.77 16.26 9.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 127.405 2.282 . . . . 0.0 117.093 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -142.97 -176.52 4.94 Favored 'General case' 0 C--O 1.223 -0.303 0 O-C-N 128.529 3.643 . . . . 0.0 108.305 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.452 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -140.75 108.17 5.56 Favored 'General case' 0 CA--C 1.485 -1.54 1 O-C-N 130.283 4.739 . . . . 0.0 117.598 -179.904 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.755 ' O ' HD23 ' A' ' 118' ' ' LEU . 17.4 m-30 -72.36 142.72 48.76 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 111.23 -2.714 . . . . 0.0 116.809 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.789 HD22 ' HG2' ' A' ' 109' ' ' GLN . 3.1 mt -130.48 86.37 2.38 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 109.141 -3.663 . . . . 0.0 107.542 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -96.98 92.41 6.07 Favored 'General case' 0 CA--C 1.495 -1.164 0 C-N-CA 128.278 2.631 . . . . 0.0 111.829 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.456 ' CD2' ' HB3' ' A' ' 127' ' ' CYS . 0.3 OUTLIER -110.64 -177.07 3.13 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 128.119 3.387 . . . . 0.0 108.645 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 106' ' ' GLY . 9.2 t -150.44 178.32 9.16 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.978 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.5 p -173.09 60.23 0.02 OUTLIER 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 126.066 2.841 . . . . 0.0 113.078 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.97 -74.77 1.09 Allowed Glycine 0 CA--C 1.521 0.439 0 CA-C-N 111.166 -2.743 . . . . 0.0 112.79 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.91 -50.47 3.05 Favored 'General case' 0 CA--C 1.493 -1.214 0 O-C-N 126.19 1.759 . . . . 0.0 110.966 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.28 174.94 1.06 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 128.466 3.604 . . . . 0.0 109.815 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 126' ' ' VAL . 3.6 p -153.81 88.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 CA-C-N 109.425 -3.534 . . . . 0.0 111.007 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.456 ' HB3' ' CD2' ' A' ' 120' ' ' LEU . 52.0 t -73.35 118.53 16.41 Favored 'General case' 0 CA--C 1.49 -1.349 0 CA-C-N 112.161 -2.29 . . . . 0.0 112.203 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -106.1 135.5 47.45 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 114.524 -2.655 . . . . 0.0 110.46 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -126.34 154.31 43.69 Favored 'General case' 0 CA--C 1.488 -1.422 1 O-C-N 129.671 4.357 . . . . 0.0 116.159 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.22 136.21 53.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.523 ' CD1' ' N ' ' A' ' 131' ' ' PHE . 52.4 m-85 -126.47 -179.43 4.76 Favored 'General case' 0 CA--C 1.477 -1.853 0 CA-C-N 111.709 -2.496 . . . . 0.0 113.916 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.483 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.318 0.0 OUTLIER -157.69 45.86 0.36 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 112.369 -3.681 . . . . 0.0 108.825 -179.759 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.509 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 35.6 ttpt 15.18 102.2 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.933 1 O-C-N 130.186 4.679 . . . . 0.0 118.294 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt . . . . . 0 CA--C 1.494 -1.189 0 CA-C-O 114.383 -2.722 . . . . 0.0 112.02 -179.581 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.455 ' HG2' ' CH2' ' A' ' 89' ' ' TRP . 0.6 OUTLIER . . . . . 0 N--CA 1.446 -0.633 0 N-CA-C 118.583 2.809 . . . . 0.0 118.583 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.28 105.27 0.07 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 125.898 1.679 . . . . 0.0 109.602 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -116.43 -143.57 0.38 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 112.743 -3.503 . . . . 0.0 102.073 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.9 m120 125.42 122.45 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 1 O-C-N 131.026 5.204 . . . . 0.0 115.337 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.02 -169.96 33.16 Favored Glycine 0 C--O 1.204 -1.722 0 CA-C-N 112.108 -2.315 . . . . 0.0 111.885 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.526 HG23 HG23 ' A' ' 40' ' ' THR . 0.3 OUTLIER -119.01 152.11 37.0 Favored 'General case' 0 C--O 1.202 -1.412 1 O-C-N 132.15 5.265 . . . . 0.0 104.216 179.735 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.563 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -149.11 108.05 3.88 Favored 'General case' 0 CA--C 1.486 -1.506 1 O-C-N 132.426 6.079 . . . . 0.0 112.517 -179.976 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -76.52 100.73 5.37 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 116.213 -2.195 . . . . 0.0 108.156 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.452 ' HB3' ' CD ' ' A' ' 39' ' ' GLN . 4.9 ttm -32.53 -42.42 0.07 Allowed 'General case' 0 N--CA 1.474 0.759 0 O-C-N 127.409 2.943 . . . . 0.0 108.78 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 85.25 -55.84 0.09 Allowed 'General case' 0 CA--C 1.51 -0.569 1 O-C-N 131.461 5.475 . . . . 0.0 112.224 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -157.44 -175.67 5.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 124.815 2.245 . . . . 0.0 111.419 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.527 ' N ' ' ND2' ' A' ' 14' ' ' ASN . 1.5 p30 -155.26 168.0 28.51 Favored 'General case' 0 CA--C 1.483 -1.617 0 CA-C-N 111.513 -2.585 . . . . 0.0 114.109 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -89.9 -80.61 0.31 Allowed 'General case' 0 CA--C 1.503 -0.859 0 O-C-N 128.781 3.801 . . . . 0.0 110.01 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -114.14 126.84 55.53 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 123.216 1.484 . . . . 0.0 112.31 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.64 ' CZ ' HG22 ' A' ' 35' ' ' VAL . 5.7 p90 -109.74 -44.81 3.76 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-O 124.095 1.902 . . . . 0.0 107.883 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.438 ' HG3' ' CB ' ' A' ' 31' ' ' ARG . 5.2 tt0 -66.8 -37.22 84.12 Favored 'General case' 0 C--O 1.215 -0.721 0 O-C-N 120.685 -1.259 . . . . 0.0 113.732 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.18 -33.01 81.67 Favored Glycine 0 N--CA 1.475 1.24 1 O-C-N 129.36 4.163 . . . . 0.0 109.73 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.525 ' CE1' HD21 ' A' ' 24' ' ' LEU . 0.9 OUTLIER -73.69 -44.18 57.29 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-O 124.878 2.275 . . . . 0.0 107.447 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.673 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -61.28 -23.47 65.7 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 124.389 2.042 . . . . 0.0 113.282 -179.692 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -76.58 -27.3 55.77 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 108.441 -3.982 . . . . 0.0 112.684 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.26 -42.24 79.92 Favored 'General case' 0 N--CA 1.477 0.915 1 O-C-N 129.883 4.489 . . . . 0.0 111.679 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.721 HD22 ' NE ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -84.73 -16.33 42.04 Favored 'General case' 0 N--CA 1.483 1.184 1 O-C-N 130.194 4.684 . . . . 0.0 103.966 -179.698 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.4 t0 55.33 84.0 0.08 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 128.561 3.663 . . . . 0.0 110.587 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.673 HG22 ' O ' ' A' ' 21' ' ' MET . 20.2 tt -124.39 53.59 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 1 CA-C-N 107.988 -4.187 . . . . 0.0 107.237 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.55 -171.74 0.85 Allowed 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 113.239 -1.8 . . . . 0.0 113.584 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.444 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.5 m-85 65.75 46.92 2.22 Favored 'General case' 0 CA--C 1.501 -0.924 0 O-C-N 126.288 2.242 . . . . 0.0 116.518 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 88.86 163.04 0.06 Allowed 'General case' 0 C--O 1.2 -1.506 0 O-C-N 127.387 2.929 . . . . 0.0 107.858 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 t 122.38 -31.64 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.016 2 O-C-N 133.214 6.571 . . . . 0.0 109.142 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.438 ' CB ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -105.56 163.96 12.26 Favored 'General case' 0 C--O 1.243 0.725 1 O-C-N 132.357 6.036 . . . . 0.0 108.103 179.34 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 mttt 82.68 10.02 0.65 Allowed 'General case' 0 C--O 1.2 -1.53 0 O-C-N 127.63 3.081 . . . . 0.0 109.922 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.8 mp -145.36 -57.81 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.58 2 O-C-N 132.009 5.818 . . . . 0.0 107.357 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.486 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -82.92 62.15 6.33 Favored 'General case' 0 C--O 1.203 -1.377 0 CA-C-N 112.235 -2.257 . . . . 0.0 113.797 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.64 HG22 ' CZ ' ' A' ' 17' ' ' PHE . 3.2 t -83.81 -45.48 18.38 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.322 0 CA-C-N 111.032 -2.804 . . . . 0.0 109.589 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.447 ' CD ' ' HB2' ' A' ' 39' ' ' GLN . 1.0 OUTLIER 168.0 113.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.664 2 O-C-N 131.416 5.448 . . . . 0.0 109.475 179.793 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.689 HD12 ' N ' ' A' ' 38' ' ' THR . 0.4 OUTLIER -90.11 -9.08 49.7 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 127.496 2.997 . . . . 0.0 111.449 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.689 ' N ' HD12 ' A' ' 37' ' ' LEU . 0.8 OUTLIER 164.31 -65.19 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.135 0 O-C-N 128.158 3.411 . . . . 0.0 112.289 179.886 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.647 ' N ' HG22 ' A' ' 38' ' ' THR . 14.0 tm0? 66.58 146.5 0.04 OUTLIER 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.526 HG23 HG23 ' A' ' 8' ' ' THR . 20.1 m -162.01 104.77 1.17 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 130.837 3.655 . . . . 0.0 112.004 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.482 ' HZ3' ' HG ' ' A' ' 116' ' ' LEU . 0.8 OUTLIER -86.98 146.37 26.16 Favored 'General case' 0 N--CA 1.488 1.425 1 O-C-N 129.662 4.351 . . . . 0.0 109.054 -179.433 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.566 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.0 mt -134.84 154.91 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-N 114.506 -1.225 . . . . 0.0 110.574 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.568 HG13 ' CE1' ' A' ' 50' ' ' PHE . 13.7 tt -130.27 124.75 58.41 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 O-C-N 128.37 3.544 . . . . 0.0 107.463 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.2 t -98.36 -32.54 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.173 0 CA-C-N 113.303 -1.771 . . . . 0.0 111.501 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 8.16 91.03 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.02 0 O-C-N 127.38 2.925 . . . . 0.0 118.111 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.82 -35.05 15.03 Favored 'General case' 0 CA--C 1.477 -1.84 2 CA-C-N 106.678 -4.783 . . . . 0.0 114.857 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.17 -111.81 0.5 Allowed Glycine 0 C--O 1.204 -1.774 0 O-C-N 120.457 -1.402 . . . . 0.0 112.493 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -52.51 -28.11 19.2 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 125.964 1.626 . . . . 0.0 111.854 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -117.46 138.75 51.65 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 128.487 2.715 . . . . 0.0 109.279 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.621 ' CE2' HD22 ' A' ' 94' ' ' LEU . 1.7 t80 -149.73 113.54 5.07 Favored 'General case' 0 CA--C 1.483 -1.631 0 O-C-N 127.501 3.001 . . . . 0.0 113.014 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.4 mttm -119.19 82.81 1.93 Allowed 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.416 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -58.8 133.16 55.73 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 128.491 3.62 . . . . 0.0 106.719 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 62' ' ' ASP . 0.5 OUTLIER -144.43 154.3 42.81 Favored 'General case' 0 CA--C 1.488 -1.427 0 C-N-CA 115.087 -2.645 . . . . 0.0 111.453 -179.509 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 59' ' ' ARG . 0.9 OUTLIER -102.77 155.38 18.36 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 127.57 3.044 . . . . 0.0 111.658 -179.573 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -138.09 49.27 1.95 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.985 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -88.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 1 O-C-N 130.971 5.169 . . . . 0.0 107.93 179.796 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 155.88 -33.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.18 1 O-C-N 131.577 5.548 . . . . 0.0 104.313 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.486 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 8.6 m-85 -69.03 -49.37 58.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 125.955 2.035 . . . . 0.0 108.098 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.459 ' O ' HG22 ' A' ' 54' ' ' THR . 0.2 OUTLIER -155.23 120.18 4.85 Favored 'General case' 0 C--N 1.364 1.227 2 CA-C-N 106.869 -4.696 . . . . 0.0 112.845 179.378 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 m-20 -104.85 21.94 16.08 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 111.232 -2.713 . . . . 0.0 111.724 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -117.29 98.52 6.48 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 128.586 3.679 . . . . 0.0 109.622 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.465 ' HB2' ' HA ' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -108.95 -79.7 0.58 Allowed 'General case' 0 C--O 1.205 -1.25 1 O-C-N 129.298 4.124 . . . . 0.0 113.361 -179.994 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.586 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 1.1 tp -125.54 119.53 28.4 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -144.75 88.85 1.93 Allowed 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.568 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -150.12 -163.61 1.82 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 123.451 1.595 . . . . 0.0 110.23 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -145.59 152.24 39.38 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.415 HG21 ' CD1' ' A' ' 89' ' ' TRP . 3.1 t -61.55 130.94 26.35 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.586 0 C-N-CA 116.724 -1.991 . . . . 0.0 113.544 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.14 -0.73 89.33 Favored Glycine 0 N--CA 1.486 1.998 0 CA-C-N 110.763 -2.926 . . . . 0.0 116.461 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.579 HG12 ' N ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -49.85 -39.13 14.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 125.208 1.181 . . . . 0.0 109.66 -179.654 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.435 ' N ' HG12 ' A' ' 69' ' ' VAL . 4.3 tt0 57.17 65.14 1.44 Allowed 'General case' 0 C--O 1.211 -0.946 1 O-C-N 130.67 4.981 . . . . 0.0 108.546 -179.262 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.691 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.1 t80 -49.16 92.65 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.68 2 O-C-N 133.421 6.701 . . . . 0.0 110.866 -179.384 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.428 ' C ' ' HG3' ' A' ' 73' ' ' GLU . 39.6 t0 -57.29 63.84 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.997 0 O-C-N 126.403 2.314 . . . . 0.0 113.93 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.482 ' HB3' ' CB ' ' A' ' 82' ' ' ASN 0.258 5.3 mt-10 56.36 -170.59 0.08 Allowed 'General case' 0 CA--C 1.484 -1.574 0 CA-C-O 125.373 2.511 . . . . 0.0 110.05 179.743 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.75 93.11 0.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 109.225 -3.625 . . . . 0.0 109.004 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.43 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 2.0 p -96.07 -55.86 2.83 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 111.301 -2.681 . . . . 0.0 116.91 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.43 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 48.1 165.31 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.933 1 O-C-N 129.348 4.155 . . . . 0.0 115.562 -179.515 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.18 -51.39 3.42 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 112.36 -2.2 . . . . 0.0 112.497 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.647 ' O ' HD12 ' A' ' 26' ' ' ILE 0.267 2.5 tp -119.8 -0.79 10.63 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 127.975 2.809 . . . . 0.0 117.417 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -154.99 -74.08 0.11 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 116.545 -2.062 . . . . 0.0 113.199 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.93 72.88 1.28 Allowed Glycine 0 C--O 1.212 -1.219 0 CA-C-O 122.578 1.099 . . . . 0.0 111.825 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.423 ' CG ' ' H ' ' A' ' 82' ' ' ASN . 0.8 OUTLIER -136.89 -148.45 0.28 Allowed 'General case' 0 C--N 1.351 0.651 0 CA-C-N 110.185 -3.007 . . . . 0.0 109.107 -179.769 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.482 ' CB ' ' HB3' ' A' ' 73' ' ' GLU . 40.6 m-20 -161.69 100.15 1.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 125.637 1.835 . . . . 0.0 109.516 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 40.4 t -129.13 146.81 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 O-C-N 127.265 2.853 . . . . 0.0 118.534 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -79.87 88.23 5.29 Favored 'General case' 0 C--O 1.218 -0.595 1 O-C-N 130.423 4.827 . . . . 0.0 108.254 179.436 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.691 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 8.0 m -99.22 85.83 3.29 Favored 'General case' 0 C--O 1.193 -1.882 1 O-C-N 130.258 4.724 . . . . 0.0 114.034 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.644 HD23 ' N ' ' A' ' 87' ' ' VAL . 7.9 tt -89.63 155.71 19.06 Favored 'General case' 0 N--CA 1.442 -0.854 1 CA-C-N 107.509 -4.405 . . . . 0.0 110.238 179.822 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.644 ' N ' HD23 ' A' ' 86' ' ' LEU . 2.4 p -140.14 132.49 33.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 127.087 2.155 . . . . 0.0 109.692 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.473 ' HB ' HD21 ' A' ' 86' ' ' LEU . 6.8 t -155.8 -178.69 7.48 Favored 'General case' 0 CA--C 1.485 -1.55 0 CA-C-O 125.419 2.533 . . . . 0.0 111.584 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.732 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 58.5 m95 -99.25 145.6 27.1 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 118.577 -2.577 . . . . 0.0 108.647 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.648 ' HB2' HG23 ' A' ' 95' ' ' VAL . 7.2 tp10 -93.09 -44.45 8.37 Favored 'General case' 0 C--O 1.201 -1.455 1 CA-C-O 131.529 5.443 . . . . 0.0 112.15 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 174.93 -46.64 0.13 Allowed Glycine 0 N--CA 1.478 1.491 1 CA-C-N 106.634 -4.803 . . . . 0.0 104.464 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -141.48 36.53 1.67 Allowed 'General case' 0 C--O 1.202 -1.438 1 O-C-N 130.305 4.18 . . . . 0.0 110.881 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 90' ' ' GLU . 3.6 t -176.09 158.72 2.02 Favored 'General case' 0 C--O 1.203 -1.354 0 N-CA-C 118.048 2.61 . . . . 0.0 118.048 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.621 HD22 ' CE2' ' A' ' 50' ' ' PHE . 6.4 tp -90.01 94.55 9.84 Favored 'General case' 0 CA--C 1.492 -1.258 0 O-C-N 128.613 3.695 . . . . 0.0 117.244 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.648 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.366 38.2 t -91.91 126.72 44.47 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-N 108.816 -3.811 . . . . 0.0 111.923 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 4.4 m -131.64 123.74 28.47 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 127.077 2.736 . . . . 0.0 103.795 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.1 t -96.31 119.73 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 110.854 -2.884 . . . . 0.0 112.657 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.544 ' HG3' ' CB ' ' A' ' 105' ' ' ARG 0.307 0.1 OUTLIER -94.68 104.24 16.16 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 110.895 -2.866 . . . . 0.0 107.886 179.647 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.9 106.92 12.52 Favored 'General case' 0 C--O 1.206 -1.227 0 O-C-N 127.27 2.856 . . . . 0.0 110.681 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -120.47 -169.12 13.86 Favored Glycine 0 C--O 1.209 -1.415 0 CA-C-O 124.033 1.907 . . . . 0.0 109.57 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -72.69 -13.39 61.34 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 108.376 -3.912 . . . . 0.0 112.459 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -160.63 -43.24 0.05 OUTLIER 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 117.407 2.373 . . . . 0.0 117.407 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.505 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 28.4 mt-10 -56.04 144.78 27.69 Favored 'General case' 0 C--O 1.208 -1.121 0 O-C-N 126.716 2.51 . . . . 0.0 117.668 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.466 ' O ' HG23 ' A' ' 121' ' ' THR . 94.2 m-20 -127.11 60.56 1.38 Allowed 'General case' 0 N--CA 1.491 1.593 1 CA-C-N 107.597 -4.365 . . . . 0.0 102.0 179.651 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.721 ' NE ' HD22 ' A' ' 24' ' ' LEU . 0.7 OUTLIER -69.32 -15.54 63.36 Favored 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.118 5.261 . . . . 0.0 113.792 -179.667 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.518 ' N ' ' HG2' ' A' ' 98' ' ' GLN . . . -21.11 96.08 0.01 OUTLIER Glycine 0 C--O 1.21 -1.346 2 O-C-N 134.041 7.088 . . . . 0.0 115.351 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.586 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.315 0.0 OUTLIER -114.38 129.77 56.66 Favored 'General case' 0 C--O 1.196 -1.727 1 O-C-N 132.259 5.329 . . . . 0.0 110.389 179.762 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.9 ptpt -158.03 168.02 28.27 Favored 'General case' 0 C--N 1.354 0.774 1 O-C-N 130.681 4.988 . . . . 0.0 117.91 -178.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.484 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 2.3 mp0 -125.26 172.68 9.36 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 115.2 -2.333 . . . . 0.0 110.799 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.464 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER 175.41 71.12 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.977 1 O-C-N 130.222 4.702 . . . . 0.0 117.948 -179.586 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 44.9 t -18.45 116.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.484 -1.583 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -127.18 68.99 1.28 Allowed 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.81 100.61 0.06 OUTLIER Glycine 0 C--O 1.207 -1.537 0 CA-C-O 118.129 -1.373 . . . . 0.0 115.647 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 39.58 41.77 0.81 Allowed 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 10.3 pttm 177.2 170.06 0.56 Allowed 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 128.978 3.924 . . . . 0.0 107.769 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.561 HD23 ' CZ2' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -148.85 121.1 8.37 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 115.362 -2.535 . . . . 0.0 113.038 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.464 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 8.9 m-85 -67.15 154.84 40.26 Favored 'General case' 0 C--N 1.362 1.138 0 CA-C-N 111.374 -2.648 . . . . 0.0 112.895 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.464 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -130.21 39.88 3.6 Favored 'General case' 0 N--CA 1.476 0.833 2 O-C-N 131.418 5.449 . . . . 0.0 106.501 179.632 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 120' ' ' LEU . 0.1 OUTLIER -51.9 122.17 7.89 Favored 'General case' 0 CA--C 1.508 -0.651 0 O-C-N 128.853 3.846 . . . . 0.0 110.889 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.573 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -141.15 168.37 19.94 Favored 'General case' 0 CA--C 1.486 -1.51 1 O-C-N 130.33 4.769 . . . . 0.0 109.579 -179.811 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' ' 126' ' ' VAL . 2.1 t -135.16 175.73 9.32 Favored 'General case' 0 C--O 1.198 -1.621 0 O-C-N 127.112 2.758 . . . . 0.0 105.224 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.6 p 174.2 84.87 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.52 0 O-C-N 124.925 1.391 . . . . 0.0 111.115 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 71.91 39.64 58.89 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-O 123.749 1.749 . . . . 0.0 111.223 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.14 37.05 6.83 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 109.53 -3.335 . . . . 0.0 112.482 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -96.3 -13.3 23.43 Favored 'General case' 0 C--O 1.199 -1.586 0 O-C-N 127.125 2.765 . . . . 0.0 107.851 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.538 ' HA ' ' HA ' ' A' ' 121' ' ' THR . 35.6 m 27.57 60.55 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 C-N-CA 127.505 2.322 . . . . 0.0 115.144 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.0 t -55.02 112.09 0.98 Allowed 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 125.344 1.458 . . . . 0.0 111.793 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 53.4 ttm-85 -105.76 100.88 10.43 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -85.01 173.78 10.26 Favored 'General case' 0 CA--C 1.489 -1.389 0 CA-C-N 112.962 -1.926 . . . . 0.0 113.545 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.449 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 2.2 m -135.88 157.12 38.34 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.464 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 63.6 m-85 -140.96 175.83 9.3 Favored 'General case' 0 CA--C 1.493 -1.215 0 O-C-N 128.196 3.435 . . . . 0.0 115.718 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.293 0.0 OUTLIER -163.96 119.81 1.62 Allowed 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 110.731 -2.941 . . . . 0.0 103.606 179.834 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.563 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 9.2 tttt -53.09 126.17 19.79 Favored 'General case' 0 C--O 1.198 -1.614 0 O-C-N 127.176 2.798 . . . . 0.0 110.72 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.124 0 O-C-N 125.712 1.882 . . . . 0.0 115.972 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.74 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -101.31 81.31 2.19 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -101.11 -83.45 0.45 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 113.725 -3.036 . . . . 0.0 108.127 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.9 113.02 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.733 1 O-C-N 129.191 4.057 . . . . 0.0 114.451 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.56 -130.72 1.84 Allowed Glycine 0 C--O 1.207 -1.569 0 O-C-N 126.52 2.388 . . . . 0.0 112.472 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.494 HG23 HG23 ' A' ' 40' ' ' THR . 1.2 m -174.57 144.01 0.84 Allowed 'General case' 0 C--N 1.314 -0.954 1 O-C-N 130.661 4.389 . . . . 0.0 106.398 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.592 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.2 134.8 22.15 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 111.967 -2.379 . . . . 0.0 114.621 -179.539 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -69.54 -14.81 63.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.599 ' HE2' ' HB2' ' A' ' 41' ' ' LYS . 5.2 ttp 55.2 57.74 5.26 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -17.88 -49.6 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.883 0 O-C-N 128.514 3.634 . . . . 0.0 111.903 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.3 165.39 28.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 110.273 -3.148 . . . . 0.0 111.406 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.24 129.91 11.56 Favored 'General case' 0 CA--C 1.482 -1.651 0 CA-C-N 110.42 -3.082 . . . . 0.0 111.466 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' A' ' 17' ' ' PHE . 7.0 mm-40 -88.46 -174.59 4.65 Favored 'General case' 0 CA--C 1.496 -1.125 1 O-C-N 129.471 4.232 . . . . 0.0 112.119 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 33.24 -81.76 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.55 0 C-N-CA 125.855 1.662 . . . . 0.0 113.763 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.424 ' N ' ' O ' ' A' ' 15' ' ' GLU . 1.4 t80 73.81 -59.39 0.56 Allowed 'General case' 0 C--O 1.203 -1.364 0 O-C-N 126.203 2.189 . . . . 0.0 113.165 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.418 ' OE1' ' N ' ' A' ' 19' ' ' GLY . 0.5 OUTLIER -76.4 -48.86 18.35 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.536 -1.665 . . . . 0.0 115.241 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.471 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.47 -19.92 28.36 Favored Glycine 0 CA--C 1.494 -1.222 0 CA-C-O 116.934 -2.037 . . . . 0.0 112.893 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -36.89 38.96 Favored 'General case' 0 C--O 1.21 -0.983 0 O-C-N 128.13 2.9 . . . . 0.0 106.387 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.595 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -75.45 -25.57 57.56 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 111.048 -2.796 . . . . 0.0 107.554 179.53 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.471 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -79.92 -28.76 39.74 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 129.065 2.946 . . . . 0.0 114.238 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.53 -28.67 66.21 Favored 'General case' 0 N--CA 1.477 0.912 2 O-C-N 130.818 5.074 . . . . 0.0 113.344 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.963 HD11 ' HB ' ' A' ' 26' ' ' ILE . 4.1 pp -103.04 -4.39 24.66 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 127.946 3.279 . . . . 0.0 108.999 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 54.25 82.59 0.09 Allowed 'General case' 0 CA--C 1.484 -1.571 0 C-N-CA 131.027 3.731 . . . . 0.0 114.519 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.963 ' HB ' HD11 ' A' ' 24' ' ' LEU . 16.2 tt -111.65 42.76 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-N 111.501 -2.591 . . . . 0.0 106.883 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.531 ' O ' ' CG ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -47.21 151.53 0.69 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 114.247 -2.787 . . . . 0.0 108.957 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.531 ' CG ' ' O ' ' A' ' 27' ' ' ASP . 4.8 m-30 147.12 -27.68 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.783 1 O-C-N 131.276 5.36 . . . . 0.0 111.28 179.169 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 90.52 73.32 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.542 0 O-C-N 127.049 2.718 . . . . 0.0 108.125 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -26.43 27.76 Favored 'General case' 0 C--O 1.212 -0.899 1 CA-C-N 105.708 -5.224 . . . . 0.0 111.816 179.761 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.412 ' HG2' ' CB ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -89.93 -171.24 3.08 Favored 'General case' 0 C--N 1.319 -0.739 1 O-C-N 129.283 4.114 . . . . 0.0 110.874 -179.925 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 96.64 -37.64 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.415 1 O-C-N 130.905 5.128 . . . . 0.0 112.848 -179.663 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.9 OUTLIER -145.06 34.16 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 128.514 3.634 . . . . 0.0 108.675 -179.753 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -129.57 20.9 5.59 Favored 'General case' 0 C--O 1.206 -1.185 1 CA-C-O 128.63 4.062 . . . . 0.0 111.373 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.27 -40.75 57.57 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-N 108.542 -3.936 . . . . 0.0 110.038 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HD2' ' CB ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -177.47 99.0 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.858 0 CA-C-N 110.562 -3.017 . . . . 0.0 115.717 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.746 HD21 ' N ' ' A' ' 58' ' ' PHE . 1.4 pp -100.08 -1.26 37.3 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 105.41 -2.071 . . . . 0.0 105.41 178.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.577 ' N ' HD12 ' A' ' 37' ' ' LEU . 2.9 m 142.72 128.38 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.161 1 O-C-N 131.098 5.249 . . . . 0.0 110.393 -178.71 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.585 ' HG2' ' HE3' ' A' ' 11' ' ' MET . 0.6 OUTLIER -130.81 140.95 50.31 Favored 'General case' 0 CA--C 1.494 -1.178 0 O-C-N 126.3 2.25 . . . . 0.0 113.321 -179.359 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.494 HG23 HG23 ' A' ' 8' ' ' THR . 38.9 m -156.03 104.13 2.26 Favored 'General case' 0 C--O 1.21 -1.02 0 O-C-N 128.62 3.7 . . . . 0.0 114.371 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.621 ' HE3' HD11 ' A' ' 118' ' ' LEU . 0.0 OUTLIER -96.68 118.96 34.27 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.54 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.8 mp -105.92 155.79 6.83 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 1 O-C-N 129.289 4.118 . . . . 0.0 111.1 179.587 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.54 ' N ' HG22 ' A' ' 42' ' ' ILE 0.307 2.4 tt -132.05 141.18 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.41 0 O-C-N 127.555 3.035 . . . . 0.0 106.486 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.7 t -141.08 85.12 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.752 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.53 131.51 37.6 Favored 'General case' 0 CA--C 1.494 -1.182 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.439 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -140.78 -6.87 1.11 Allowed 'General case' 0 CA--C 1.483 -1.626 0 O-C-N 127.777 3.173 . . . . 0.0 118.06 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 115.21 102.88 2.42 Favored Glycine 0 N--CA 1.474 1.209 0 CA-C-N 120.752 1.615 . . . . 0.0 111.177 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 56.42 26.46 10.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 126.314 1.832 . . . . 0.0 112.102 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -173.5 85.57 0.05 Allowed 'General case' 0 C--O 1.22 -0.475 0 O-C-N 128.235 3.459 . . . . 0.0 112.704 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.683 ' CE1' HD22 ' A' ' 94' ' ' LEU . 35.9 t80 -108.36 119.18 38.75 Favored 'General case' 0 CA--C 1.502 -0.899 0 O-C-N 127.623 3.077 . . . . 0.0 113.99 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -128.15 100.72 5.97 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.536 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -78.21 124.1 27.68 Favored 'General case' 0 C--O 1.217 -0.638 0 O-C-N 129.019 3.95 . . . . 0.0 106.203 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.462 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -132.35 138.22 47.68 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 126.519 2.387 . . . . 0.0 111.232 -179.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.7 t -100.1 143.74 29.95 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 125.936 2.023 . . . . 0.0 110.11 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -118.16 37.54 3.97 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 112.148 -2.296 . . . . 0.0 115.626 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.464 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 63.3 m -96.51 106.79 19.1 Favored 'General case' 0 N--CA 1.476 0.864 1 O-C-N 131.643 5.589 . . . . 0.0 106.318 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.5 m -43.69 -48.42 7.88 Favored 'General case' 0 CA--C 1.501 -0.919 0 O-C-N 127.942 3.277 . . . . 0.0 110.761 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.746 ' N ' HD21 ' A' ' 37' ' ' LEU . 0.2 OUTLIER -50.89 -37.2 42.21 Favored 'General case' 0 C--N 1.365 1.245 0 O-C-N 126.421 2.325 . . . . 0.0 111.692 -179.714 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -169.31 124.84 0.87 Allowed 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 129.926 4.516 . . . . 0.0 117.941 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -115.56 79.07 1.24 Allowed 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 111.231 -2.713 . . . . 0.0 108.86 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -62.01 -47.31 85.34 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 126.934 2.646 . . . . 0.0 106.69 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 52.83 123.2 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 130.098 4.624 . . . . 0.0 117.154 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.915 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -86.06 95.04 9.4 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 127.173 2.796 . . . . 0.0 109.256 178.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -131.39 92.38 3.17 Favored 'General case' 0 C--O 1.208 -1.105 0 C-N-CA 116.409 -2.116 . . . . 0.0 109.597 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.433 ' CE2' ' HB ' ' A' ' 87' ' ' VAL . 0.1 OUTLIER -143.37 -141.78 0.13 Allowed 'General case' 0 CA--C 1.484 -1.582 0 CA-C-N 112.566 -2.106 . . . . 0.0 111.114 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.608 HG22 HG23 ' A' ' 69' ' ' VAL 0.26 0.8 OUTLIER -158.83 159.79 35.48 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 179.819 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.571 ' HA ' HG22 ' A' ' 87' ' ' VAL . 15.4 t -77.42 144.73 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 O-C-N 125.03 1.457 . . . . 0.0 111.732 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 75.21 1.48 64.12 Favored Glycine 0 CA--C 1.491 -1.434 0 CA-C-N 109.916 -3.311 . . . . 0.0 116.397 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.608 HG23 HG22 ' A' ' 66' ' ' THR 0.305 1.4 t -67.54 -45.77 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 CA-C-N 112.374 -1.913 . . . . 0.0 107.527 -179.944 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 72.9 92.3 0.08 Allowed 'General case' 0 C--N 1.353 0.72 0 CA-C-N 109.613 -3.449 . . . . 0.0 109.898 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.537 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.5 m-30 -71.55 82.82 0.83 Allowed 'General case' 0 C--N 1.356 0.879 0 O-C-N 128.085 3.366 . . . . 0.0 111.013 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 12.7 p30 -56.22 79.29 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 113.707 -1.588 . . . . 0.0 111.736 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 1.4 mt-10 56.38 89.71 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 123.182 1.468 . . . . 0.0 109.936 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.4 ' CD2' ' CE2' ' A' ' 71' ' ' PHE . 1.3 t60 -163.68 98.44 0.88 Allowed 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 111.69 -2.505 . . . . 0.0 115.107 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.42 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -127.81 -60.61 1.15 Allowed 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.33 -1.305 . . . . 0.0 111.139 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.437 ' HA ' ' HA2' ' A' ' 80' ' ' GLY . 0.1 OUTLIER 49.27 -178.86 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 128.428 3.966 . . . . 0.0 116.248 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.55 -84.7 0.27 Allowed Glycine 0 C--O 1.211 -1.326 0 CA-C-N 108.833 -3.803 . . . . 0.0 112.747 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.502 ' O ' HD12 ' A' ' 26' ' ' ILE . 5.4 tp -57.72 -60.98 2.87 Favored 'General case' 0 N--CA 1.451 -0.376 1 CA-C-N 107.481 -4.359 . . . . 0.0 114.285 179.874 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.662 ' HB2' HD13 ' A' ' 24' ' ' LEU . 8.1 t0 -115.09 -54.79 2.53 Favored 'General case' 0 CA--C 1.494 -1.187 0 O-C-N 126.928 2.642 . . . . 0.0 110.594 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 76' ' ' LYS . . . 68.64 89.25 0.07 OUTLIER Glycine 0 N--CA 1.473 1.129 0 CA-C-N 112.133 -2.303 . . . . 0.0 111.651 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.402 ' HD3' ' HA ' ' A' ' 81' ' ' ARG . 12.9 tpp85 -129.4 -131.65 0.21 Allowed 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 111.743 -2.228 . . . . 0.0 112.139 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.491 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 6.9 p-10 -164.09 81.05 0.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 117.997 -1.481 . . . . 0.0 107.729 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.466 HG12 ' C ' ' A' ' 99' ' ' LYS . 0.1 OUTLIER -126.31 133.41 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.505 0 N-CA-C 118.754 2.872 . . . . 0.0 118.754 -179.36 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.446 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -61.53 90.36 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.705 0 O-C-N 128.595 3.684 . . . . 0.0 107.421 179.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.537 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 94.6 m -86.73 58.14 4.89 Favored 'General case' 0 C--O 1.201 -1.49 0 CA-C-N 109.648 -3.433 . . . . 0.0 113.818 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.595 HD21 ' OG1' ' A' ' 88' ' ' THR . 8.4 tt -62.82 144.6 56.41 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 109.141 -3.663 . . . . 0.0 112.81 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.571 HG22 ' HA ' ' A' ' 67' ' ' VAL . 2.0 p -130.7 132.76 64.08 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 CA-C-N 110.812 -2.904 . . . . 0.0 109.466 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.595 ' OG1' HD21 ' A' ' 86' ' ' LEU 0.256 90.1 m -153.82 169.63 22.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 111.477 -2.601 . . . . 0.0 110.716 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.624 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 23.8 m95 -98.38 138.96 34.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 C-N-CA 128.55 2.74 . . . . 0.0 106.22 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.671 ' HB2' HG23 ' A' ' 95' ' ' VAL . 1.6 tt0 -95.96 -47.08 6.27 Favored 'General case' 0 CA--C 1.479 -1.773 1 CA-C-O 128.776 4.131 . . . . 0.0 116.292 -179.55 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -176.43 -51.65 0.06 OUTLIER Glycine 0 C--O 1.197 -2.196 0 CA-C-N 109.302 -3.59 . . . . 0.0 106.333 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.01 31.49 1.78 Allowed 'General case' 0 C--O 1.209 -1.036 1 O-C-N 131.945 5.144 . . . . 0.0 111.176 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.4 ' O ' ' N ' ' A' ' 90' ' ' GLU . 0.8 OUTLIER -167.83 165.46 13.97 Favored 'General case' 0 C--O 1.202 -1.425 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.683 HD22 ' CE1' ' A' ' 50' ' ' PHE . 2.1 tp -95.12 86.17 4.52 Favored 'General case' 0 C--O 1.204 -1.314 0 CA-C-N 111.138 -2.756 . . . . 0.0 117.477 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.671 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.344 2.5 t -82.25 125.82 39.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.737 0 CA-C-N 109.653 -3.43 . . . . 0.0 111.976 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.429 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 14.3 m -132.49 129.13 38.77 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 125.727 2.679 . . . . 0.0 105.24 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -114.19 77.57 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.58 0 CA-C-N 110.754 -2.93 . . . . 0.0 118.902 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.414 ' HB3' ' HB2' ' A' ' 105' ' ' ARG . 2.3 tt0 -60.62 111.44 1.61 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 119.682 -1.886 . . . . 0.0 108.088 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.466 ' C ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.27 143.5 35.96 Favored 'General case' 0 C--O 1.195 -1.813 0 C-N-CA 113.744 -3.182 . . . . 0.0 113.306 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 146.39 137.87 3.1 Favored Glycine 0 C--O 1.213 -1.159 0 C-N-CA 119.259 -1.448 . . . . 0.0 111.032 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 66.88 -59.92 0.36 Allowed 'General case' 0 C--N 1.353 0.753 0 CA-C-N 110.206 -2.997 . . . . 0.0 112.179 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.19 -31.81 0.05 Allowed 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.29 146.69 54.31 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 125.879 2.752 . . . . 0.0 117.311 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.404 ' O ' ' N ' ' A' ' 122' ' ' CYS . 11.6 m-20 -127.25 78.97 1.85 Allowed 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.224 -4.989 . . . . 0.0 101.683 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.414 ' HB2' ' HB3' ' A' ' 98' ' ' GLN . 6.9 mmm180 -98.42 3.11 48.39 Favored 'General case' 0 C--O 1.199 -1.602 1 O-C-N 131.078 5.237 . . . . 0.0 112.664 -179.634 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -33.56 85.66 0.01 OUTLIER Glycine 0 N--CA 1.428 -1.884 2 O-C-N 133.004 6.44 . . . . 0.0 114.929 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.915 ' CZ2' HD21 ' A' ' 63' ' ' LEU 0.273 0.0 OUTLIER -97.42 129.56 44.63 Favored 'General case' 0 C--O 1.197 -1.669 0 O-C-N 129.934 3.961 . . . . 0.0 109.807 179.308 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.03 156.67 36.33 Favored 'General case' 0 C--O 1.211 -0.942 0 O-C-N 129.011 3.944 . . . . 0.0 115.951 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.431 ' NE2' ' CD1' ' A' ' 107' ' ' TRP 0.299 39.2 mm-40 -114.05 165.97 12.09 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 111.201 -2.727 . . . . 0.0 110.927 -177.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -175.76 95.71 0.06 Allowed 'General case' 0 C--O 1.213 -0.858 1 O-C-N 129.986 4.553 . . . . 0.0 116.009 177.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.415 ' H ' HG23 ' A' ' 111' ' ' VAL . 48.3 t -38.85 98.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.91 0 CA-C-O 127.036 3.303 . . . . 0.0 112.277 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -104.2 56.19 0.72 Allowed 'General case' 0 CA--C 1.488 -1.408 0 CA-C-N 109.361 -3.563 . . . . 0.0 117.235 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 105.17 -111.61 3.79 Favored Glycine 0 C--O 1.205 -1.712 0 CA-C-N 113.593 -1.639 . . . . 0.0 113.09 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -112.74 19.36 17.49 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 117.413 2.375 . . . . 0.0 117.413 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 131' ' ' PHE . 4.5 pttt -158.91 163.43 36.56 Favored 'General case' 0 N--CA 1.476 0.825 2 O-C-N 131.189 5.306 . . . . 0.0 109.807 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.488 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 4.8 mt -105.39 173.13 6.44 Favored 'General case' 0 CA--C 1.494 -1.206 0 O-C-N 127.104 2.753 . . . . 0.0 112.503 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -133.9 93.73 3.15 Favored 'General case' 0 C--O 1.206 -1.206 0 O-C-N 127.95 3.281 . . . . 0.0 113.803 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.657 HD13 ' CZ ' ' A' ' 131' ' ' PHE . 2.3 mp -79.6 70.93 6.17 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 111.467 -2.606 . . . . 0.0 106.479 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -85.6 108.14 17.84 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 127.387 2.929 . . . . 0.0 109.075 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.505 HD21 ' HB3' ' A' ' 127' ' ' CYS . 0.6 OUTLIER -126.28 177.78 6.22 Favored 'General case' 0 N--CA 1.484 1.275 1 O-C-N 130.091 4.619 . . . . 0.0 113.013 179.83 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.1 m -125.76 170.55 11.46 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 110.593 -3.003 . . . . 0.0 105.364 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER -169.37 38.37 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 123.888 1.804 . . . . 0.0 111.592 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 117.18 -67.3 0.32 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 112.735 -2.03 . . . . 0.0 108.257 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -173.8 43.34 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.005 0 CA-C-N 109.661 -3.269 . . . . 0.0 109.932 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -120.86 4.89 10.49 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 111.669 -2.514 . . . . 0.0 110.006 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.51 ' O ' HG22 ' A' ' 126' ' ' VAL . 8.0 p 6.67 71.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 O-C-N 128.433 3.583 . . . . 0.0 114.925 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.505 ' HB3' HD21 ' A' ' 120' ' ' LEU . 0.5 OUTLIER -66.11 142.82 57.64 Favored 'General case' 0 C--O 1.219 -0.538 0 O-C-N 120.441 -1.412 . . . . 0.0 111.142 -179.532 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.61 147.54 48.68 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 128.432 3.583 . . . . 0.0 110.949 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -122.7 171.06 9.43 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 118.312 -1.355 . . . . 0.0 112.654 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.15 138.3 30.15 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.422 0 N-CA-C 103.543 -2.762 . . . . 0.0 103.543 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.657 ' CZ ' HD13 ' A' ' 118' ' ' LEU . 45.5 m-85 -126.31 179.97 5.03 Favored 'General case' 0 CA--C 1.488 -1.426 0 CA-C-O 128.149 3.833 . . . . 0.0 117.965 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER -161.89 113.35 1.68 Allowed 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 111.196 -2.729 . . . . 0.0 103.773 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.592 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 33.3 ttpt -58.07 89.77 0.01 OUTLIER 'General case' 0 C--O 1.194 -1.867 0 O-C-N 126.654 2.471 . . . . 0.0 115.299 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt . . . . . 0 C--O 1.26 1.616 0 O-C-N 127.866 3.229 . . . . 0.0 117.906 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 25.0 mttt . . . . . 0 CA--C 1.491 -1.326 0 CA-C-O 122.325 1.06 . . . . 0.0 113.096 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -72.02 -151.86 0.02 OUTLIER 'General case' 0 C--O 1.24 0.562 0 N-CA-C 104.531 -2.396 . . . . 0.0 104.531 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -171.14 135.89 1.03 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 103.28 -2.859 . . . . 0.0 103.28 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -51.43 124.76 12.71 Favored 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 131.456 5.472 . . . . 0.0 113.345 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.11 -173.95 43.97 Favored Glycine 0 C--O 1.206 -1.647 0 CA-C-O 116.426 -2.319 . . . . 0.0 113.895 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.702 HG23 HG23 ' A' ' 40' ' ' THR . 1.2 m -127.18 124.37 38.86 Favored 'General case' 0 C--O 1.209 -1.036 1 O-C-N 132.911 5.712 . . . . 0.0 104.937 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.509 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -118.0 90.35 3.31 Favored 'General case' 0 CA--C 1.493 -1.249 1 O-C-N 129.224 4.077 . . . . 0.0 114.467 179.882 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.57 100.19 0.05 OUTLIER 'General case' 0 C--O 1.218 -0.579 0 O-C-N 126.901 2.626 . . . . 0.0 108.039 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.408 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -33.37 -58.04 0.4 Allowed 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.04 3.337 . . . . 0.0 107.335 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 90.37 -28.21 0.04 OUTLIER 'General case' 0 C--O 1.199 -1.603 1 O-C-N 131.818 5.699 . . . . 0.0 111.006 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.256 3.3 p -175.7 177.25 1.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 124.513 2.102 . . . . 0.0 110.882 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -146.08 168.86 19.9 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 108.828 -3.805 . . . . 0.0 111.458 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -102.18 -107.09 0.25 Allowed 'General case' 0 CA--C 1.477 -1.841 2 O-C-N 133.237 6.586 . . . . 0.0 111.828 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -84.77 87.03 7.28 Favored 'General case' 0 C--O 1.21 -1.013 0 O-C-N 118.783 -2.448 . . . . 0.0 110.464 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.44 -52.23 65.45 Favored 'General case' 0 C--O 1.207 -1.176 0 CA-C-O 127.584 3.564 . . . . 0.0 112.62 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.469 ' CG ' ' HG3' ' A' ' 31' ' ' ARG . 1.1 mp0 -62.06 -51.79 66.54 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 112.297 -2.229 . . . . 0.0 116.379 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.483 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -53.07 -21.65 11.23 Favored Glycine 0 CA--C 1.484 -1.86 1 O-C-N 129.563 4.289 . . . . 0.0 113.651 -179.931 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.456 ' CD1' ' C ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -73.81 -45.7 49.81 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 126.237 2.922 . . . . 0.0 105.654 179.615 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.519 ' O ' HG22 ' A' ' 26' ' ' ILE . 24.6 mtm -71.73 -25.38 62.04 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 112.543 -2.117 . . . . 0.0 112.066 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.483 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 1.0 OUTLIER -79.73 -33.92 40.42 Favored 'General case' 0 C--O 1.215 -0.753 0 O-C-N 128.024 3.327 . . . . 0.0 114.989 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.97 78.0 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 109.462 -3.517 . . . . 0.0 113.675 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.661 ' O ' HD12 ' A' ' 24' ' ' LEU . 1.1 pp -84.19 -7.15 59.44 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 128.304 3.502 . . . . 0.0 108.093 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 46.35 93.67 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.59 0 CA-C-O 127.269 3.414 . . . . 0.0 111.105 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.519 HG22 ' O ' ' A' ' 21' ' ' MET . 19.7 tt -111.07 28.45 2.07 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 1 CA-C-O 129.093 4.282 . . . . 0.0 108.869 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.443 ' C ' ' CD1' ' A' ' 28' ' ' PHE . 30.5 m-20 77.03 53.35 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 CA-C-N 108.637 -3.892 . . . . 0.0 110.427 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.605 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER 12.15 69.97 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.104 1 O-C-N 130.319 4.762 . . . . 0.0 117.374 179.036 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.87 -175.01 2.91 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 112.591 -2.095 . . . . 0.0 106.677 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.474 HG21 HH21 ' A' ' 59' ' ' ARG . 3.2 m 93.57 -20.51 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 2 O-C-N 132.95 6.406 . . . . 0.0 114.707 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.511 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -77.53 -171.4 2.14 Favored 'General case' 0 N--CA 1.44 -0.936 1 O-C-N 130.83 5.081 . . . . 0.0 110.839 179.737 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.3 OUTLIER 75.75 21.26 1.69 Allowed 'General case' 0 CA--C 1.498 -1.034 0 O-C-N 128.749 3.78 . . . . 0.0 113.643 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.501 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -170.12 -40.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 O-C-N 128.917 3.886 . . . . 0.0 113.268 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.492 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -72.77 -12.91 61.19 Favored 'General case' 0 C--O 1.209 -1.048 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.56 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -15.03 -48.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 O-C-N 128.789 3.806 . . . . 0.0 114.659 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 14.7 tpt180 -177.79 144.56 0.37 Allowed 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 127.321 2.888 . . . . 0.0 115.219 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.788 ' C ' HD12 ' A' ' 37' ' ' LEU . 1.1 pp -175.52 147.96 0.88 Allowed 'General case' 0 CA--C 1.539 0.532 2 O-C-N 130.675 4.984 . . . . 0.0 109.005 178.73 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 m 1.97 58.42 0.0 OUTLIER 'General case' 0 CA--C 1.482 -1.653 1 O-C-N 133.467 6.729 . . . . 0.0 112.982 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 37' ' ' LEU . 1.4 tp60 -74.19 137.94 43.44 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.702 HG23 HG23 ' A' ' 8' ' ' THR . 2.9 m -150.6 124.28 9.13 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 109.524 -3.489 . . . . 0.0 114.782 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.68 ' NZ ' HD21 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -109.99 156.85 19.95 Favored 'General case' 0 N--CA 1.49 1.553 1 O-C-N 129.55 4.281 . . . . 0.0 101.938 179.044 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.53 HD12 ' HG2' ' A' ' 53' ' ' LYS . 66.3 mt -149.18 157.71 6.68 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 O-C-N 126.717 2.511 . . . . 0.0 112.198 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.503 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -142.02 135.79 29.24 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 109.014 -3.721 . . . . 0.0 105.981 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.1 t -119.35 -32.62 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.194 0 CA-C-N 112.032 -2.349 . . . . 0.0 116.449 -178.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 23.45 72.09 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -18.75 64.89 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 108.705 -3.861 . . . . 0.0 110.744 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.96 -95.92 0.16 Allowed Glycine 0 C--O 1.2 -2.016 0 CA-C-N 113.637 -1.619 . . . . 0.0 114.23 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -82.05 -27.44 32.99 Favored 'General case' 0 C--O 1.22 -0.497 0 O-C-N 125.874 1.573 . . . . 0.0 111.124 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.7 99.22 11.09 Favored 'General case' 0 CA--C 1.54 0.591 1 O-C-N 129.601 4.313 . . . . 0.0 108.462 179.32 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.554 ' CD2' HD13 ' A' ' 94' ' ' LEU . 90.5 t80 -100.38 104.16 15.58 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 128.447 3.592 . . . . 0.0 114.526 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 36.9 mttm -125.72 83.03 2.12 Favored 'General case' 0 CA--C 1.496 -1.115 1 O-C-N 129.181 4.051 . . . . 0.0 119.097 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.682 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.09 151.85 46.4 Favored 'General case' 0 C--N 1.362 1.146 1 O-C-N 129.281 4.113 . . . . 0.0 106.373 179.664 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.53 ' HG2' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -144.84 165.44 28.12 Favored 'General case' 0 CA--C 1.49 -1.342 0 C-N-CA 115.328 -2.549 . . . . 0.0 111.901 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -129.8 137.05 50.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 125.234 2.445 . . . . 0.0 108.171 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -119.7 51.15 1.19 Allowed 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 110.799 -2.91 . . . . 0.0 115.725 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.45 115.05 27.69 Favored 'General case' 0 N--CA 1.483 1.192 1 O-C-N 133.832 6.957 . . . . 0.0 105.178 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.3 p -45.11 -44.36 10.46 Favored 'General case' 0 CA--C 1.511 -0.541 1 O-C-N 129.361 4.163 . . . . 0.0 110.296 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.742 ' CE2' HD23 ' A' ' 37' ' ' LEU . 6.3 m-85 -48.75 -71.57 0.06 Allowed 'General case' 0 C--N 1.366 1.311 0 O-C-N 128.433 3.583 . . . . 0.0 110.499 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.474 HH21 HG21 ' A' ' 30' ' ' THR . 9.2 mmt180 -128.44 133.29 48.51 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-N 108.876 -3.784 . . . . 0.0 113.257 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -136.39 83.53 2.01 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 126.821 2.576 . . . . 0.0 107.32 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -99.37 -37.37 9.26 Favored 'General case' 0 C--N 1.32 -0.677 0 O-C-N 127.952 3.283 . . . . 0.0 108.672 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.63 152.01 0.06 Allowed 'General case' 0 C--O 1.199 -1.556 0 O-C-N 128.527 3.642 . . . . 0.0 116.684 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.682 ' HB2' HG22 ' A' ' 52' ' ' THR . 7.3 tp -99.33 73.88 1.9 Allowed 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 112.577 -2.101 . . . . 0.0 110.908 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.86 100.26 9.49 Favored 'General case' 0 CA--C 1.487 -1.449 0 O-C-N 126.998 2.686 . . . . 0.0 113.148 -179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.53 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 21.0 m-85 -127.01 -175.23 3.36 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 126.093 2.854 . . . . 0.0 106.994 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -134.75 115.24 13.51 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.351 -3.203 . . . . 0.0 102.351 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.54 HG21 ' CD1' ' A' ' 89' ' ' TRP . 2.4 p -46.72 123.84 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.483 -1.616 0 O-C-N 126.954 2.659 . . . . 0.0 116.083 -179.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 60.8 53.8 42.24 Favored Glycine 0 CA--C 1.487 -1.683 0 O-C-N 127.324 2.89 . . . . 0.0 117.923 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 69' ' ' VAL 0.277 1.8 p -122.26 10.25 5.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.354 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 52.44 72.9 0.37 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.377 5.423 . . . . 0.0 108.308 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.531 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 7.7 t80 -63.71 82.16 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.066 0 CA-C-N 108.582 -3.917 . . . . 0.0 118.325 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -65.13 84.94 0.05 Allowed 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 123.436 1.588 . . . . 0.0 109.417 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.534 ' HG2' HG23 ' A' ' 75' ' ' THR . 32.3 tt0 -71.14 148.91 46.92 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-O 124.819 2.247 . . . . 0.0 108.168 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 82' ' ' ASN . 2.9 m80 -140.6 59.39 1.55 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-N 110.257 -3.156 . . . . 0.0 109.852 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.534 HG23 ' HG2' ' A' ' 73' ' ' GLU . 27.9 p -35.22 146.65 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 110.391 -3.095 . . . . 0.0 114.73 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.81 144.04 0.07 Allowed 'General case' 0 C--O 1.212 -0.911 0 O-C-N 128.994 3.934 . . . . 0.0 111.396 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.91 2.48 64.66 Favored Glycine 0 C--O 1.205 -1.675 0 CA-C-N 111.55 -2.568 . . . . 0.0 107.43 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 tp -147.99 -57.86 0.24 Allowed 'General case' 0 CA--C 1.506 -0.72 1 O-C-N 131.185 4.697 . . . . 0.0 117.266 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -111.13 -62.59 1.52 Allowed 'General case' 0 CA--C 1.502 -0.875 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.06 64.79 1.29 Allowed Glycine 0 N--CA 1.476 1.365 0 CA-C-O 126.171 3.095 . . . . 0.0 109.808 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.42 ' N ' ' OG1' ' A' ' 75' ' ' THR . 5.4 tpt180 -145.75 -131.63 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 109.166 -3.517 . . . . 0.0 112.635 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.443 ' HA ' ' HA ' ' A' ' 74' ' ' HIS . 1.2 p-10 -164.15 -100.78 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 115.114 -2.374 . . . . 0.0 108.294 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.418 HG13 ' C ' ' A' ' 99' ' ' LYS . 21.2 t 91.82 146.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 O-C-N 128.544 3.653 . . . . 0.0 117.027 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.86 87.31 6.6 Favored 'General case' 0 C--O 1.219 -0.522 2 O-C-N 129.398 4.186 . . . . 0.0 107.289 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.531 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 61.7 m -96.41 86.15 4.1 Favored 'General case' 0 C--O 1.202 -1.404 0 O-C-N 128.229 3.456 . . . . 0.0 112.091 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 tp -87.24 94.69 9.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 108.595 -3.911 . . . . 0.0 116.259 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.2 t -74.4 141.74 15.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 O-C-N 119.586 -1.946 . . . . 0.0 108.763 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.587 HG23 ' HB ' ' A' ' 95' ' ' VAL . 9.3 t -164.04 172.73 13.44 Favored 'General case' 0 CA--C 1.488 -1.43 0 CA-C-O 126.87 3.224 . . . . 0.0 110.833 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.696 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 49.7 m95 -98.71 136.93 38.05 Favored 'General case' 0 N--CA 1.437 -1.101 0 O-C-N 117.916 -2.99 . . . . 0.0 109.377 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 1.034 ' HB2' HG23 ' A' ' 93' ' ' THR . 0.3 OUTLIER -93.1 -11.15 33.64 Favored 'General case' 0 CA--C 1.475 -1.94 1 CA-C-O 133.642 6.449 . . . . 0.0 113.966 179.569 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.34 -42.18 1.33 Allowed Glycine 0 C--O 1.198 -2.152 1 CA-C-N 107.588 -4.369 . . . . 0.0 104.594 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.406 ' C ' HG22 ' A' ' 93' ' ' THR . 0.2 OUTLIER -152.85 60.8 0.79 Allowed 'General case' 0 C--O 1.204 -1.312 1 O-C-N 131.594 4.938 . . . . 0.0 110.577 -179.768 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 1.034 HG23 ' HB2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.91 130.5 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.124 0 O-C-N 127.084 2.74 . . . . 0.0 118.048 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.554 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -74.13 92.32 2.18 Favored 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 130.323 4.765 . . . . 0.0 110.758 179.787 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.945 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.284 79.5 t -90.36 140.6 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 1 O-C-N 130.655 4.972 . . . . 0.0 115.248 -179.75 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.45 ' HB3' ' CZ3' ' A' ' 107' ' ' TRP . 4.5 t -143.95 122.71 12.63 Favored 'General case' 0 C--O 1.195 -1.778 0 O-C-N 125.573 1.796 . . . . 0.0 106.328 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.4 t -101.34 105.2 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.862 0 CA-C-N 111.172 -2.74 . . . . 0.0 111.902 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.509 ' NE2' ' HB3' ' A' ' 105' ' ' ARG . 5.1 mt-30 -86.29 100.79 12.53 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 123.822 1.772 . . . . 0.0 109.88 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.418 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.4 OUTLIER -97.12 96.75 8.67 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 110.037 -3.256 . . . . 0.0 110.507 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -93.29 -97.67 1.48 Allowed Glycine 0 C--O 1.206 -1.646 0 CA-C-N 112.719 -2.037 . . . . 0.0 110.891 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.64 -53.17 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 108.974 -3.613 . . . . 0.0 109.244 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -94.02 -39.61 10.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 111.047 -2.797 . . . . 0.0 112.833 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -115.96 146.63 41.94 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 111.163 -2.744 . . . . 0.0 114.899 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -106.07 97.54 7.34 Favored 'General case' 0 N--CA 1.478 0.957 2 O-C-N 130.29 4.743 . . . . 0.0 102.9 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.509 ' HB3' ' NE2' ' A' ' 98' ' ' GLN . 0.1 OUTLIER -101.5 5.46 41.89 Favored 'General case' 0 C--O 1.214 -0.781 1 O-C-N 130.483 4.864 . . . . 0.0 110.065 -179.724 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.464 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -45.75 93.68 0.01 OUTLIER Glycine 0 N--CA 1.426 -2.012 2 O-C-N 132.393 6.058 . . . . 0.0 114.277 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.6 ' HE1' ' NE2' ' A' ' 109' ' ' GLN 0.289 0.0 OUTLIER -108.24 136.32 48.09 Favored 'General case' 0 C--O 1.214 -0.802 1 O-C-N 132.262 5.331 . . . . 0.0 110.304 179.808 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.39 159.33 43.52 Favored 'General case' 0 CA--C 1.506 -0.728 1 O-C-N 131.121 5.263 . . . . 0.0 113.391 -178.637 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.6 ' NE2' ' HE1' ' A' ' 107' ' ' TRP 0.279 1.0 OUTLIER -134.04 123.53 24.68 Favored 'General case' 0 C--N 1.368 1.371 0 C-N-CA 115.999 -2.28 . . . . 0.0 111.172 -178.393 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.516 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -117.46 171.32 8.07 Favored 'General case' 0 CA--C 1.498 -1.031 0 O-C-N 128.987 3.93 . . . . 0.0 112.163 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.1 t -109.57 98.81 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.905 0 CA-C-O 124.499 2.095 . . . . 0.0 112.443 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -108.14 85.68 2.16 Favored 'General case' 0 CA--C 1.479 -1.766 0 CA-C-O 125.816 2.722 . . . . 0.0 113.317 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 90.25 -109.28 3.63 Favored Glycine 0 C--O 1.2 -2.024 0 CA-C-N 113.027 -1.897 . . . . 0.0 115.439 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -105.93 -7.78 17.99 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 114.572 -2.632 . . . . 0.0 113.829 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -127.1 174.06 9.2 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 133.132 6.52 . . . . 0.0 110.227 179.954 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.68 HD21 ' NZ ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -136.43 128.26 29.21 Favored 'General case' 0 C--O 1.202 -1.429 0 O-C-N 124.787 1.305 . . . . 0.0 110.517 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.516 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.1 m-85 -78.57 167.17 21.66 Favored 'General case' 0 C--O 1.202 -1.44 0 O-C-N 128.618 3.699 . . . . 0.0 110.11 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.565 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -140.45 59.54 1.55 Allowed 'General case' 0 CA--C 1.509 -0.624 1 CA-C-N 107.291 -4.504 . . . . 0.0 108.079 -179.845 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.2 109.26 1.48 Allowed 'General case' 0 CA--C 1.506 -0.722 0 O-C-N 127.525 3.016 . . . . 0.0 110.525 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.13 148.98 39.75 Favored 'General case' 0 CA--C 1.487 -1.461 1 O-C-N 130.044 4.59 . . . . 0.0 109.902 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 45.5 m -118.47 162.03 19.02 Favored 'General case' 0 C--O 1.208 -1.113 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -161.25 33.52 0.14 Allowed 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 124.2 1.952 . . . . 0.0 113.941 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 104.04 -94.49 1.08 Allowed Glycine 0 CA--C 1.505 -0.531 0 CA-C-N 111.428 -2.624 . . . . 0.0 112.272 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.85 -31.58 45.69 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 112.171 -2.014 . . . . 0.0 111.625 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -103.33 176.87 5.01 Favored 'General case' 0 C--O 1.214 -0.785 1 O-C-N 129.104 4.003 . . . . 0.0 109.332 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.1 m -156.19 87.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 CA-C-N 108.842 -3.799 . . . . 0.0 111.672 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 t -66.49 113.71 4.93 Favored 'General case' 0 CA--C 1.489 -1.392 0 C-N-CA 125.58 1.552 . . . . 0.0 112.765 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.73 93.58 9.31 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 117.612 -1.635 . . . . 0.0 110.858 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.501 ' OE1' HD13 ' A' ' 118' ' ' LEU . 51.6 mt-30 -75.82 165.54 24.86 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 117.532 2.419 . . . . 0.0 117.532 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.508 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -132.46 150.11 32.97 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.428 0 CA-C-O 124.373 2.035 . . . . 0.0 109.058 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.565 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 88.7 m-85 -148.89 175.13 11.53 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 110.854 -2.884 . . . . 0.0 116.509 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.492 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -155.78 137.05 13.88 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 111.9 -2.409 . . . . 0.0 104.98 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.443 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 5.7 ttpt -77.74 94.91 4.54 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 118.185 2.661 . . . . 0.0 118.185 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt . . . . . 0 C--O 1.259 1.557 0 CA-C-O 114.895 -2.479 . . . . 0.0 116.852 179.857 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 mttt . . . . . 0 CA--C 1.492 -1.275 0 N-CA-C 114.974 1.472 . . . . 0.0 114.974 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -67.92 -53.36 27.0 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.24 169.67 0.3 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.956 2.66 . . . . 0.0 107.468 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 26.31 120.04 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.43 1 O-C-N 129.361 4.163 . . . . 0.0 117.876 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -169.51 -128.32 1.0 Allowed Glycine 0 CA--C 1.532 1.112 0 CA-C-N 112.267 -2.242 . . . . 0.0 114.2 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.538 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 3.7 t 168.63 147.74 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.948 1 O-C-N 133.323 5.954 . . . . 0.0 106.479 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.538 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -145.72 103.02 3.74 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.496 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' N ' ' A' ' 12' ' ' GLU 0.259 1.8 mt-10 -64.56 92.49 0.09 Allowed 'General case' 0 C--O 1.213 -0.861 0 O-C-N 126.72 2.513 . . . . 0.0 108.52 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.594 ' HG3' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -42.26 96.01 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 1 O-C-N 130.227 4.704 . . . . 0.0 103.81 -179.917 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' GLU . 27.8 tt0 -35.81 -37.45 0.1 Allowed 'General case' 0 C--O 1.21 -1.014 1 O-C-N 130.383 4.802 . . . . 0.0 107.403 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.263 4.6 p 173.55 141.08 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 110.723 -2.944 . . . . 0.0 110.327 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -96.69 130.37 43.93 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 111.746 -2.479 . . . . 0.0 110.913 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -116.77 140.64 49.2 Favored 'General case' 0 CA--C 1.499 -1.01 0 O-C-N 128.047 3.342 . . . . 0.0 110.563 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 49.53 69.7 0.57 Allowed 'General case' 0 C--O 1.205 -1.287 0 CA-C-O 126.146 2.879 . . . . 0.0 109.963 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -95.38 -40.44 9.51 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 111.41 -2.632 . . . . 0.0 107.974 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -74.93 -39.13 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 111.183 -2.735 . . . . 0.0 111.089 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.09 -26.72 73.95 Favored Glycine 0 CA--C 1.487 -1.708 0 O-C-N 127.187 2.805 . . . . 0.0 110.771 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -71.61 -31.69 67.18 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 124.961 2.315 . . . . 0.0 109.054 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 12.0 mtt -75.11 -27.04 59.68 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.874 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -79.91 -31.24 40.15 Favored 'General case' 0 C--N 1.317 -0.814 1 O-C-N 133.475 6.734 . . . . 0.0 114.92 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.82 91.38 Favored 'General case' 0 C--O 1.208 -1.086 2 O-C-N 130.835 5.084 . . . . 0.0 113.621 -179.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.718 HD11 ' HB ' ' A' ' 26' ' ' ILE . 1.5 pp -103.09 -8.26 20.67 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 110.623 -2.99 . . . . 0.0 109.543 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 49.17 99.18 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.155 1 CA-C-O 128.565 4.031 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.718 ' HB ' HD11 ' A' ' 24' ' ' LEU . 7.3 tt -124.53 42.67 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 109.556 -3.474 . . . . 0.0 109.537 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 76.45 137.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.441 0 CA-C-N 110.339 -3.118 . . . . 0.0 107.479 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -106.0 -172.64 2.13 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 116.42 2.008 . . . . 0.0 116.42 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 58.03 30.85 19.85 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 124.443 2.068 . . . . 0.0 106.343 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.429 ' O ' HD11 ' A' ' 33' ' ' ILE . 0.5 OUTLIER -101.84 -16.05 16.7 Favored 'General case' 0 C--O 1.209 -1.057 1 CA-C-N 107.783 -4.281 . . . . 0.0 115.115 -179.916 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -86.57 -172.43 4.02 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 128.893 3.87 . . . . 0.0 109.949 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.46 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER 82.71 7.84 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 O-C-N 129.05 3.968 . . . . 0.0 113.254 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.429 HD11 ' O ' ' A' ' 30' ' ' THR . 0.3 OUTLIER -147.21 -41.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 128.561 3.663 . . . . 0.0 111.0 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.407 ' H ' HD12 ' A' ' 33' ' ' ILE . . . -90.5 24.93 2.44 Favored 'General case' 0 C--O 1.209 -1.032 0 CA-C-O 123.637 1.684 . . . . 0.0 113.865 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.436 ' C ' ' HD3' ' A' ' 36' ' ' ARG . 66.7 t -55.36 -27.41 20.48 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.399 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.203 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.436 ' HD3' ' C ' ' A' ' 35' ' ' VAL . 1.6 mpt_? 140.01 134.1 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.862 2 O-C-N 130.621 4.95 . . . . 0.0 108.975 179.141 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.516 ' CD2' ' CG ' ' A' ' 58' ' ' PHE . 0.3 OUTLIER -102.54 15.36 29.46 Favored 'General case' 0 N--CA 1.439 -1.019 2 O-C-N 130.377 4.798 . . . . 0.0 111.184 -179.703 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 173.54 -53.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.316 1 O-C-N 132.125 5.891 . . . . 0.0 111.113 179.64 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.433 ' NE2' ' HB3' ' A' ' 11' ' ' MET . 17.1 tt0 67.94 140.29 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 O-C-N 127.488 2.993 . . . . 0.0 115.439 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.0 m 162.42 109.39 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.82 1 O-C-N 131.189 5.305 . . . . 0.0 113.307 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.943 ' CE ' HD22 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -98.52 156.12 16.94 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 127.714 3.134 . . . . 0.0 106.764 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.488 HG22 ' N ' ' A' ' 43' ' ' ILE . 4.4 mp -135.99 162.94 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 O-C-N 128.58 3.675 . . . . 0.0 111.497 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.531 HD13 ' N ' ' A' ' 44' ' ' VAL 0.292 0.2 OUTLIER -134.5 133.25 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.566 1 CA-C-N 107.93 -4.214 . . . . 0.0 108.472 179.771 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.603 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.5 t -107.95 -64.71 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.312 0 CA-C-N 112.226 -2.261 . . . . 0.0 108.985 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.603 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.0 OUTLIER 56.01 91.96 0.03 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.01 -40.52 11.05 Favored 'General case' 0 CA--C 1.49 -1.328 2 O-C-N 131.031 5.207 . . . . 0.0 113.255 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.56 -93.23 0.09 OUTLIER Glycine 0 C--O 1.2 -1.977 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.808 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.51 -19.14 24.15 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 127.516 2.539 . . . . 0.0 110.332 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.43 110.93 23.29 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 129.078 3.986 . . . . 0.0 109.917 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.622 ' HD2' HD13 ' A' ' 94' ' ' LEU . 1.7 t80 -115.84 110.25 18.77 Favored 'General case' 0 CA--C 1.497 -1.061 0 O-C-N 127.53 3.019 . . . . 0.0 111.64 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 79.47 1.44 Allowed 'General case' 0 C--O 1.202 -1.401 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.85 160.75 5.49 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 127.216 2.822 . . . . 0.0 107.507 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.423 ' NZ ' HD13 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -161.91 148.87 14.02 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 115.226 -2.59 . . . . 0.0 110.301 -179.254 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 t -103.83 136.73 42.95 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-O 124.135 1.922 . . . . 0.0 109.618 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -92.55 6.86 45.67 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 115.908 -1.996 . . . . 0.0 113.038 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.4 m -47.61 102.85 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 O-C-N 131.638 5.587 . . . . 0.0 104.872 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 p -33.13 -43.82 0.11 Allowed 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.479 5.487 . . . . 0.0 109.364 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.516 ' CG ' ' CD2' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -51.37 -68.19 0.19 Allowed 'General case' 0 C--N 1.35 0.62 0 O-C-N 128.755 3.784 . . . . 0.0 111.31 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.12 135.16 30.63 Favored 'General case' 0 CA--C 1.508 -0.641 1 O-C-N 129.283 4.114 . . . . 0.0 111.962 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.57 100.4 7.11 Favored 'General case' 0 C--O 1.2 -1.503 0 O-C-N 128.835 3.835 . . . . 0.0 112.275 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -177.39 113.61 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 1 O-C-N 129.337 4.148 . . . . 0.0 108.186 -179.856 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -77.66 0.46 Allowed 'General case' 0 CA--C 1.495 -1.171 0 O-C-N 126.812 2.57 . . . . 0.0 116.56 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.997 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 9.8 tp -112.07 39.91 2.3 Favored 'General case' 0 N--CA 1.435 -1.207 0 N-CA-C 119.554 3.168 . . . . 0.0 119.554 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.09 101.99 0.26 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 104.276 -2.491 . . . . 0.0 104.276 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 1.019 ' CD1' HG21 ' A' ' 87' ' ' VAL . 2.2 m-85 -147.18 -175.23 4.75 Favored 'General case' 0 CA--C 1.496 -1.12 1 CA-C-O 128.726 4.108 . . . . 0.0 112.304 -179.633 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.529 ' CG2' HG21 ' A' ' 69' ' ' VAL . 2.0 m -150.74 166.45 30.4 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.481 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.747 HG21 ' CD1' ' A' ' 89' ' ' TRP . 14.0 t -96.07 130.4 44.8 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.33 0 O-C-N 127.395 2.934 . . . . 0.0 115.544 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.75 34.81 59.16 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.224 -1.941 . . . . 0.0 116.439 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.529 HG21 ' CG2' ' A' ' 66' ' ' THR . 15.0 t -118.21 55.92 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 117.528 -1.225 . . . . 0.0 109.601 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -15.42 86.13 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.801 1 O-C-N 131.934 5.771 . . . . 0.0 115.612 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.496 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.3 m-85 -59.74 94.09 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 109.528 -3.487 . . . . 0.0 114.082 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 80.27 0.3 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 126.984 2.677 . . . . 0.0 108.654 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.447 ' CD ' ' HB3' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 67.57 150.92 0.07 Allowed 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 125.408 2.528 . . . . 0.0 112.929 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.97 62.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 108.88 -3.782 . . . . 0.0 116.166 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.404 ' C ' ' CG ' ' A' ' 76' ' ' LYS . 55.9 p -136.09 115.94 13.12 Favored 'General case' 0 C--O 1.211 -0.954 0 O-C-N 119.434 -2.041 . . . . 0.0 109.743 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.404 ' CG ' ' C ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -155.24 -64.1 0.12 Allowed 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 126.501 3.048 . . . . 0.0 111.561 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -47.96 -37.76 16.28 Favored Glycine 0 N--CA 1.468 0.831 0 CA-C-N 109.289 -3.596 . . . . 0.0 111.516 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . 0.281 1.5 tp -124.28 32.89 5.4 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.705 ' HB2' HD13 ' A' ' 24' ' ' LEU . 2.3 t0 174.46 -83.43 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 123.499 1.618 . . . . 0.0 112.983 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.93 76.91 0.99 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.674 2.083 . . . . 0.0 110.57 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -148.74 -133.19 0.06 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 111.275 -2.462 . . . . 0.0 114.09 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.447 ' HB3' ' CD ' ' A' ' 73' ' ' GLU . 2.0 p30 177.95 105.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 125.199 1.562 . . . . 0.0 109.835 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.66 HG13 ' N ' ' A' ' 100' ' ' GLY . 99.6 t -136.67 134.04 48.81 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.299 0 N-CA-C 117.665 2.469 . . . . 0.0 117.665 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -60.56 107.88 0.75 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 112.116 -2.311 . . . . 0.0 106.809 178.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.496 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 94.9 m -109.77 65.55 0.62 Allowed 'General case' 0 C--O 1.204 -1.33 0 CA-C-O 126.34 2.971 . . . . 0.0 118.372 -178.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.441 ' HB3' HG23 ' A' ' 97' ' ' VAL . 4.7 tt -65.78 142.3 58.02 Favored 'General case' 0 CA--C 1.514 -0.426 1 CA-C-N 108.04 -4.164 . . . . 0.0 112.602 179.633 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 1.019 HG21 ' CD1' ' A' ' 65' ' ' PHE . 30.8 t -125.35 144.62 34.78 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 CA-C-N 110.995 -2.82 . . . . 0.0 109.682 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.619 ' HA ' HG13 ' A' ' 67' ' ' VAL . 3.6 t -159.72 170.54 21.32 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-O 125.743 2.687 . . . . 0.0 110.117 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.747 ' CD1' HG21 ' A' ' 67' ' ' VAL . 32.4 m95 -94.22 145.26 24.84 Favored 'General case' 0 CA--C 1.507 -0.703 0 C-N-CA 128.015 2.526 . . . . 0.0 106.156 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.606 ' HB2' HG23 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -95.82 -36.28 11.19 Favored 'General case' 0 C--O 1.197 -1.681 1 CA-C-O 129.888 4.661 . . . . 0.0 113.109 179.708 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.46 -47.02 0.44 Allowed Glycine 0 N--CA 1.481 1.659 1 CA-C-N 107.361 -4.472 . . . . 0.0 106.078 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -122.84 2.17 9.4 Favored 'General case' 0 N--CA 1.429 -1.49 1 O-C-N 132.74 5.612 . . . . 0.0 113.207 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.489 ' CB ' ' HA ' ' A' ' 110' ' ' TRP . 1.3 t -160.65 175.68 12.39 Favored 'General case' 0 C--O 1.202 -1.43 0 N-CA-C 119.407 3.114 . . . . 0.0 119.407 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.743 HD11 ' CG1' ' A' ' 87' ' ' VAL 0.257 2.9 tp -92.34 106.59 18.56 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 109.872 -3.331 . . . . 0.0 114.805 179.633 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.606 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.327 41.1 t -108.15 126.09 64.78 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.136 0 CA-C-N 111.003 -2.817 . . . . 0.0 111.862 179.506 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.448 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -137.56 150.69 47.68 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 122.255 1.026 . . . . 0.0 108.999 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.441 HG23 ' HB3' ' A' ' 86' ' ' LEU . 6.0 m -130.79 108.08 14.88 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.545 0 CA-C-O 127.229 3.395 . . . . 0.0 118.046 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.563 ' HB3' HG11 ' A' ' 83' ' ' VAL . 2.9 mm-40 -85.09 112.19 20.43 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 112.243 -2.253 . . . . 0.0 108.007 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -51.68 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 128.419 3.574 . . . . 0.0 112.585 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.66 ' N ' HG13 ' A' ' 83' ' ' VAL . . . 79.75 155.09 9.75 Favored Glycine 0 C--O 1.219 -0.811 0 CA-C-O 124.276 2.042 . . . . 0.0 109.128 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.29 -16.27 14.62 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 110.704 -2.748 . . . . 0.0 111.276 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -50.06 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 127.131 2.172 . . . . 0.0 113.122 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -97.04 166.56 11.54 Favored 'General case' 0 C--O 1.198 -1.633 0 CA-C-O 123.295 1.522 . . . . 0.0 113.486 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.484 ' O ' HG23 ' A' ' 121' ' ' THR . 7.0 m-20 -124.48 97.33 5.26 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 108.752 -3.84 . . . . 0.0 103.398 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.456 ' HD3' ' HB3' ' A' ' 122' ' ' CYS . 0.1 OUTLIER -89.65 2.38 54.82 Favored 'General case' 0 C--O 1.203 -1.36 0 C-N-CA 125.071 1.348 . . . . 0.0 113.421 -179.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.446 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -46.06 115.48 1.75 Allowed Glycine 0 C--O 1.203 -1.84 2 CA-C-N 108.177 -4.101 . . . . 0.0 112.506 179.816 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.997 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.262 0.0 OUTLIER -114.02 144.93 42.29 Favored 'General case' 0 C--O 1.193 -1.888 0 O-C-N 129.974 3.985 . . . . 0.0 110.344 179.218 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.3 169.74 21.53 Favored 'General case' 0 C--O 1.207 -1.141 1 O-C-N 129.851 4.47 . . . . 0.0 116.6 -179.053 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.525 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -138.42 157.4 46.28 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 109.221 -3.627 . . . . 0.0 109.503 -179.99 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.489 ' HA ' ' CB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -146.08 12.29 1.23 Allowed 'General case' 0 CA--C 1.502 -0.878 1 O-C-N 129.835 4.46 . . . . 0.0 116.044 179.228 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.464 HG22 HD12 ' A' ' 116' ' ' LEU . 5.8 t 34.22 55.4 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-O 127.226 3.393 . . . . 0.0 116.303 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -60.63 104.53 0.35 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 110.154 -3.203 . . . . 0.0 114.536 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 58.17 -84.1 0.01 OUTLIER Glycine 0 C--O 1.204 -1.771 0 CA-C-N 114.03 -1.441 . . . . 0.0 115.991 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -134.35 49.27 2.26 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 116.428 2.011 . . . . 0.0 116.428 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.405 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.322 -0.604 0 O-C-N 127.406 2.941 . . . . 0.0 109.488 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.943 HD22 ' CE ' ' A' ' 41' ' ' LYS . 3.3 tt -116.0 82.23 1.74 Allowed 'General case' 0 CA--C 1.484 -1.558 0 O-C-N 128.434 3.584 . . . . 0.0 116.597 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -54.05 109.26 0.45 Allowed 'General case' 0 CA--C 1.502 -0.866 0 CA-C-N 109.984 -3.28 . . . . 0.0 114.878 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.489 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -92.02 56.77 2.96 Favored 'General case' 0 C--N 1.36 1.059 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.0 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.04 140.33 58.38 Favored 'General case' 0 CA--C 1.489 -1.366 0 C-N-CA 126.838 2.055 . . . . 0.0 107.945 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.65 162.6 41.06 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 118.32 -1.352 . . . . 0.0 109.062 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 104' ' ' ASN . 2.7 t -134.43 151.53 51.24 Favored 'General case' 0 C--O 1.199 -1.579 0 O-C-N 127.147 2.78 . . . . 0.0 104.421 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.456 ' HB3' ' HD3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -141.53 30.99 1.69 Allowed 'General case' 0 CA--C 1.496 -1.11 0 CA-C-O 123.768 1.747 . . . . 0.0 114.506 -179.237 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 119.38 -61.15 0.49 Allowed Glycine 0 C--O 1.223 -0.541 0 CA-C-N 109.732 -3.394 . . . . 0.0 113.587 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -162.75 69.87 0.26 Allowed 'General case' 0 C--O 1.205 -1.271 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.447 ' C ' HG12 ' A' ' 126' ' ' VAL . 7.2 tp60 -140.71 -49.95 0.44 Allowed 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 110.659 -2.973 . . . . 0.0 109.85 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.533 ' O ' HG22 ' A' ' 126' ' ' VAL . 2.4 p 49.1 87.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.131 1 O-C-N 131.55 5.531 . . . . 0.0 112.337 -179.676 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -72.34 126.9 30.97 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 112.528 -2.124 . . . . 0.0 109.728 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 6.2 mmt85 -106.69 80.39 1.45 Allowed 'General case' 0 CA--C 1.484 -1.578 0 O-C-N 125.762 1.913 . . . . 0.0 112.37 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.11 161.71 2.28 Favored 'General case' 0 C--N 1.35 0.617 0 O-C-N 127.396 2.935 . . . . 0.0 114.548 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -152.42 109.32 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.211 0 CA-C-O 126.449 3.023 . . . . 0.0 104.838 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.594 ' CZ ' ' HG3' ' A' ' 11' ' ' MET . 4.2 m-85 -109.69 174.28 5.94 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-N 108.859 -3.791 . . . . 0.0 116.743 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -154.47 125.38 7.17 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 110.821 -2.9 . . . . 0.0 104.508 179.637 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.531 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 18.8 ttpt -70.63 116.05 10.51 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 128.206 3.441 . . . . 0.0 109.72 178.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.461 ' HB3' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.486 -1.513 0 N-CA-C 118.038 2.607 . . . . 0.0 118.038 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.1 mttt . . . . . 0 N--CA 1.443 -0.792 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 57.97 89.44 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 124.428 2.061 . . . . 0.0 108.142 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -148.96 47.21 1.0 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 112.945 -1.934 . . . . 0.0 107.633 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.24 148.88 0.11 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 127.409 2.943 . . . . 0.0 113.082 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.3 174.96 40.04 Favored Glycine 0 C--O 1.223 -0.567 0 CA-C-N 110.969 -2.832 . . . . 0.0 112.77 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.434 HG22 ' HG3' ' A' ' 134' ' ' LYS . 0.4 OUTLIER -116.77 136.87 52.62 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 130.104 4.061 . . . . 0.0 103.877 179.759 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.531 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.274 0.0 OUTLIER -138.88 100.2 3.98 Favored 'General case' 0 CA--C 1.495 -1.143 0 O-C-N 128.564 3.665 . . . . 0.0 112.085 -179.595 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.21 -24.4 0.46 Allowed 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 115.685 -2.102 . . . . 0.0 114.972 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.464 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 3.5 ttm 83.32 -67.58 0.07 Allowed 'General case' 0 C--O 1.244 0.813 0 O-C-N 128.364 3.54 . . . . 0.0 106.072 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.402 ' CB ' ' O ' ' A' ' 11' ' ' MET . 36.0 tt0 108.08 -44.77 0.0 OUTLIER 'General case' 0 C--O 1.206 -1.222 1 O-C-N 130.364 4.79 . . . . 0.0 111.231 179.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 177.39 153.64 0.26 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 109.004 -3.725 . . . . 0.0 110.73 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -123.69 134.71 53.68 Favored 'General case' 0 CA--C 1.486 -1.502 0 CA-C-N 111.809 -2.451 . . . . 0.0 111.943 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -73.27 -176.56 2.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 128.936 3.898 . . . . 0.0 111.572 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -9.54 80.73 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.082 0 CA-C-O 124.648 2.166 . . . . 0.0 115.479 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.532 ' CD2' ' HA ' ' A' ' 35' ' ' VAL . 8.3 t80 -80.94 -31.92 34.77 Favored 'General case' 0 C--O 1.203 -1.379 0 CA-C-N 110.038 -3.255 . . . . 0.0 110.258 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -78.24 -49.4 13.82 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 110.725 -2.943 . . . . 0.0 112.905 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.428 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -60.95 -21.59 59.12 Favored Glycine 0 C--N 1.342 0.915 0 O-C-N 127.92 3.262 . . . . 0.0 111.723 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.434 ' CE1' HD11 ' A' ' 120' ' ' LEU . 0.3 OUTLIER -75.24 -39.34 59.98 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 127.399 2.47 . . . . 0.0 105.701 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . 0.251 31.9 mtt -79.74 -23.96 41.91 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 112.533 -2.121 . . . . 0.0 111.631 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.428 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 9.4 ttpt -76.99 -23.84 52.27 Favored 'General case' 0 C--N 1.313 -1.007 0 O-C-N 128.798 3.811 . . . . 0.0 113.102 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -72.05 -54.62 9.29 Favored 'General case' 0 C--O 1.201 -1.451 1 O-C-N 129.906 4.504 . . . . 0.0 109.453 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.856 HD11 ' HB ' ' A' ' 26' ' ' ILE . 0.4 OUTLIER -74.33 -18.93 60.63 Favored 'General case' 0 N--CA 1.488 1.457 1 O-C-N 129.809 4.443 . . . . 0.0 106.237 -179.984 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 45.34 84.33 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.363 0 CA-C-O 126.441 3.02 . . . . 0.0 106.705 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.856 ' HB ' HD11 ' A' ' 24' ' ' LEU . 9.9 tt -94.8 -30.26 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.531 1 CA-C-N 107.866 -4.243 . . . . 0.0 115.353 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -168.55 -175.74 2.58 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 118.345 -2.722 . . . . 0.0 109.997 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -127.52 115.5 18.94 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 63.81 41.46 6.82 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.871 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.11 -5.13 50.97 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 128.725 3.766 . . . . 0.0 110.648 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -75.94 -162.8 0.24 Allowed 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 128.647 2.779 . . . . 0.0 109.236 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HG2' HG13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER 77.46 4.75 3.1 Favored 'General case' 0 CA--C 1.485 -1.549 0 O-C-N 127.424 2.953 . . . . 0.0 114.133 179.553 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.473 ' O ' HD22 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -147.71 -73.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-N 113.416 -1.72 . . . . 0.0 113.43 179.418 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.695 ' HA ' HD21 ' A' ' 37' ' ' LEU . . . -48.98 -19.85 0.45 Allowed 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.532 ' HA ' ' CD2' ' A' ' 17' ' ' PHE . 53.7 t -26.48 -48.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.584 0 O-C-N 126.463 2.352 . . . . 0.0 109.841 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.658 ' C ' HD23 ' A' ' 37' ' ' LEU . 4.6 tpp180 164.54 125.58 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.376 2 O-C-N 131.145 5.278 . . . . 0.0 111.41 178.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.711 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -142.42 85.45 1.91 Allowed 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 110.006 -3.27 . . . . 0.0 104.994 -179.9 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m 87.85 120.81 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.896 1 O-C-N 135.346 7.904 . . . . 0.0 110.689 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.464 ' HG2' ' CB ' ' A' ' 11' ' ' MET . 46.4 tp60 -135.8 141.72 44.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 120.513 1.506 . . . . 0.0 110.821 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 40' ' ' THR . 99.3 m -168.99 80.74 0.13 Allowed 'General case' 0 C--O 1.212 -0.879 2 O-C-N 132.258 5.974 . . . . 0.0 112.364 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.93 144.85 54.06 Favored 'General case' 0 N--CA 1.485 1.321 1 O-C-N 129.674 4.359 . . . . 0.0 103.415 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.488 ' N ' ' O ' ' A' ' 53' ' ' LYS . 4.2 mt -138.54 103.6 2.27 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.438 0 CA-C-O 124.087 1.899 . . . . 0.0 115.387 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.589 ' CD1' ' CE1' ' A' ' 50' ' ' PHE 0.289 0.3 OUTLIER -88.17 141.04 14.86 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 1 CA-C-N 107.753 -4.294 . . . . 0.0 108.81 179.8 . . . . . . . . 5 4 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.7 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.1 t -124.8 -66.5 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.367 0 CA-C-N 111.898 -2.41 . . . . 0.0 114.445 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.7 ' N ' HG12 ' A' ' 44' ' ' VAL . 9.6 mt-30 64.39 123.38 0.02 OUTLIER 'General case' 0 CA--C 1.488 -1.424 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -152.01 37.97 0.57 Allowed 'General case' 0 CA--C 1.489 -1.384 0 C-N-CA 114.563 -2.855 . . . . 0.0 116.362 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.0 93.22 0.54 Allowed Glycine 0 C--O 1.201 -1.954 0 CA-C-N 118.985 0.811 . . . . 0.0 111.575 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 53.22 43.92 30.9 Favored 'General case' 0 CA--C 1.507 -0.698 0 O-C-N 128.066 2.862 . . . . 0.0 113.449 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 179.68 96.06 0.02 OUTLIER 'General case' 0 C--O 1.232 0.175 1 O-C-N 129.465 4.228 . . . . 0.0 109.942 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.61 ' CD2' HD22 ' A' ' 94' ' ' LEU . 2.0 t80 -118.75 109.95 16.68 Favored 'General case' 0 CA--C 1.483 -1.613 1 O-C-N 130.094 4.621 . . . . 0.0 112.813 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 20.7 mttt -112.86 80.48 1.35 Allowed 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 118.951 2.945 . . . . 0.0 118.951 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.469 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -63.01 150.36 42.65 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 127.742 3.151 . . . . 0.0 105.668 179.072 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -159.14 133.36 7.71 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 115.845 -2.342 . . . . 0.0 110.502 -179.14 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.29 148.11 22.77 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 126.128 2.142 . . . . 0.0 111.006 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -112.16 48.35 0.99 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 127.305 2.878 . . . . 0.0 115.081 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.517 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 1.5 p -73.04 158.18 35.91 Favored 'General case' 0 N--CA 1.475 0.814 1 O-C-N 133.091 6.494 . . . . 0.0 105.166 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 57' ' ' THR . 1.0 OUTLIER -103.92 24.03 11.95 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 129.026 3.954 . . . . 0.0 107.141 179.51 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.568 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 14.5 p90 -137.36 -50.71 0.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.82 2.156 . . . . 0.0 116.82 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 -79.78 0.56 Allowed 'General case' 0 CA--C 1.503 -0.859 0 C-N-CA 115.238 -2.585 . . . . 0.0 116.781 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 64.82 67.9 0.53 Allowed 'General case' 0 C--O 1.2 -1.539 0 O-C-N 126.264 2.228 . . . . 0.0 108.883 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 -46.04 41.14 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 110.834 -2.894 . . . . 0.0 109.776 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 47.7 t0 74.24 122.13 0.04 OUTLIER 'General case' 0 CA--C 1.503 -0.838 1 O-C-N 130.437 4.836 . . . . 0.0 110.288 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 1.078 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 13.8 tp -77.14 47.45 0.55 Allowed 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.297 2.248 . . . . 0.0 112.028 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.464 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 54.8 t0 -63.08 96.88 0.1 Allowed 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 106.476 -1.676 . . . . 0.0 106.476 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -134.48 169.17 17.66 Favored 'General case' 0 N--CA 1.475 0.783 1 CA-C-O 129.828 4.632 . . . . 0.0 107.908 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.56 HG22 HG23 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -156.54 126.66 6.47 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 109.715 -3.402 . . . . 0.0 105.041 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.915 ' HA ' HG22 ' A' ' 87' ' ' VAL . 7.2 p -48.27 132.91 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 0 O-C-N 126.277 2.236 . . . . 0.0 116.15 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.14 -0.44 73.56 Favored Glycine 0 C--N 1.359 1.848 0 O-C-N 127.34 2.9 . . . . 0.0 116.943 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.56 HG23 HG22 ' A' ' 66' ' ' THR . 0.9 OUTLIER -65.08 -40.47 89.04 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 C-N-CA 118.398 -1.321 . . . . 0.0 109.565 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 65.12 88.41 0.11 Allowed 'General case' 0 C--N 1.361 1.096 0 O-C-N 128.337 3.523 . . . . 0.0 110.628 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.467 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.4 OUTLIER -70.44 75.94 0.56 Allowed 'General case' 0 C--O 1.216 -0.707 0 O-C-N 127.643 3.089 . . . . 0.0 110.743 -179.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -48.36 81.02 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 25.4 mt-10 60.47 -176.47 0.11 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 123.249 1.5 . . . . 0.0 107.9 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 47.7 t60 92.15 97.38 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 109.825 -3.352 . . . . 0.0 116.477 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.28 166.51 24.85 Favored 'General case' 0 C--O 1.198 -1.642 0 CA-C-N 112.111 -2.313 . . . . 0.0 108.925 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 172.07 -31.12 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 O-C-N 126.134 2.146 . . . . 0.0 113.187 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.7 -33.03 48.13 Favored Glycine 0 C--O 1.208 -1.511 0 N-CA-C 107.057 -2.417 . . . . 0.0 107.057 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.3 tp -140.68 101.49 4.09 Favored 'General case' 0 N--CA 1.448 -0.527 1 CA-C-N 107.427 -4.387 . . . . 0.0 115.399 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.794 ' HB2' HD13 ' A' ' 24' ' ' LEU . 23.4 t0 92.06 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.776 0 O-C-N 128.954 3.909 . . . . 0.0 113.489 179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.88 82.41 1.4 Allowed Glycine 0 N--CA 1.469 0.862 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.418 ' HB3' HG23 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -137.35 -170.4 2.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 111.476 -2.362 . . . . 0.0 109.663 -179.413 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.524 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.6 OUTLIER -135.59 87.79 2.35 Favored 'General case' 0 C--O 1.202 -1.431 0 O-C-N 127.552 3.032 . . . . 0.0 106.723 179.693 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.954 HG22 ' HA2' ' A' ' 100' ' ' GLY . 94.8 t -119.19 142.79 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.557 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -178.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.45 73.83 0.24 Allowed 'General case' 0 C--O 1.218 -0.604 0 O-C-N 127.22 2.825 . . . . 0.0 108.1 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.467 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 18.5 m -76.92 70.61 3.36 Favored 'General case' 0 C--O 1.195 -1.793 0 CA-C-N 109.76 -3.382 . . . . 0.0 112.096 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 165.98 7.82 Favored 'General case' 0 C--O 1.214 -0.788 1 CA-C-N 107.459 -4.428 . . . . 0.0 113.659 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.915 HG22 ' HA ' ' A' ' 67' ' ' VAL . 0.3 OUTLIER -157.52 116.5 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.364 0 CA-C-N 112.467 -2.151 . . . . 0.0 108.625 179.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.826 ' HA ' HG23 ' A' ' 67' ' ' VAL . 0.5 OUTLIER -150.0 173.98 13.23 Favored 'General case' 0 CA--C 1.474 -1.946 0 CA-C-N 110.574 -3.012 . . . . 0.0 111.023 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.701 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.0 m95 -96.71 151.67 19.41 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-O 114.832 -2.509 . . . . 0.0 107.982 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.631 ' HB2' HG23 ' A' ' 95' ' ' VAL . 7.0 tp10 -100.67 -40.55 7.31 Favored 'General case' 0 C--O 1.199 -1.597 1 CA-C-O 131.663 5.506 . . . . 0.0 112.143 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 176.35 -48.6 0.11 Allowed Glycine 0 C--O 1.207 -1.548 0 CA-C-N 108.723 -3.853 . . . . 0.0 105.708 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -151.09 41.73 0.75 Allowed 'General case' 0 N--CA 1.444 -0.748 1 O-C-N 130.586 4.345 . . . . 0.0 110.656 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.447 HG22 ' HB3' ' A' ' 90' ' ' GLU . 0.6 OUTLIER -172.37 153.86 3.07 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 112.091 -2.322 . . . . 0.0 115.367 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.61 HD22 ' CD2' ' A' ' 50' ' ' PHE . 3.1 tp -88.9 93.96 9.77 Favored 'General case' 0 CA--C 1.481 -1.684 0 O-C-N 128.32 3.513 . . . . 0.0 118.561 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.653 HG13 ' NZ ' ' A' ' 108' ' ' LYS 0.341 53.0 t -89.61 114.75 28.03 Favored 'Isoleucine or valine' 0 C--N 1.358 0.977 0 CA-C-N 113.014 -1.903 . . . . 0.0 112.72 178.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 75.4 m -119.41 110.35 16.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 103.333 -2.84 . . . . 0.0 103.333 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.56 74.36 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.482 -1.639 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.51 ' HB2' ' HA2' ' A' ' 106' ' ' GLY . 0.1 OUTLIER -53.49 100.19 0.03 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.694 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.4 OUTLIER -97.88 88.3 4.24 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-N 110.647 -2.979 . . . . 0.0 113.745 -178.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.954 ' HA2' HG22 ' A' ' 83' ' ' VAL . . . -62.66 -86.56 0.05 OUTLIER Glycine 0 CA--C 1.534 1.223 0 N-CA-C 106.631 -2.588 . . . . 0.0 106.631 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 177.25 -57.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 128.369 3.04 . . . . 0.0 111.312 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -37.07 18.79 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 110.653 -2.976 . . . . 0.0 115.62 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.431 ' HG3' ' CZ ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -120.35 175.97 5.71 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 110.297 -3.138 . . . . 0.0 111.988 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.466 ' HB2' ' CG2' ' A' ' 121' ' ' THR . 0.0 OUTLIER -124.69 115.83 21.39 Favored 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.637 -4.801 . . . . 0.0 102.212 179.267 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.431 ' CZ ' ' HG3' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -115.39 24.8 11.32 Favored 'General case' 0 C--O 1.209 -1.06 0 O-C-N 128.256 3.473 . . . . 0.0 108.217 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.51 ' HA2' ' HB2' ' A' ' 98' ' ' GLN . . . -81.65 129.29 8.95 Favored Glycine 0 N--CA 1.427 -1.953 2 O-C-N 133.492 6.745 . . . . 0.0 115.15 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 1.078 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.258 0.0 OUTLIER -115.57 136.22 53.29 Favored 'General case' 0 C--O 1.202 -1.409 0 O-C-N 129.554 3.737 . . . . 0.0 108.419 177.746 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.653 ' NZ ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -153.03 174.59 13.98 Favored 'General case' 0 C--O 1.206 -1.23 1 O-C-N 129.432 4.208 . . . . 0.0 114.484 -178.634 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.413 ' NE2' HD23 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -134.01 162.54 31.78 Favored 'General case' 0 C--N 1.361 1.102 0 CA-C-N 110.518 -3.037 . . . . 0.0 109.445 -179.502 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.523 ' CZ3' ' HD3' ' A' ' 108' ' ' LYS . 0.4 OUTLIER -170.0 66.47 0.05 Allowed 'General case' 0 C--N 1.31 -1.116 1 O-C-N 131.711 5.632 . . . . 0.0 115.799 -179.931 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.552 HG22 HD21 ' A' ' 116' ' ' LEU . 39.7 t -17.84 99.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.269 0 C-N-CA 128.213 2.605 . . . . 0.0 114.896 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.509 ' HB2' ' CE1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -94.08 38.54 1.08 Allowed 'General case' 0 CA--C 1.49 -1.361 0 CA-C-N 111.819 -2.446 . . . . 0.0 116.317 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.7 -100.82 1.02 Allowed Glycine 0 C--O 1.213 -1.191 0 O-C-N 126.448 2.343 . . . . 0.0 118.065 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -107.01 12.6 28.47 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.894 2.553 . . . . 0.0 117.894 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.402 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 6.6 pttt -157.08 150.03 23.68 Favored 'General case' 0 C--N 1.314 -0.936 1 O-C-N 129.437 4.211 . . . . 0.0 109.192 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.552 HD21 HG22 ' A' ' 111' ' ' VAL . 0.4 OUTLIER -84.34 174.16 10.35 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 126.203 2.189 . . . . 0.0 112.776 179.619 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.509 ' CE1' ' HB2' ' A' ' 112' ' ' GLU . 11.4 m-85 -146.9 89.61 1.83 Allowed 'General case' 0 C--O 1.213 -0.833 0 C-N-CA 115.129 -2.628 . . . . 0.0 112.513 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 118' ' ' LEU . 11.2 mt -83.01 58.86 4.61 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 110.08 -3.236 . . . . 0.0 108.423 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -76.32 91.96 3.29 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 129.713 3.205 . . . . 0.0 111.531 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.434 HD11 ' CE1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -90.73 -179.12 5.45 Favored 'General case' 0 N--CA 1.489 1.504 1 O-C-N 129.367 4.167 . . . . 0.0 110.365 179.628 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.466 ' CG2' ' HB2' ' A' ' 104' ' ' ASN . 18.3 m -129.38 159.08 37.32 Favored 'General case' 0 CA--C 1.492 -1.271 0 O-C-N 127.274 2.859 . . . . 0.0 105.792 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.55 73.27 0.37 Allowed 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 126.738 3.161 . . . . 0.0 113.268 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 63.76 33.29 86.83 Favored Glycine 0 C--O 1.217 -0.909 0 CA-C-N 110.218 -3.174 . . . . 0.0 112.151 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 79.24 51.72 0.03 OUTLIER 'General case' 0 CA--C 1.492 -1.26 0 O-C-N 128.854 3.326 . . . . 0.0 112.43 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.513 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 2.1 mm100 -129.8 24.24 5.36 Favored 'General case' 0 C--O 1.217 -0.614 0 O-C-N 127.572 3.045 . . . . 0.0 106.773 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.555 ' O ' HG22 ' A' ' 126' ' ' VAL . 7.7 p -10.91 79.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 CA-C-N 108.734 -3.848 . . . . 0.0 115.864 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 16.7 t -65.04 151.07 46.95 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.794 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 96.63 3.45 Favored 'General case' 0 CA--C 1.5 -0.967 0 O-C-N 125.101 1.5 . . . . 0.0 112.989 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -73.14 170.2 15.42 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 113.906 -3.118 . . . . 0.0 111.402 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 89.8 t -140.61 140.32 33.95 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.552 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.402 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 14.9 m-85 -123.2 -177.66 3.75 Favored 'General case' 0 CA--C 1.477 -1.857 0 CA-C-N 109.994 -3.275 . . . . 0.0 116.86 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.317 2.9 tptt -167.94 107.77 0.55 Allowed 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 103.218 -2.882 . . . . 0.0 103.218 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.459 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 23.0 ttpt -57.53 93.3 0.01 OUTLIER 'General case' 0 C--O 1.195 -1.796 0 O-C-N 127.094 2.746 . . . . 0.0 112.126 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.434 ' HG3' HG22 ' A' ' 8' ' ' THR . 0.8 OUTLIER . . . . . 0 C--O 1.265 1.876 0 O-C-N 126.85 2.593 . . . . 0.0 114.028 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.547 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 17.3 pttp . . . . . 0 CA--C 1.503 -0.863 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -81.27 87.41 6.12 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 125.778 1.924 . . . . 0.0 107.024 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -117.84 138.71 51.91 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -125.51 77.7 1.67 Allowed 'General case' 0 C--N 1.317 -0.845 0 O-C-N 128.348 3.53 . . . . 0.0 111.6 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -125.64 -144.96 6.34 Favored Glycine 0 C--O 1.204 -1.733 0 CA-C-N 111.199 -2.728 . . . . 0.0 114.32 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.44 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -160.41 152.28 20.04 Favored 'General case' 0 N--CA 1.478 0.968 1 O-C-N 133.395 5.997 . . . . 0.0 104.898 179.974 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.679 ' CZ2' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -150.21 122.55 8.42 Favored 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.922 2.639 . . . . 0.0 117.13 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.45 95.52 10.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 126.678 2.486 . . . . 0.0 106.096 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.513 ' HB3' ' CD ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -33.85 -37.78 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 O-C-N 128.516 3.635 . . . . 0.0 106.236 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 78.97 -70.73 0.1 Allowed 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 125.43 2.538 . . . . 0.0 112.206 179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -134.39 169.69 16.86 Favored 'General case' 0 N--CA 1.433 -1.296 1 CA-C-N 108.175 -4.102 . . . . 0.0 107.809 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.568 ' N ' ' ND2' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -146.47 137.79 24.44 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 108.471 -3.968 . . . . 0.0 112.251 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -79.63 -74.35 0.3 Allowed 'General case' 0 CA--C 1.505 -0.775 0 O-C-N 126.181 2.176 . . . . 0.0 109.033 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -96.87 140.76 30.94 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.796 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -144.05 -52.32 0.32 Allowed 'General case' 0 CA--C 1.491 -1.291 0 CA-C-N 112.488 -2.142 . . . . 0.0 111.179 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.403 ' N ' ' CG ' ' A' ' 17' ' ' PHE . 1.8 tm-20 -70.25 -48.95 54.63 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 124.484 1.114 . . . . 0.0 111.991 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.471 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -60.26 -22.19 58.03 Favored Glycine 0 CA--C 1.492 -1.376 1 O-C-N 129.219 4.074 . . . . 0.0 111.822 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.566 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -79.8 -38.53 32.81 Favored 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.545 ' HG3' ' CG2' ' A' ' 26' ' ' ILE 0.318 0.4 OUTLIER -70.37 -24.79 63.02 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 110.373 -3.103 . . . . 0.0 110.227 -179.598 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.471 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.53 -33.2 42.15 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 129.175 4.047 . . . . 0.0 112.697 179.705 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.45 ' HB2' ' HG2' ' A' ' 125' ' ' GLN . . . -61.59 -37.43 83.86 Favored 'General case' 0 C--O 1.207 -1.163 2 O-C-N 132.316 6.01 . . . . 0.0 113.979 -179.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.02 HD12 ' HB2' ' A' ' 79' ' ' ASP 0.351 2.3 mm? -74.87 -45.14 45.04 Favored 'General case' 0 C--O 1.211 -0.954 2 CA-C-N 106.38 -4.918 . . . . 0.0 109.041 -178.241 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.27 12.1 t70 91.83 46.35 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.512 3 O-C-N 133.302 6.626 . . . . 0.0 112.809 -179.892 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.545 ' CG2' ' HG3' ' A' ' 21' ' ' MET . 0.6 OUTLIER -105.28 21.33 3.57 Favored 'Isoleucine or valine' 0 C--N 1.361 1.104 1 CA-C-N 107.525 -4.398 . . . . 0.0 111.259 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -87.38 147.27 25.53 Favored 'General case' 0 C--N 1.359 0.988 0 CA-C-N 111.704 -2.498 . . . . 0.0 110.598 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -176.3 43.21 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.672 0 O-C-N 127.189 2.806 . . . . 0.0 113.242 179.867 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 69.22 48.48 0.66 Allowed 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 126.067 2.841 . . . . 0.0 109.392 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.491 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.3 OUTLIER -96.89 -45.78 6.49 Favored 'General case' 0 C--N 1.361 1.089 1 CA-C-N 107.231 -4.532 . . . . 0.0 114.386 -179.993 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.491 ' N ' HG22 ' A' ' 30' ' ' THR . 0.1 OUTLIER -62.89 -179.6 0.29 Allowed 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 114.504 -2.665 . . . . 0.0 111.392 -179.638 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.17 11.09 3.57 Favored 'General case' 0 CA--C 1.488 -1.406 1 O-C-N 130.881 5.113 . . . . 0.0 112.433 179.934 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.6 mt -147.9 -51.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.019 1 O-C-N 132.516 6.135 . . . . 0.0 111.043 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.438 ' HA ' ' CD2' ' A' ' 37' ' ' LEU . . . -77.62 1.72 18.81 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.523 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 t -51.74 -29.85 11.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 124.036 1.874 . . . . 0.0 109.971 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.685 ' HD2' ' HB3' ' A' ' 39' ' ' GLN . 0.0 OUTLIER 164.89 133.83 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 109.011 -3.722 . . . . 0.0 111.258 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.837 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.7 OUTLIER -157.94 96.85 1.5 Allowed 'General case' 0 C--O 1.215 -0.724 2 O-C-N 130.045 4.591 . . . . 0.0 108.081 179.152 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.1 m 62.77 52.65 2.7 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 128.677 3.736 . . . . 0.0 109.863 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.685 ' HB3' ' HD2' ' A' ' 36' ' ' ARG . 37.4 tt0 -74.3 154.38 38.95 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 113.047 -1.888 . . . . 0.0 112.104 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.459 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 82.7 m 177.59 125.3 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.209 1 O-C-N 132.754 6.284 . . . . 0.0 111.847 179.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.447 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 8.5 tmtt? -112.74 142.46 45.33 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 127.23 2.831 . . . . 0.0 107.668 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.527 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.5 mp -131.6 159.85 42.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 127.456 2.973 . . . . 0.0 111.044 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.527 ' N ' HG22 ' A' ' 42' ' ' ILE 0.262 0.0 OUTLIER -131.41 150.74 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.604 0 CA-C-N 110.912 -2.858 . . . . 0.0 107.968 179.98 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.634 HG12 ' N ' ' A' ' 45' ' ' GLN . 1.2 t -132.4 -54.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.029 0 C-N-CA 116.544 -2.062 . . . . 0.0 116.102 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.634 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.0 OUTLIER 44.48 88.52 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 -179.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.71 45.9 0.98 Allowed 'General case' 0 N--CA 1.481 1.095 1 O-C-N 129.322 4.139 . . . . 0.0 114.622 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.58 93.42 0.36 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-O 117.8 -1.556 . . . . 0.0 113.61 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 75.49 -30.9 0.2 Allowed 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 117.527 2.417 . . . . 0.0 117.527 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 66' ' ' THR . 18.3 m-20 -109.11 100.98 10.07 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.415 2.686 . . . . 0.0 108.191 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.42 ' CE1' HG12 ' A' ' 43' ' ' ILE . 25.8 t80 -99.67 102.06 13.43 Favored 'General case' 0 C--N 1.311 -1.109 1 O-C-N 130.353 4.783 . . . . 0.0 115.059 -178.769 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -115.21 67.62 0.7 Allowed 'General case' 0 CA--C 1.493 -1.215 1 O-C-N 129.623 4.327 . . . . 0.0 117.797 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -58.52 125.88 25.22 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 127.694 3.121 . . . . 0.0 105.838 179.247 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -129.56 154.17 47.32 Favored 'General case' 0 CA--C 1.485 -1.535 0 O-C-N 128.503 3.627 . . . . 0.0 112.284 -178.081 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.507 HG23 ' H ' ' A' ' 56' ' ' SER . 0.6 OUTLIER -106.56 167.46 9.84 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 126.039 2.087 . . . . 0.0 109.938 179.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.507 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -137.93 39.56 2.35 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.507 ' H ' HG23 ' A' ' 54' ' ' THR . 14.7 m -75.5 154.32 36.98 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 128.437 3.586 . . . . 0.0 105.245 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.813 ' OG1' HD12 ' A' ' 37' ' ' LEU . 40.6 p -85.65 -1.51 57.23 Favored 'General case' 0 N--CA 1.481 1.091 1 O-C-N 131.285 5.366 . . . . 0.0 109.125 -179.848 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.837 ' HB3' HD11 ' A' ' 37' ' ' LEU . 2.5 p90 -118.21 -40.87 2.91 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.66 128.02 18.86 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 112.695 -2.048 . . . . 0.0 115.052 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -113.09 -161.75 0.77 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 128.677 3.735 . . . . 0.0 107.256 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 60.9 83.62 0.14 Allowed 'General case' 0 CA--C 1.504 -0.808 0 O-C-N 126.408 2.317 . . . . 0.0 110.194 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.19 -65.99 0.93 Allowed 'General case' 0 C--O 1.208 -1.114 0 O-C-N 126.749 2.53 . . . . 0.0 113.894 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 1.126 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 5.2 tp -136.82 41.87 2.49 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 118.455 2.761 . . . . 0.0 118.455 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.56 98.07 0.24 Allowed 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.543 ' CD2' HG21 ' A' ' 87' ' ' VAL . 5.9 m-85 -140.63 -178.36 5.49 Favored 'General case' 0 CA--C 1.488 -1.408 1 CA-C-O 129.427 4.442 . . . . 0.0 110.01 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.59 HG22 HG23 ' A' ' 69' ' ' VAL . 1.6 m -150.61 121.91 7.83 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 109.648 -3.433 . . . . 0.0 104.143 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.795 HG21 ' NE1' ' A' ' 89' ' ' TRP . 5.2 t -61.25 144.1 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 O-C-N 128.134 3.396 . . . . 0.0 116.59 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.95 15.97 61.12 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-N 108.94 -3.754 . . . . 0.0 117.201 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.59 HG23 HG22 ' A' ' 66' ' ' THR 0.269 11.1 t -81.07 -25.43 10.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 C-N-CA 119.044 -1.062 . . . . 0.0 109.344 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 67.86 77.6 0.25 Allowed 'General case' 0 C--N 1.364 1.208 0 O-C-N 129.06 3.975 . . . . 0.0 108.909 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.528 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.3 m-85 -60.51 99.0 0.07 Allowed 'General case' 0 C--N 1.355 0.811 0 O-C-N 127.497 2.998 . . . . 0.0 115.836 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.444 ' C ' ' HG3' ' A' ' 73' ' ' GLU . 74.2 m-20 -68.55 73.11 0.23 Allowed 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 112.358 -2.201 . . . . 0.0 111.352 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.493 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 6.7 mt-10 53.11 -156.51 0.18 Allowed 'General case' 0 CA--C 1.507 -0.683 0 CA-C-O 121.499 0.666 . . . . 0.0 112.339 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.8 m80 71.5 87.97 0.11 Allowed 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 124.763 2.221 . . . . 0.0 112.631 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -125.93 122.56 36.33 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-N 110.214 -3.175 . . . . 0.0 113.04 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.24 168.96 18.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 127.657 3.098 . . . . 0.0 112.254 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.13 34.63 64.52 Favored Glycine 0 C--O 1.207 -1.536 0 CA-C-N 111.782 -2.463 . . . . 0.0 107.845 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.52 ' O ' HD12 ' A' ' 26' ' ' ILE . 4.5 tp -167.45 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.51 -0.57 1 O-C-N 130.417 4.245 . . . . 0.0 116.501 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 1.02 ' HB2' HD12 ' A' ' 24' ' ' LEU . 7.7 t70 -155.17 -57.4 0.1 Allowed 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 116.197 -2.201 . . . . 0.0 113.055 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.63 76.86 1.31 Allowed Glycine 0 C--O 1.213 -1.169 0 O-C-N 126.104 2.127 . . . . 0.0 111.619 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.524 ' HG3' HG23 ' A' ' 83' ' ' VAL . 9.3 ptt180 -137.05 -156.91 0.73 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 111.342 -2.429 . . . . 0.0 111.168 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.493 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.5 OUTLIER -160.14 105.08 1.51 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 128.167 3.417 . . . . 0.0 108.488 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.524 HG23 ' HG3' ' A' ' 81' ' ' ARG . 12.8 t -144.27 135.33 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.2 0 N-CA-C 117.48 2.4 . . . . 0.0 117.48 -178.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.521 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -49.58 145.07 5.26 Favored 'General case' 0 N--CA 1.467 0.39 1 O-C-N 129.708 4.38 . . . . 0.0 106.266 178.183 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.528 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 78.3 m -150.42 66.14 0.95 Allowed 'General case' 0 C--O 1.201 -1.459 0 O-C-N 127.537 3.023 . . . . 0.0 115.251 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 6.0 tt -62.04 140.58 58.36 Favored 'General case' 0 N--CA 1.432 -1.373 1 CA-C-N 108.12 -4.127 . . . . 0.0 110.811 -179.765 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.543 HG21 ' CD2' ' A' ' 65' ' ' PHE . 3.9 t -132.39 135.98 56.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 C-N-CA 126.1 1.76 . . . . 0.0 108.414 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.47 ' HA ' ' CG1' ' A' ' 67' ' ' VAL . 9.7 t -159.81 156.67 27.89 Favored 'General case' 0 CA--C 1.473 -1.982 0 CA-C-O 124.462 2.077 . . . . 0.0 109.28 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.795 ' NE1' HG21 ' A' ' 67' ' ' VAL . 38.5 m95 -90.34 145.31 25.06 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-O 114.602 -2.618 . . . . 0.0 106.761 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.826 ' HB3' HG22 ' A' ' 93' ' ' THR . 7.0 tp10 -97.38 -8.53 29.32 Favored 'General case' 0 CA--C 1.489 -1.367 1 CA-C-O 129.462 4.458 . . . . 0.0 112.055 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.95 -19.17 11.22 Favored Glycine 0 C--O 1.2 -2.023 0 CA-C-N 108.731 -3.85 . . . . 0.0 106.097 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.498 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.8 OUTLIER -158.96 44.88 0.27 Allowed 'General case' 0 N--CA 1.431 -1.391 1 O-C-N 131.826 5.074 . . . . 0.0 111.766 179.978 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.826 HG22 ' HB3' ' A' ' 90' ' ' GLU . 15.1 t 164.1 144.88 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.916 2.561 . . . . 0.0 117.916 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.756 ' CD2' HD21 ' A' ' 63' ' ' LEU . 1.2 tp -87.55 83.17 7.28 Favored 'General case' 0 CA--C 1.504 -0.798 0 O-C-N 127.397 2.936 . . . . 0.0 114.907 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.479 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.355 73.8 t -81.03 127.63 39.38 Favored 'Isoleucine or valine' 0 C--N 1.351 0.672 1 O-C-N 129.285 4.116 . . . . 0.0 111.394 179.663 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -139.23 141.39 37.87 Favored 'General case' 0 C--O 1.196 -1.749 0 N-CA-C 103.953 -2.61 . . . . 0.0 103.953 -179.019 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.2 t -121.87 91.13 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.736 0 N-CA-C 119.719 3.229 . . . . 0.0 119.719 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.441 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 17.4 mm-40 -65.97 97.84 0.39 Allowed 'General case' 0 C--N 1.361 1.072 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.521 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 1.1 tmtm? -39.29 -49.24 1.93 Allowed 'General case' 0 N--CA 1.48 1.075 0 O-C-N 128.507 3.629 . . . . 0.0 112.417 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.467 ' H ' ' CG1' ' A' ' 83' ' ' VAL . . . 87.4 133.97 4.1 Favored Glycine 0 C--O 1.206 -1.652 1 CA-C-O 128.076 4.153 . . . . 0.0 113.879 179.382 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.412 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -100.78 -46.36 5.17 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 108.955 -3.622 . . . . 0.0 107.607 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.412 ' CG ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -146.24 16.44 1.34 Allowed 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 127.798 2.439 . . . . 0.0 115.965 179.773 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.65 -178.73 7.54 Favored 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 125.859 1.664 . . . . 0.0 114.349 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.638 ' O ' HG22 ' A' ' 121' ' ' THR . 7.9 m120 -125.39 88.22 2.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 127.699 3.124 . . . . 0.0 102.827 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.639 HH21 HD13 ' A' ' 24' ' ' LEU . 57.9 mmt-85 -92.92 2.79 56.6 Favored 'General case' 0 C--O 1.212 -0.894 0 O-C-N 126.9 2.625 . . . . 0.0 113.427 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.417 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -37.98 99.44 0.01 OUTLIER Glycine 0 C--O 1.209 -1.41 2 O-C-N 131.974 5.796 . . . . 0.0 113.093 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 1.126 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.299 0.0 OUTLIER -108.63 126.8 53.36 Favored 'General case' 0 C--O 1.209 -1.032 0 O-C-N 128.954 3.385 . . . . 0.0 110.025 179.546 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -153.52 155.08 35.54 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 128.299 3.904 . . . . 0.0 113.809 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.505 HE22 HD23 ' A' ' 94' ' ' LEU . 0.8 OUTLIER -114.93 -179.42 3.62 Favored 'General case' 0 C--N 1.366 1.283 1 CA-C-N 108.006 -4.179 . . . . 0.0 109.562 -179.186 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.455 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.6 OUTLIER 174.55 77.86 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.509 1 O-C-N 132.017 5.823 . . . . 0.0 117.743 179.113 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 63.6 t -27.55 101.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.817 1 CA-C-O 128.61 4.053 . . . . 0.0 117.435 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -111.06 -179.79 3.83 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 112.257 -2.247 . . . . 0.0 111.852 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -25.8 73.94 0.0 OUTLIER Glycine 0 C--O 1.204 -1.742 0 C-N-CA 127.284 2.373 . . . . 0.0 116.633 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 43.25 68.45 0.51 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 127.674 2.39 . . . . 0.0 116.823 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.473 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 9.3 pttt 160.33 164.83 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.161 1 O-C-N 133.128 6.517 . . . . 0.0 108.33 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.679 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -105.14 151.55 23.89 Favored 'General case' 0 CA--C 1.478 -1.789 0 O-C-N 127.088 2.743 . . . . 0.0 113.544 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.586 ' H ' HD23 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -113.14 98.34 7.08 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 113.425 -1.716 . . . . 0.0 115.609 -179.768 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.494 ' CD2' ' HG2' ' A' ' 109' ' ' GLN . 8.3 mt -85.98 77.61 9.63 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 128.178 3.424 . . . . 0.0 107.593 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.455 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.4 mt-10 -88.81 95.24 10.21 Favored 'General case' 0 CA--C 1.494 -1.19 0 O-C-N 126.666 2.479 . . . . 0.0 111.434 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.576 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -110.79 166.11 11.29 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 127.307 2.879 . . . . 0.0 108.466 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.638 HG22 ' O ' ' A' ' 104' ' ' ASN . 20.2 m -122.18 156.35 33.89 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 110.498 -3.046 . . . . 0.0 105.259 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.8 OUTLIER -162.35 59.9 0.23 Allowed 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 125.283 2.468 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.44 32.93 14.82 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 113.426 -1.715 . . . . 0.0 113.478 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 73.11 28.03 1.94 Allowed 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 111.576 -2.312 . . . . 0.0 111.485 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.45 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -87.15 -28.06 22.68 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 110.896 -2.866 . . . . 0.0 108.165 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.431 ' O ' HG22 ' A' ' 126' ' ' VAL . 0.3 OUTLIER 45.81 119.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 1 O-C-N 131.38 5.425 . . . . 0.0 113.477 -179.766 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.1 t -112.19 120.51 42.04 Favored 'General case' 0 CA--C 1.5 -0.954 0 O-C-N 117.991 -2.943 . . . . 0.0 111.452 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 99.0 8.09 Favored 'General case' 0 CA--C 1.51 -0.578 0 O-C-N 127.105 2.753 . . . . 0.0 112.038 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -79.68 172.2 14.1 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 12.2 t -140.42 148.66 22.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 103.788 -2.671 . . . . 0.0 103.788 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.473 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 18.8 m-85 -138.24 -177.18 4.72 Favored 'General case' 0 CA--C 1.485 -1.534 0 CA-C-O 127.454 3.502 . . . . 0.0 116.797 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.277 9.2 tppt? -162.7 105.18 1.07 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 110.975 -2.83 . . . . 0.0 103.418 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 6.2 ttpt -68.59 78.39 0.28 Allowed 'General case' 0 C--O 1.201 -1.455 0 CA-C-N 111.969 -2.378 . . . . 0.0 113.496 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt . . . . . 0 CA--C 1.481 -1.677 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -179.939 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.517 ' HG2' ' CZ2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.583 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -71.2 -169.74 0.41 Allowed 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.399 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -164.95 148.54 8.65 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 104.451 -2.425 . . . . 0.0 104.451 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -46.16 158.3 0.1 Allowed 'General case' 0 C--N 1.313 -0.982 1 O-C-N 132.83 6.331 . . . . 0.0 116.566 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.77 -167.53 33.68 Favored Glycine 0 C--O 1.203 -1.828 0 O-C-N 127.332 2.895 . . . . 0.0 112.314 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.01 147.01 33.29 Favored 'General case' 0 C--N 1.316 -0.852 1 O-C-N 132.64 5.553 . . . . 0.0 107.801 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.84 ' CE3' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -140.56 130.1 24.08 Favored 'General case' 0 C--N 1.323 -0.548 1 O-C-N 133.282 6.614 . . . . 0.0 111.137 -179.644 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -86.47 -6.25 58.96 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 126.753 2.533 . . . . 0.0 115.332 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.476 ' HG3' ' CE1' ' A' ' 131' ' ' PHE . 19.8 ttm 54.88 85.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.678 0 O-C-N 125.073 1.483 . . . . 0.0 107.257 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -25.43 -38.01 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 131.034 3.734 . . . . 0.0 110.741 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 173.47 169.17 0.17 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 126.753 3.168 . . . . 0.0 111.513 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -104.88 160.86 14.67 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 108.653 -3.885 . . . . 0.0 114.757 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -122.97 -64.41 1.18 Allowed 'General case' 0 CA--C 1.494 -1.183 1 O-C-N 130.275 4.734 . . . . 0.0 113.978 179.79 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -127.22 85.9 2.43 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.681 -1.145 . . . . 0.0 113.872 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -43.44 7.62 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.687 3.117 . . . . 0.0 112.378 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.262 32.9 tt0 -79.6 -35.34 39.73 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 111.096 -2.775 . . . . 0.0 114.282 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -76.91 -22.73 71.05 Favored Glycine 0 N--CA 1.478 1.481 0 C-N-CA 115.301 -3.333 . . . . 0.0 110.917 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.527 ' CE1' HD11 ' A' ' 120' ' ' LEU . 8.9 t80 -62.4 -33.38 74.65 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 124.608 2.147 . . . . 0.0 108.522 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.478 ' HB3' ' CG2' ' A' ' 26' ' ' ILE 0.282 51.4 mtp -75.64 -26.05 57.4 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-N 112.876 -1.965 . . . . 0.0 108.63 -179.752 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -80.02 -29.05 39.31 Favored 'General case' 0 C--N 1.312 -1.057 0 O-C-N 125.511 1.757 . . . . 0.0 112.841 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.61 -46.23 84.35 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 111.061 -2.79 . . . . 0.0 113.925 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.827 HD11 ' HB ' ' A' ' 26' ' ' ILE . 4.0 pp -83.82 -27.12 28.99 Favored 'General case' 0 N--CA 1.48 1.043 1 O-C-N 130.029 4.581 . . . . 0.0 103.005 179.11 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 80.99 93.4 0.05 OUTLIER 'General case' 0 CA--C 1.483 -1.633 1 CA-C-O 129.486 4.469 . . . . 0.0 114.312 179.252 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.827 ' HB ' HD11 ' A' ' 24' ' ' LEU . 1.0 OUTLIER -134.23 20.78 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-O 127.415 3.483 . . . . 0.0 107.669 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.54 99.45 0.03 OUTLIER 'General case' 0 C--N 1.366 1.309 0 CA-C-N 112.27 -2.241 . . . . 0.0 113.516 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -132.98 16.01 4.22 Favored 'General case' 0 CA--C 1.488 -1.423 0 O-C-N 128.81 3.819 . . . . 0.0 112.144 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 48.6 38.65 11.69 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-O 126.321 2.962 . . . . 0.0 109.987 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.19 -11.17 33.38 Favored 'General case' 0 C--N 1.349 0.556 1 CA-C-N 108.326 -4.034 . . . . 0.0 112.092 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -102.31 -172.37 2.12 Favored 'General case' 0 C--O 1.222 -0.373 1 O-C-N 130.791 5.057 . . . . 0.0 110.872 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 91.6 -9.27 0.24 Allowed 'General case' 0 C--O 1.202 -1.428 1 O-C-N 131.312 5.383 . . . . 0.0 112.99 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.655 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.6 OUTLIER -125.79 4.16 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 O-C-N 128.238 3.461 . . . . 0.0 111.682 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -120.8 31.75 6.28 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 123.182 1.468 . . . . 0.0 108.488 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -41.19 -42.24 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.303 0 CA-C-N 110.739 -2.937 . . . . 0.0 111.242 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.734 ' C ' HD23 ' A' ' 37' ' ' LEU . 7.0 tmm_? 150.26 125.02 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.149 2 CA-C-N 107.472 -4.422 . . . . 0.0 113.07 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.914 HD11 ' CZ ' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -145.14 110.69 5.34 Favored 'General case' 0 N--CA 1.435 -1.178 1 O-C-N 129.428 4.205 . . . . 0.0 107.343 -179.961 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.7 m 75.94 25.43 1.11 Allowed 'General case' 0 CA--C 1.502 -0.9 1 O-C-N 132.991 6.432 . . . . 0.0 112.653 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.494 ' CB ' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -70.12 110.67 5.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.026 2.704 . . . . 0.0 116.23 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.4 m -137.58 101.67 4.55 Favored 'General case' 0 C--O 1.206 -1.189 1 O-C-N 129.178 4.049 . . . . 0.0 113.203 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.589 ' HZ1' HD11 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -77.72 139.75 39.44 Favored 'General case' 0 C--O 1.222 -0.372 0 O-C-N 126.671 2.482 . . . . 0.0 108.795 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.443 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.3 mp -125.15 161.45 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 126.509 2.38 . . . . 0.0 109.698 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.742 HD11 ' HE2' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -137.12 126.14 35.76 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.528 0 O-C-N 127.504 3.003 . . . . 0.0 110.439 -179.813 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.655 ' N ' HD13 ' A' ' 43' ' ' ILE . 93.8 t -129.48 86.67 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 112.443 -2.162 . . . . 0.0 111.128 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.61 140.41 32.07 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 127.107 2.754 . . . . 0.0 112.199 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -151.7 31.95 0.57 Allowed 'General case' 0 CA--C 1.488 -1.408 1 CA-C-N 107.435 -4.438 . . . . 0.0 117.41 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.92 -70.07 1.35 Allowed Glycine 0 C--O 1.205 -1.682 0 O-C-N 119.941 -1.724 . . . . 0.0 111.29 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.61 98.28 3.65 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 129.159 3.505 . . . . 0.0 110.695 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.451 ' ND2' ' HE2' ' A' ' 51' ' ' LYS . 42.1 t30 116.66 79.68 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.604 1 O-C-N 129.577 4.298 . . . . 0.0 108.463 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.742 ' HE2' HD11 ' A' ' 43' ' ' ILE . 7.6 t80 -90.5 125.96 35.76 Favored 'General case' 0 C--N 1.313 -1.004 1 O-C-N 131.974 5.797 . . . . 0.0 110.08 179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.451 ' HE2' ' ND2' ' A' ' 49' ' ' ASN . 2.8 mttt -137.05 80.08 1.79 Allowed 'General case' 0 CA--C 1.492 -1.259 0 O-C-N 128.267 3.479 . . . . 0.0 119.027 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.517 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -60.3 157.64 13.23 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 128.397 3.561 . . . . 0.0 107.053 179.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 62' ' ' ASP . 0.3 OUTLIER -167.64 141.56 3.54 Favored 'General case' 0 CA--C 1.487 -1.454 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.571 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.53 161.32 14.41 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.617 1.198 . . . . 0.0 111.258 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -128.59 28.72 5.38 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 116.219 1.933 . . . . 0.0 116.219 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 91.0 p -64.3 145.83 55.39 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 128.65 3.719 . . . . 0.0 105.102 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.8 m -64.82 -27.35 68.82 Favored 'General case' 0 N--CA 1.469 0.496 1 O-C-N 132.101 5.876 . . . . 0.0 107.46 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.914 ' CZ ' HD11 ' A' ' 37' ' ' LEU . 4.3 m-30 -82.21 -79.02 0.19 Allowed 'General case' 0 C--O 1.239 0.543 0 O-C-N 128.799 3.812 . . . . 0.0 117.615 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -115.8 88.58 2.91 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 127.603 3.064 . . . . 0.0 115.269 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -92.47 63.3 4.1 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.221 4.076 . . . . 0.0 110.636 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -88.57 111.79 22.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 111.772 -2.467 . . . . 0.0 109.394 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 17.5 p30 -77.64 161.87 27.47 Favored 'General case' 0 C--O 1.204 -1.294 0 O-C-N 127.437 2.961 . . . . 0.0 115.717 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.517 ' HB2' HG22 ' A' ' 52' ' ' THR . 12.4 tp -106.8 45.41 0.98 Allowed 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 112.697 -2.047 . . . . 0.0 111.554 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -71.59 95.0 1.37 Allowed 'General case' 0 C--O 1.203 -1.382 1 O-C-N 129.285 4.116 . . . . 0.0 110.704 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.681 ' CE2' HG22 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -159.57 132.29 6.74 Favored 'General case' 0 CA--C 1.483 -1.606 1 CA-C-O 131.111 5.243 . . . . 0.0 112.912 179.93 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.481 HG23 ' N ' ' A' ' 67' ' ' VAL . 0.4 OUTLIER -85.83 172.04 11.07 Favored 'General case' 0 C--O 1.21 -1.012 0 O-C-N 116.835 -3.666 . . . . 0.0 110.32 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.935 HG21 ' CD1' ' A' ' 89' ' ' TRP . 10.3 t -82.12 136.02 23.8 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.909 0 O-C-N 127.86 3.225 . . . . 0.0 112.916 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.56 5.85 19.48 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.687 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.427 HG11 ' HD1' ' A' ' 71' ' ' PHE . 8.2 p -60.87 -20.93 22.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.192 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 58.14 72.58 0.51 Allowed 'General case' 0 C--N 1.353 0.718 1 O-C-N 130.344 4.777 . . . . 0.0 109.047 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.58 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.4 OUTLIER -66.88 141.42 57.66 Favored 'General case' 0 CA--C 1.493 -1.24 2 CA-C-N 106.648 -4.796 . . . . 0.0 118.254 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -120.91 63.47 0.87 Allowed 'General case' 0 CA--C 1.485 -1.533 0 CA-C-O 124.21 1.957 . . . . 0.0 113.541 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -55.18 143.13 28.57 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-O 125.081 2.372 . . . . 0.0 108.514 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -111.32 18.69 19.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 112.972 -1.922 . . . . 0.0 115.789 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 16.73 98.77 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.06 0 O-C-N 127.095 2.747 . . . . 0.0 115.956 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.84 146.07 27.79 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 128.116 3.385 . . . . 0.0 115.479 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.16 -32.1 7.98 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-N 110.04 -3.255 . . . . 0.0 110.666 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.565 ' O ' HD12 ' A' ' 26' ' ' ILE . 7.2 tp -117.86 -4.23 11.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 129.617 3.775 . . . . 0.0 116.655 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.433 ' HB3' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -159.75 -72.43 0.08 Allowed 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 118.296 -1.361 . . . . 0.0 114.361 -179.879 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.21 84.88 1.79 Allowed Glycine 0 N--CA 1.466 0.688 0 CA-C-O 122.188 0.882 . . . . 0.0 111.273 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.446 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.0 OUTLIER -148.87 -127.32 0.05 Allowed 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.861 -2.17 . . . . 0.0 114.716 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.446 ' ND2' ' O ' ' A' ' 81' ' ' ARG . 3.3 p30 164.43 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 124.533 1.145 . . . . 0.0 110.069 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.439 HG13 ' HA2' ' A' ' 100' ' ' GLY . 0.8 OUTLIER -146.59 165.92 7.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.798 0 N-CA-C 117.443 2.386 . . . . 0.0 117.443 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.482 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -74.82 167.7 21.33 Favored 'General case' 0 C--O 1.241 0.628 2 O-C-N 132.58 6.175 . . . . 0.0 107.715 179.458 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.58 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.2 m -173.4 86.69 0.06 Allowed 'General case' 0 C--O 1.194 -1.828 1 O-C-N 130.197 4.685 . . . . 0.0 111.1 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 110.18 21.56 Favored 'General case' 0 N--CA 1.43 -1.444 1 CA-C-N 106.862 -4.699 . . . . 0.0 116.874 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.681 HG22 ' CE2' ' A' ' 65' ' ' PHE . 17.6 t -80.77 150.59 4.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 CA-C-N 111.859 -2.428 . . . . 0.0 108.667 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.287 22.3 m -160.14 145.77 15.28 Favored 'General case' 0 CA--C 1.474 -1.962 0 CA-C-N 112.608 -2.087 . . . . 0.0 109.964 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.935 ' CD1' HG21 ' A' ' 67' ' ' VAL . 8.9 m95 -85.69 129.09 34.91 Favored 'General case' 0 C--N 1.357 0.899 0 CA-C-O 113.696 -3.05 . . . . 0.0 105.461 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.544 ' HB3' HG21 ' A' ' 93' ' ' THR . 0.5 OUTLIER -99.33 -9.53 23.43 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 127.224 3.392 . . . . 0.0 116.243 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 147.34 -78.2 0.24 Allowed Glycine 0 C--O 1.194 -2.363 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.486 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -134.75 100.5 4.63 Favored 'General case' 0 C--O 1.195 -1.788 1 O-C-N 131.502 4.884 . . . . 0.0 103.265 179.591 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.544 HG21 ' HB3' ' A' ' 90' ' ' GLU . 4.5 t 166.42 -131.87 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 127.478 2.986 . . . . 0.0 113.132 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.587 HD22 ' CE1' ' A' ' 50' ' ' PHE 0.292 1.2 tp 166.19 70.03 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 129.697 3.199 . . . . 0.0 113.925 179.465 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.36 45.5 t -74.66 132.72 32.9 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 N-CA-C 118.586 2.81 . . . . 0.0 118.586 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -137.72 129.67 28.78 Favored 'General case' 0 C--O 1.199 -1.56 0 N-CA-C 103.05 -2.944 . . . . 0.0 103.05 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.2 t -104.37 99.62 8.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 C-N-CA 127.254 2.222 . . . . 0.0 116.527 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.84 93.14 5.58 Favored 'General case' 0 C--N 1.36 1.022 0 CA-C-O 125.398 2.523 . . . . 0.0 110.682 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.482 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -75.55 87.35 2.66 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 111.89 -2.413 . . . . 0.0 111.089 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.439 ' HA2' HG13 ' A' ' 83' ' ' VAL . . . -118.66 165.65 12.94 Favored Glycine 0 C--O 1.209 -1.432 1 CA-C-O 128.566 4.425 . . . . 0.0 113.823 -179.671 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -129.89 109.48 10.94 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 109.98 -3.11 . . . . 0.0 110.798 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? 125.89 -36.25 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.291 0 O-C-N 127.708 3.13 . . . . 0.0 110.881 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.18 156.24 43.28 Favored 'General case' 0 C--O 1.199 -1.587 1 CA-C-N 107.83 -4.259 . . . . 0.0 113.393 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -115.29 118.53 33.53 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 109.868 -3.333 . . . . 0.0 103.537 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 122' ' ' CYS . 6.5 mmt85 -110.91 11.84 22.27 Favored 'General case' 0 C--O 1.213 -0.835 1 O-C-N 129.746 4.404 . . . . 0.0 109.523 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -51.81 92.85 0.01 OUTLIER Glycine 0 N--CA 1.429 -1.789 2 CA-C-N 106.814 -4.721 . . . . 0.0 111.929 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.44 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.262 0.0 OUTLIER -107.43 143.14 36.19 Favored 'General case' 0 C--O 1.206 -1.214 1 O-C-N 130.786 4.463 . . . . 0.0 109.904 179.662 . . . . . . . . 5 4 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.524 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 2.3 ptpt -158.14 172.22 18.8 Favored 'General case' 0 CA--C 1.507 -0.705 1 O-C-N 132.095 5.872 . . . . 0.0 114.43 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.519 ' OE1' HD22 ' A' ' 118' ' ' LEU . 0.3 OUTLIER -122.44 176.69 5.75 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 113.86 -2.971 . . . . 0.0 105.0 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.524 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 20.0 m95 -133.28 -55.64 0.91 Allowed 'General case' 0 C--N 1.311 -1.075 0 O-C-N 125.988 2.055 . . . . 0.0 112.001 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.535 HG23 ' HA ' ' A' ' 93' ' ' THR . 10.8 t 87.37 57.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.777 1 CA-C-O 130.222 4.82 . . . . 0.0 110.134 -176.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.95 67.55 1.27 Allowed 'General case' 0 CA--C 1.478 -1.812 1 CA-C-N 107.006 -4.634 . . . . 0.0 117.757 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 87.83 -88.39 1.56 Allowed Glycine 0 C--O 1.202 -1.887 0 N-CA-C 117.527 1.771 . . . . 0.0 117.527 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.474 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 74.5 m-20 -100.94 -23.9 14.45 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 118.962 2.949 . . . . 0.0 118.962 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.474 ' HE2' ' HB2' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -130.72 -168.45 1.99 Allowed 'General case' 0 CA--C 1.499 -0.981 1 O-C-N 130.205 4.691 . . . . 0.0 110.199 179.987 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.84 HD22 ' CE3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -146.31 94.66 2.49 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 128.123 3.821 . . . . 0.0 111.156 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.14 124.47 20.07 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 109.145 -3.662 . . . . 0.0 110.47 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.519 HD22 ' OE1' ' A' ' 109' ' ' GLN . 2.6 mt -95.2 72.2 3.32 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 127.539 3.024 . . . . 0.0 108.882 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -71.39 91.89 1.04 Allowed 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 128.964 3.915 . . . . 0.0 110.909 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.658 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -102.87 160.4 14.64 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 114.26 -1.336 . . . . 0.0 107.55 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.658 ' O ' HD12 ' A' ' 120' ' ' LEU . 4.7 m -124.17 168.73 12.53 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.365 1.666 . . . . 0.0 110.799 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.475 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 10.3 t -167.8 50.8 0.06 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 126.347 2.975 . . . . 0.0 110.38 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 103.29 6.91 44.22 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 112.244 -2.253 . . . . 0.0 112.284 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.9 t0 100.57 28.45 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.058 0 O-C-N 128.523 3.131 . . . . 0.0 112.299 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -85.36 -17.27 37.23 Favored 'General case' 0 C--O 1.206 -1.188 0 C-N-CA 114.207 -2.997 . . . . 0.0 105.468 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 33.3 85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 O-C-N 129.051 3.969 . . . . 0.0 113.284 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 77.0 m -59.44 152.48 21.46 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.18 70.95 1.46 Allowed 'General case' 0 CA--C 1.486 -1.501 0 CA-C-O 124.374 2.035 . . . . 0.0 112.604 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -57.49 170.51 0.53 Allowed 'General case' 0 C--N 1.358 0.936 0 C-N-CA 116.611 -2.035 . . . . 0.0 111.695 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 11.5 t -141.62 105.03 1.4 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.295 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.476 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 12.0 m-85 -99.28 162.37 13.09 Favored 'General case' 0 CA--C 1.494 -1.204 1 CA-C-N 108.111 -4.131 . . . . 0.0 117.628 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.452 ' HD2' ' C ' ' A' ' 132' ' ' LYS 0.384 0.0 OUTLIER -147.82 129.44 15.04 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 110.579 -3.01 . . . . 0.0 104.471 179.989 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.516 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 17.0 tttm -68.53 122.62 18.85 Favored 'General case' 0 C--O 1.198 -1.606 0 O-C-N 127.406 2.941 . . . . 0.0 110.997 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.245 0.861 0 CA-C-O 115.932 -1.985 . . . . 0.0 115.028 -179.906 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.491 -1.3 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.48 136.63 53.51 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.5 -2.778 . . . . 0.0 103.5 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.622 HE21 ' N ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -178.83 154.14 0.7 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 114.875 -2.488 . . . . 0.0 105.262 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 24.29 108.67 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.712 1 O-C-N 133.398 6.686 . . . . 0.0 116.934 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.511 ' N ' HG22 ' A' ' 43' ' ' ILE . . . -177.22 147.86 8.52 Favored Glycine 0 C--O 1.211 -1.296 0 CA-C-N 113.411 -1.722 . . . . 0.0 113.333 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.676 HG22 HG23 ' A' ' 42' ' ' ILE . 62.7 p -124.7 63.39 1.12 Allowed 'General case' 0 C--O 1.201 -1.451 0 O-C-N 127.228 2.369 . . . . 0.0 105.813 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.625 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -62.77 128.1 34.34 Favored 'General case' 0 N--CA 1.451 -0.421 1 O-C-N 130.838 5.086 . . . . 0.0 111.282 -179.672 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -77.41 -12.06 59.91 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.483 ' HB2' ' HE3' ' A' ' 11' ' ' MET . 37.6 ttm 54.53 74.97 0.32 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 105.439 -2.059 . . . . 0.0 105.439 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.538 ' HG3' ' HG2' ' A' ' 132' ' ' LYS . 91.3 mt-10 -47.77 -51.9 20.67 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 127.01 2.694 . . . . 0.0 109.883 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.96 154.54 42.03 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 111.511 -2.586 . . . . 0.0 111.356 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.428 ' ND2' ' O ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -134.58 141.12 46.55 Favored 'General case' 0 CA--C 1.483 -1.63 0 O-C-N 128.49 3.619 . . . . 0.0 111.403 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.428 ' O ' ' ND2' ' A' ' 14' ' ' ASN . 3.0 mt-10 -77.21 -169.81 1.5 Allowed 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 112.661 -2.063 . . . . 0.0 114.085 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -30.1 100.42 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.386 0 C-N-CA 127.108 2.163 . . . . 0.0 114.326 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -96.91 -24.8 15.68 Favored 'General case' 0 C--O 1.204 -1.299 0 O-C-N 125.791 1.932 . . . . 0.0 109.547 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -76.67 -37.6 55.93 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 113.45 -1.704 . . . . 0.0 112.762 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.7 -24.62 60.03 Favored Glycine 0 N--CA 1.487 2.048 0 C-N-CA 115.951 -3.023 . . . . 0.0 106.547 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.529 ' O ' HD23 ' A' ' 24' ' ' LEU . 1.1 t80 -68.58 -27.77 66.35 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-O 127.236 3.398 . . . . 0.0 108.488 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.569 ' HG2' HG22 ' A' ' 26' ' ' ILE . 3.5 ttt -70.22 -33.57 71.83 Favored 'General case' 0 CA--C 1.488 -1.442 0 CA-C-N 112.704 -2.044 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.9 mtmt -77.0 -21.76 54.16 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 109.177 -3.647 . . . . 0.0 115.987 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.01 -46.49 74.34 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 127.637 3.085 . . . . 0.0 113.456 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.609 HD11 ' HB ' ' A' ' 26' ' ' ILE . 0.5 OUTLIER -96.77 -9.91 27.86 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 128.593 3.683 . . . . 0.0 108.176 -179.71 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t0 38.75 93.78 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.436 1 CA-C-O 129.296 4.379 . . . . 0.0 112.078 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.609 ' HB ' HD11 ' A' ' 24' ' ' LEU . 14.0 tt -105.3 39.38 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 108.684 -3.871 . . . . 0.0 108.525 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.4 t70 81.83 144.77 0.08 Allowed 'General case' 0 C--N 1.352 0.676 0 CA-C-O 116.485 -1.722 . . . . 0.0 108.658 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -96.71 155.57 16.72 Favored 'General case' 0 C--O 1.204 -1.301 1 O-C-N 129.389 4.181 . . . . 0.0 115.746 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.3 77.84 0.29 Allowed 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 111.951 -2.386 . . . . 0.0 105.268 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.6 m -137.62 -61.07 0.64 Allowed 'General case' 0 C--N 1.354 0.791 2 CA-C-N 105.502 -5.317 . . . . 0.0 116.135 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -69.98 -155.05 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.986 0 O-C-N 128.419 3.574 . . . . 0.0 114.423 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.424 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.1 OUTLIER 89.33 -2.77 0.38 Allowed 'General case' 0 C--O 1.204 -1.34 1 O-C-N 130.502 4.876 . . . . 0.0 111.293 -179.722 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.409 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.8 OUTLIER -149.92 35.92 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.671 0 CA-C-N 110.436 -3.075 . . . . 0.0 109.033 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -141.6 35.32 1.63 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 126.025 2.822 . . . . 0.0 108.573 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -53.71 -34.27 24.31 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.457 0 CA-C-N 110.564 -3.017 . . . . 0.0 110.327 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.706 ' C ' HD23 ' A' ' 37' ' ' LEU . 16.1 ttp85 158.0 131.52 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.35 1 CA-C-N 107.488 -4.414 . . . . 0.0 111.584 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.06 HD21 ' CE2' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -130.44 83.9 2.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.543 -3.026 . . . . 0.0 105.65 -179.253 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 m 70.14 -21.07 0.18 Allowed 'General case' 0 C--N 1.317 -0.814 1 O-C-N 134.123 7.139 . . . . 0.0 117.436 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -13.74 92.18 0.01 OUTLIER 'General case' 0 CA--C 1.492 -1.251 0 O-C-N 127.773 3.171 . . . . 0.0 118.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -99.58 101.81 13.13 Favored 'General case' 0 C--O 1.203 -1.375 1 O-C-N 133.443 6.714 . . . . 0.0 109.182 179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.535 ' HE3' HD22 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -81.57 131.64 35.28 Favored 'General case' 0 N--CA 1.485 1.291 1 O-C-N 129.152 4.033 . . . . 0.0 109.6 -179.353 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.676 HG23 HG22 ' A' ' 8' ' ' THR . 8.1 mt -117.82 158.67 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 127.19 2.806 . . . . 0.0 109.814 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.511 HG22 ' N ' ' A' ' 7' ' ' GLY 0.28 0.0 OUTLIER -140.17 146.95 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.444 1 O-C-N 129.123 4.014 . . . . 0.0 109.117 -179.752 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.454 ' N ' ' O ' ' A' ' 51' ' ' LYS . 79.6 t -153.14 85.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.1 0 CA-C-N 113.204 -1.816 . . . . 0.0 108.299 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.502 ' HB3' ' HA ' ' A' ' 5' ' ' GLN . 0.3 OUTLIER -103.18 117.37 34.38 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 126.605 2.441 . . . . 0.0 113.367 -179.282 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -151.48 106.69 3.31 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 111.249 -2.705 . . . . 0.0 116.848 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 33.97 100.79 0.01 OUTLIER Glycine 0 C--O 1.22 -0.768 0 O-C-N 126.951 2.657 . . . . 0.0 117.913 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.7 t0 78.94 -59.04 0.41 Allowed 'General case' 0 N--CA 1.441 -0.888 0 O-C-N 125.951 1.618 . . . . 0.0 115.087 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.08 116.83 29.27 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 125.067 1.347 . . . . 0.0 112.818 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.602 ' CE2' HD22 ' A' ' 94' ' ' LEU . 8.4 t80 -121.16 119.9 33.69 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 127.271 2.857 . . . . 0.0 117.096 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.472 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -134.32 152.61 51.91 Favored 'General case' 0 C--O 1.193 -1.914 0 O-C-N 128.412 3.57 . . . . 0.0 112.169 179.561 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.622 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -133.33 174.09 10.77 Favored 'General case' 0 CA--C 1.508 -0.635 2 O-C-N 129.914 4.509 . . . . 0.0 106.816 179.645 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.518 ' N ' HG23 ' A' ' 52' ' ' THR . 0.1 OUTLIER -177.22 142.61 0.36 Allowed 'General case' 0 CA--C 1.482 -1.636 0 O-C-N 128.442 3.589 . . . . 0.0 109.893 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.427 HG23 ' HA ' ' A' ' 60' ' ' ASN . 6.5 t -92.03 158.97 15.94 Favored 'General case' 0 CA--C 1.51 -0.565 0 O-C-N 127.917 3.26 . . . . 0.0 111.738 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -131.18 33.53 4.12 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 113.834 -1.53 . . . . 0.0 114.521 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.4 t -72.97 159.41 33.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 126.476 2.36 . . . . 0.0 108.2 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.5 m -70.8 -36.09 72.82 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 110.617 -2.992 . . . . 0.0 105.409 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 1.06 ' CE2' HD21 ' A' ' 37' ' ' LEU . 5.4 m-85 -66.8 -62.42 1.45 Allowed 'General case' 0 C--N 1.361 1.082 0 CA-C-N 112.698 -2.046 . . . . 0.0 111.321 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -139.37 174.99 9.95 Favored 'General case' 0 C--N 1.361 1.099 2 CA-C-N 107.049 -4.614 . . . . 0.0 114.625 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.427 ' HA ' HG23 ' A' ' 54' ' ' THR . 1.5 m120 -146.11 39.88 1.12 Allowed 'General case' 0 C--O 1.203 -1.381 2 O-C-N 130.596 4.935 . . . . 0.0 111.03 -179.573 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -64.02 176.95 0.86 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 126.664 2.477 . . . . 0.0 109.089 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -146.19 146.22 30.73 Favored 'General case' 0 C--O 1.199 -1.597 0 O-C-N 128.207 3.442 . . . . 0.0 116.769 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.622 ' HB2' HG22 ' A' ' 52' ' ' THR . 14.0 tp -92.24 47.44 1.33 Allowed 'General case' 0 C--N 1.361 1.073 0 CA-C-N 111.644 -2.526 . . . . 0.0 111.283 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 -60.92 93.37 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.478 ' CD2' HG21 ' A' ' 87' ' ' VAL . 1.6 m-30 -121.12 -178.09 3.67 Favored 'General case' 0 CA--C 1.491 -1.291 0 CA-C-O 126.962 3.268 . . . . 0.0 110.647 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -164.32 148.83 9.8 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 109.995 -3.275 . . . . 0.0 104.446 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.547 HG23 ' HA ' ' A' ' 88' ' ' THR . 12.0 p -68.81 133.16 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.202 0 O-C-N 127.276 2.86 . . . . 0.0 113.698 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.32 40.13 84.29 Favored Glycine 0 N--CA 1.483 1.8 0 CA-C-N 109.984 -3.28 . . . . 0.0 115.789 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -85.71 -14.97 10.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 C-N-CA 117.761 -1.575 . . . . 0.0 108.873 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 53.66 64.96 1.65 Allowed 'General case' 0 C--O 1.217 -0.612 1 O-C-N 131.981 5.8 . . . . 0.0 108.463 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.436 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 5.5 t80 -54.81 137.86 43.89 Favored 'General case' 0 CA--C 1.499 -1.018 1 O-C-N 129.879 4.487 . . . . 0.0 114.779 -178.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -102.4 71.0 1.19 Allowed 'General case' 0 C--O 1.202 -1.439 0 O-C-N 125.547 1.78 . . . . 0.0 108.032 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -53.64 130.59 36.83 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 125.161 2.41 . . . . 0.0 111.351 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -142.83 38.19 1.46 Allowed 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 110.675 -2.966 . . . . 0.0 112.028 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.442 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -38.61 160.68 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.733 0 CA-C-N 111.232 -2.713 . . . . 0.0 116.315 -179.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.442 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.6 135.83 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 126.796 3.189 . . . . 0.0 112.447 179.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.85 -12.61 14.92 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 111.252 -2.704 . . . . 0.0 106.84 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 tp -117.31 -61.36 1.72 Allowed 'General case' 0 C--N 1.352 0.677 0 CA-C-N 108.993 -3.603 . . . . 0.0 116.583 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -123.19 -53.89 1.81 Allowed 'General case' 0 C--O 1.214 -0.801 0 CA-C-O 123.226 1.489 . . . . 0.0 112.793 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.48 79.08 0.79 Allowed Glycine 0 C--O 1.207 -1.591 0 CA-C-O 125.191 2.551 . . . . 0.0 111.425 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.464 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 2.6 tpt180 -144.36 -101.34 0.11 Allowed 'General case' 0 N--CA 1.486 1.372 1 CA-C-N 107.513 -4.344 . . . . 0.0 113.875 -179.877 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.464 ' N ' ' HG3' ' A' ' 81' ' ' ARG . 0.5 OUTLIER 153.76 120.7 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 O-C-N 127.147 2.78 . . . . 0.0 108.368 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.556 HG12 ' H ' ' A' ' 84' ' ' LYS . 2.1 t -141.97 178.22 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 0 O-C-N 127.717 3.136 . . . . 0.0 113.266 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.556 ' H ' HG12 ' A' ' 83' ' ' VAL . 1.7 mtmt -119.87 95.6 4.83 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 127.038 2.711 . . . . 0.0 110.701 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 91.1 m -91.54 81.06 5.37 Favored 'General case' 0 C--O 1.195 -1.785 0 O-C-N 126.34 2.275 . . . . 0.0 115.244 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 0.6 OUTLIER -69.84 148.36 49.17 Favored 'General case' 0 N--CA 1.433 -1.319 2 CA-C-N 106.525 -4.852 . . . . 0.0 110.849 179.882 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.605 HG13 ' SG ' ' A' ' 96' ' ' CYS . 38.7 t -131.48 143.95 38.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 124.766 1.226 . . . . 0.0 110.731 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.547 ' HA ' HG23 ' A' ' 67' ' ' VAL . 0.7 OUTLIER -164.93 174.06 10.95 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.085 -1.871 . . . . 0.0 111.853 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.697 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 68.9 m95 -98.35 150.0 22.05 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 114.625 -2.607 . . . . 0.0 110.317 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.63 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.6 OUTLIER -96.43 -8.28 32.73 Favored 'General case' 0 C--O 1.206 -1.231 1 CA-C-O 131.808 5.575 . . . . 0.0 112.911 179.665 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.32 -18.15 8.89 Favored Glycine 0 C--O 1.211 -1.283 2 CA-C-N 107.7 -4.318 . . . . 0.0 102.846 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.426 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.3 OUTLIER -171.27 75.39 0.06 Allowed 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 128.919 2.888 . . . . 0.0 110.731 -179.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 90' ' ' GLU . 6.4 t 132.92 154.88 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.716 3.206 . . . . 0.0 118.365 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.602 HD22 ' CE2' ' A' ' 50' ' ' PHE . 1.1 tp -81.65 105.6 12.92 Favored 'General case' 0 CA--C 1.493 -1.23 0 O-C-N 127.315 2.885 . . . . 0.0 114.868 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.63 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.296 88.8 t -107.43 110.62 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 111.589 -2.55 . . . . 0.0 111.771 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.605 ' SG ' HG13 ' A' ' 87' ' ' VAL . 33.0 m -130.41 144.34 51.33 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.74 118.18 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.069 0 CA-C-N 112.333 -2.212 . . . . 0.0 116.765 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.464 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 1.4 mt-30 -84.78 93.1 8.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 125.651 2.643 . . . . 0.0 109.009 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -86.33 123.11 31.21 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-N 107.485 -4.416 . . . . 0.0 109.016 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -131.83 -85.6 0.32 Allowed Glycine 0 C--O 1.202 -1.885 0 CA-C-O 126.415 3.23 . . . . 0.0 108.271 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.438 ' HG2' ' N ' ' A' ' 102' ' ' LYS . 43.7 tt0 -149.97 -78.42 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 1 CA-C-N 107.752 -4.224 . . . . 0.0 112.951 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.5 ' HD2' ' HG3' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -94.71 -9.22 35.44 Favored 'General case' 0 C--O 1.206 -1.224 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.5 ' HG3' ' HD2' ' A' ' 102' ' ' LYS . 4.5 mt-10 -97.51 152.99 18.44 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -140.64 83.35 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 2 O-C-N 132.437 6.085 . . . . 0.0 101.906 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.464 ' HB2' ' CG ' ' A' ' 98' ' ' GLN . 16.7 mmm-85 -88.69 12.33 15.13 Favored 'General case' 0 C--O 1.22 -0.492 0 O-C-N 126.947 2.655 . . . . 0.0 115.284 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.53 109.37 1.74 Allowed Glycine 0 CA--C 1.541 1.702 1 O-C-N 130.533 4.895 . . . . 0.0 116.38 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.54 ' CH2' ' HB2' ' A' ' 96' ' ' CYS . 6.9 p90 -95.65 3.44 53.98 Favored 'General case' 0 N--CA 1.427 -1.623 2 O-C-N 134.858 6.858 . . . . 0.0 114.285 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -20.9 141.21 0.0 OUTLIER 'General case' 0 C--N 1.363 1.154 1 O-C-N 130.483 4.865 . . . . 0.0 115.886 -178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -107.46 167.96 9.57 Favored 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.566 -2.561 . . . . 0.0 110.531 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -173.94 61.9 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.02 1 O-C-N 130.736 5.022 . . . . 0.0 116.889 179.04 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.403 HG23 ' H ' ' A' ' 111' ' ' VAL . 99.9 t -22.53 94.1 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.634 0 O-C-N 126.672 2.483 . . . . 0.0 114.335 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.459 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -90.19 16.25 8.88 Favored 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 124.71 2.195 . . . . 0.0 115.341 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.74 122.6 4.02 Favored Glycine 0 C--O 1.197 -2.175 0 CA-C-N 113.908 -1.496 . . . . 0.0 114.378 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 63.23 6.09 2.23 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 119.216 3.043 . . . . 0.0 119.216 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.457 ' HE2' ' CE1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -167.97 -153.95 0.14 Allowed 'General case' 0 CA--C 1.496 -1.106 1 O-C-N 129.539 4.274 . . . . 0.0 110.977 179.931 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.535 HD22 ' HE3' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -162.78 110.48 1.28 Allowed 'General case' 0 CA--C 1.478 -1.805 0 C-N-CA 113.556 -3.258 . . . . 0.0 112.886 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.459 ' CD1' ' HB2' ' A' ' 112' ' ' GLU . 83.0 m-85 -66.48 80.52 0.1 Allowed 'General case' 0 C--N 1.351 0.66 1 CA-C-N 108.023 -4.171 . . . . 0.0 117.227 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 116' ' ' LEU . 1.3 tt -67.04 105.58 1.7 Allowed 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 111.716 -2.493 . . . . 0.0 104.82 178.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -109.92 115.72 30.32 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 116.416 -1.754 . . . . 0.0 109.15 -178.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -121.89 138.77 54.27 Favored 'General case' 0 CA--C 1.504 -0.816 1 O-C-N 130.386 4.804 . . . . 0.0 113.912 -179.98 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.62 ' O ' HD12 ' A' ' 120' ' ' LEU . 80.5 m -110.63 162.53 14.64 Favored 'General case' 0 C--O 1.2 -1.55 0 CA-C-N 108.642 -3.89 . . . . 0.0 105.651 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.92 54.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 127.051 3.31 . . . . 0.0 112.394 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 94.88 -43.56 2.27 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 109.813 -3.358 . . . . 0.0 114.156 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -141.28 -52.7 0.45 Allowed 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 113.412 -1.394 . . . . 0.0 110.279 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -67.01 148.19 52.26 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 126.919 2.637 . . . . 0.0 107.136 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.1 m -132.7 77.05 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.875 1 O-C-N 129.321 4.138 . . . . 0.0 111.973 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.76 142.81 58.27 Favored 'General case' 0 CA--C 1.497 -1.074 0 CA-C-N 114.59 -1.187 . . . . 0.0 112.133 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -125.47 115.14 19.78 Favored 'General case' 0 CA--C 1.506 -0.724 0 O-C-N 125.515 1.759 . . . . 0.0 115.107 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -99.46 167.42 10.63 Favored 'General case' 0 N--CA 1.487 1.379 1 O-C-N 129.118 4.012 . . . . 0.0 110.416 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.3 -46.14 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 119.595 1.089 . . . . 0.0 111.776 -178.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.422 ' C ' ' HB2' ' A' ' 115' ' ' LYS . 7.3 m-85 66.3 174.68 0.24 Allowed 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 128.955 2.902 . . . . 0.0 116.549 -179.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.538 ' HG2' ' HG3' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -157.11 118.34 3.68 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.625 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 21.2 ttpt -61.6 125.82 25.18 Favored 'General case' 0 C--O 1.207 -1.16 0 CA-C-O 116.231 -1.843 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.528 ' HG2' ' HG2' ' A' ' 133' ' ' LYS . 14.8 ptmt . . . . . 0 C--O 1.265 1.901 0 O-C-N 128.931 3.894 . . . . 0.0 118.864 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.535 ' HB3' ' CH2' ' A' ' 89' ' ' TRP . 5.7 mttt . . . . . 0 CA--C 1.497 -1.082 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.55 120.96 32.08 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -134.8 30.49 3.4 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 113.506 -3.14 . . . . 0.0 108.742 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.5 115.81 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 129.024 3.952 . . . . 0.0 112.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -153.38 -123.5 0.95 Allowed Glycine 0 C--O 1.203 -1.807 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.885 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.491 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER 179.53 148.95 0.28 Allowed 'General case' 0 N--CA 1.475 0.806 1 O-C-N 132.616 5.539 . . . . 0.0 107.686 -179.907 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.556 ' CZ3' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -156.93 106.2 2.22 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 128.932 3.895 . . . . 0.0 116.463 -179.726 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -38.74 -39.14 0.47 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 85.53 34.64 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 113.946 -2.93 . . . . 0.0 107.099 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 20.4 -75.94 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.973 1 O-C-N 130.845 5.091 . . . . 0.0 110.552 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -149.74 160.77 43.27 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 111.649 -2.523 . . . . 0.0 110.662 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -116.47 114.02 23.64 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 110.844 -2.889 . . . . 0.0 117.051 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -47.0 83.87 Favored 'General case' 0 CA--C 1.504 -0.806 1 O-C-N 130.085 4.616 . . . . 0.0 113.269 -179.766 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -128.76 95.93 4.24 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 112.362 -2.199 . . . . 0.0 114.739 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.675 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 2.2 t80 -100.31 -57.1 2.19 Favored 'General case' 0 CA--C 1.489 -1.383 0 CA-C-O 127.12 3.343 . . . . 0.0 108.395 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.475 ' N ' ' CD2' ' A' ' 17' ' ' PHE . 0.2 OUTLIER -65.05 -52.9 53.17 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 118.966 -2.333 . . . . 0.0 114.717 179.814 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.422 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -62.33 -25.14 66.36 Favored Glycine 0 N--CA 1.48 1.607 1 O-C-N 130.09 4.619 . . . . 0.0 111.63 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.538 ' OH ' HD21 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -66.98 -43.74 82.27 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-O 125.148 2.404 . . . . 0.0 108.221 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 mtp -72.05 -23.85 61.44 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-N 113.673 -1.603 . . . . 0.0 112.877 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.422 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 2.2 ttpt -76.21 -27.61 56.91 Favored 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 109.568 -3.469 . . . . 0.0 111.819 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.35 66.73 Favored 'General case' 0 C--N 1.318 -0.804 1 O-C-N 130.099 4.624 . . . . 0.0 112.089 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.79 -11.07 49.07 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 127.421 2.951 . . . . 0.0 104.372 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.3 t0 45.71 80.63 0.04 OUTLIER 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.137 3.827 . . . . 0.0 109.128 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.666 HD12 ' O ' ' A' ' 78' ' ' LEU . 14.1 tt -82.7 -15.8 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 1 CA-C-N 108.065 -4.152 . . . . 0.0 109.772 -179.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.405 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 1.3 t0 -173.38 -179.26 1.86 Allowed 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 117.523 -1.671 . . . . 0.0 112.289 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -119.25 86.5 2.56 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 62.5 49.88 3.85 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 126.959 2.662 . . . . 0.0 109.297 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' A' ' 27' ' ' ASP . 1.7 t -88.67 -26.59 21.76 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 108.571 -3.922 . . . . 0.0 113.186 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.403 ' O ' HD13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -68.84 -138.24 0.01 OUTLIER 'General case' 0 C--O 1.242 0.697 1 O-C-N 130.127 4.642 . . . . 0.0 108.435 179.953 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 0.1 OUTLIER 84.35 4.38 0.71 Allowed 'General case' 0 CA--C 1.497 -1.077 0 O-C-N 128.82 3.825 . . . . 0.0 113.291 179.422 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.403 HD13 ' O ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -137.43 -21.92 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.928 0 CA-C-N 110.111 -3.222 . . . . 0.0 114.426 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.721 ' HB1' ' CE2' ' A' ' 58' ' ' PHE . . . -90.49 11.34 22.04 Favored 'General case' 0 C--O 1.206 -1.217 0 CA-C-O 123.386 1.565 . . . . 0.0 112.365 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.5 t -44.73 -40.04 1.93 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-O 123.758 1.742 . . . . 0.0 109.931 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 169.34 117.78 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 109.337 -3.574 . . . . 0.0 115.399 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.864 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.4 OUTLIER -147.86 53.76 1.04 Allowed 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 110.704 -2.953 . . . . 0.0 104.972 179.53 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.1 m 68.87 139.94 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.243 1 O-C-N 135.106 7.754 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -125.78 -65.89 0.97 Allowed 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 117.296 2.332 . . . . 0.0 117.296 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.9 m 56.48 108.49 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.622 1 O-C-N 131.971 5.795 . . . . 0.0 111.628 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.7 149.05 23.23 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 127.988 3.305 . . . . 0.0 103.373 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.462 HG22 ' N ' ' A' ' 43' ' ' ILE . 5.1 mt -137.43 156.24 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 1 O-C-N 129.189 4.056 . . . . 0.0 110.29 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.5 ' HA ' ' HA ' ' A' ' 52' ' ' THR 0.32 6.6 tt -130.36 131.51 65.35 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 O-C-N 126.905 2.628 . . . . 0.0 108.257 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.271 72.4 t -137.58 125.98 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 113.412 -1.722 . . . . 0.0 110.312 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -132.67 88.66 2.55 Favored 'General case' 0 CA--C 1.489 -1.371 0 N-CA-C 118.979 2.955 . . . . 0.0 118.979 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -68.0 -54.78 15.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 C-N-CA 114.266 -2.973 . . . . 0.0 115.018 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.54 105.47 0.2 Allowed Glycine 0 C--O 1.205 -1.719 0 O-C-N 121.169 -0.957 . . . . 0.0 112.489 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 63.41 19.27 11.59 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 119.011 -1.075 . . . . 0.0 110.52 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -130.48 154.3 47.9 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 128.144 3.403 . . . . 0.0 108.399 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.719 ' CD1' HD13 ' A' ' 94' ' ' LEU . 51.1 t80 -155.02 99.92 2.15 Favored 'General case' 0 CA--C 1.484 -1.593 1 O-C-N 129.983 4.552 . . . . 0.0 112.932 -179.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -120.12 75.72 1.12 Allowed 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 126.508 2.38 . . . . 0.0 112.546 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 43' ' ' ILE . 0.7 OUTLIER -57.68 145.65 33.55 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 128.857 3.848 . . . . 0.0 106.04 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.479 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 4.2 ptmm? -145.26 152.57 40.17 Favored 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 115.396 -2.522 . . . . 0.0 111.397 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.499 HG23 ' HA ' ' A' ' 60' ' ' ASN . 4.1 t -106.43 155.16 19.85 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 124.934 2.302 . . . . 0.0 112.153 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -130.15 52.21 2.03 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 111.543 -2.571 . . . . 0.0 110.302 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 10.5 p -69.12 -99.69 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.078 1 O-C-N 129.332 4.145 . . . . 0.0 112.33 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.465 ' OG1' HD12 ' A' ' 37' ' ' LEU . 0.6 OUTLIER 153.81 -34.05 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 O-C-N 127.281 2.863 . . . . 0.0 104.27 -179.046 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.864 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -82.39 -60.88 2.05 Favored 'General case' 0 C--N 1.368 1.37 0 O-C-N 128.579 3.674 . . . . 0.0 112.111 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.3 98.41 3.43 Favored 'General case' 0 C--O 1.216 -0.704 2 CA-C-N 107.479 -4.418 . . . . 0.0 113.869 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.499 ' HA ' HG23 ' A' ' 54' ' ' THR . 54.3 m-20 -82.99 65.95 8.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 109.556 -3.475 . . . . 0.0 110.507 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -96.72 80.68 3.09 Favored 'General case' 0 CA--C 1.503 -0.862 0 O-C-N 127.058 2.724 . . . . 0.0 109.052 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.479 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 5.7 p-10 -79.72 132.63 36.24 Favored 'General case' 0 C--O 1.2 -1.507 1 O-C-N 129.685 4.366 . . . . 0.0 116.423 -179.605 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.52 HD23 ' CE1' ' A' ' 50' ' ' PHE . 3.2 tp -52.86 118.05 3.4 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 128.537 3.648 . . . . 0.0 109.563 177.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -135.46 84.69 2.11 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 116.766 -1.974 . . . . 0.0 111.639 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.759 ' CD1' HG21 ' A' ' 87' ' ' VAL . 6.5 p90 -171.62 145.07 1.96 Allowed 'General case' 0 N--CA 1.474 0.749 1 CA-C-O 128.939 4.209 . . . . 0.0 111.228 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.86 163.34 26.86 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 110.867 -2.879 . . . . 0.0 106.468 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.646 HG21 ' CD1' ' A' ' 89' ' ' TRP . 9.3 p -77.75 142.28 14.39 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.787 0 O-C-N 128.652 3.72 . . . . 0.0 112.127 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 59.17 14.58 26.11 Favored Glycine 0 N--CA 1.484 1.894 0 C-N-CA 116.217 -2.897 . . . . 0.0 117.323 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -83.63 -18.62 10.04 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.351 0 C-N-CA 118.062 -1.455 . . . . 0.0 107.819 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.492 ' HG3' HD12 ' A' ' 86' ' ' LEU . 1.4 mt-10 74.33 130.72 0.04 OUTLIER 'General case' 0 C--N 1.349 0.584 1 O-C-N 131.488 5.493 . . . . 0.0 109.536 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.685 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.5 t80 -107.74 29.12 7.52 Favored 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.647 3.092 . . . . 0.0 110.62 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -14.23 84.41 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.976 0 O-C-N 127.34 2.9 . . . . 0.0 115.585 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.421 ' HG2' ' HB3' ' A' ' 82' ' ' ASN . 3.0 mp0 59.62 173.23 0.08 Allowed 'General case' 0 C--O 1.209 -1.04 1 CA-C-O 129.128 4.299 . . . . 0.0 111.965 -179.345 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.509 ' ND1' ' N ' ' A' ' 74' ' ' HIS . 1.6 m-70 69.98 78.18 0.2 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-N 110.035 -3.257 . . . . 0.0 114.284 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 76.3 p -85.1 -82.32 0.18 Allowed 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 112.868 -1.969 . . . . 0.0 112.015 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.0 mtmt 60.96 168.98 0.09 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 126.215 2.912 . . . . 0.0 115.542 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.18 19.72 77.55 Favored Glycine 0 C--O 1.207 -1.565 0 CA-C-N 111.239 -2.709 . . . . 0.0 109.921 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.666 ' O ' HD12 ' A' ' 26' ' ' ILE . 3.1 tp -172.1 -44.39 0.02 OUTLIER 'General case' 0 CA--C 1.505 -0.756 1 O-C-N 130.74 4.435 . . . . 0.0 113.399 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.18 -70.21 0.57 Allowed 'General case' 0 CA--C 1.5 -0.948 0 CA-C-O 124.119 1.914 . . . . 0.0 113.011 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.76 87.88 1.21 Allowed Glycine 0 N--CA 1.476 1.332 0 CA-C-N 113.722 -1.581 . . . . 0.0 111.114 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.4 mmt-85 -144.44 178.96 7.57 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 127.084 2.284 . . . . 0.0 109.5 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.421 ' HB3' ' HG2' ' A' ' 73' ' ' GLU . 63.6 m-20 -120.47 75.07 1.09 Allowed 'General case' 0 CA--C 1.501 -0.934 0 O-C-N 124.901 1.376 . . . . 0.0 110.714 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.455 HG13 ' N ' ' A' ' 99' ' ' LYS . 17.5 t -113.47 139.15 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 O-C-N 128.815 3.822 . . . . 0.0 111.421 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.464 ' HE2' ' CA ' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -32.35 -69.34 0.08 Allowed 'General case' 0 CA--C 1.504 -0.794 1 O-C-N 131.864 5.727 . . . . 0.0 112.87 -179.856 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.685 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 62.4 m 62.65 68.47 0.65 Allowed 'General case' 0 C--O 1.199 -1.573 0 C-N-CA 127.432 2.293 . . . . 0.0 110.585 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.551 ' HB3' HG23 ' A' ' 97' ' ' VAL . 4.0 tt -91.3 112.82 24.89 Favored 'General case' 0 N--CA 1.429 -1.514 2 O-C-N 131.502 5.501 . . . . 0.0 116.425 -179.429 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.759 HG21 ' CD1' ' A' ' 65' ' ' PHE . 38.4 t -92.88 151.25 3.65 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 CA-C-O 122.764 1.268 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.477 ' HA ' ' CG2' ' A' ' 67' ' ' VAL . 4.0 t -164.3 159.08 19.49 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 112.203 -2.271 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.683 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.252 18.1 m95 -86.49 149.56 24.89 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 114.083 -2.865 . . . . 0.0 105.171 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.532 ' CB ' HG22 ' A' ' 93' ' ' THR . 2.8 tm-20 -96.82 -47.06 6.01 Favored 'General case' 0 C--O 1.195 -1.786 1 CA-C-O 128.949 4.214 . . . . 0.0 111.974 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -179.76 -49.72 0.08 OUTLIER Glycine 0 C--O 1.197 -2.179 1 CA-C-N 107.669 -4.332 . . . . 0.0 103.899 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -141.54 29.03 1.78 Allowed 'General case' 0 N--CA 1.447 -0.613 1 O-C-N 133.118 5.834 . . . . 0.0 111.344 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.532 HG22 ' CB ' ' A' ' 90' ' ' GLU . 1.5 t -162.42 160.91 26.94 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.719 HD13 ' CD1' ' A' ' 50' ' ' PHE . 3.4 tt -93.51 112.48 24.38 Favored 'General case' 0 CA--C 1.487 -1.479 0 O-C-N 127.951 3.282 . . . . 0.0 114.679 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.352 52.9 t -116.83 134.91 58.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 111.726 -2.488 . . . . 0.0 114.552 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 34.4 t -137.18 140.92 42.1 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.551 HG23 ' HB3' ' A' ' 86' ' ' LEU . 6.1 m -128.93 101.34 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 1 CA-C-O 128.635 4.064 . . . . 0.0 118.949 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.437 ' NE2' HG11 ' A' ' 83' ' ' VAL 0.302 4.0 mm100 -71.9 111.01 6.8 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-N 110.185 -3.189 . . . . 0.0 107.464 179.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.455 ' N ' HG13 ' A' ' 83' ' ' VAL . 3.3 ttmt -37.3 -46.03 0.72 Allowed 'General case' 0 C--O 1.195 -1.81 1 O-C-N 129.579 4.299 . . . . 0.0 111.014 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.403 ' H ' HG13 ' A' ' 83' ' ' VAL . . . 114.89 -86.63 0.42 Allowed Glycine 0 C--O 1.203 -1.833 0 CA-C-O 125.925 2.958 . . . . 0.0 113.37 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.78 16.18 7.88 Favored 'General case' 0 CA--C 1.497 -1.095 1 CA-C-N 106.421 -4.889 . . . . 0.0 109.423 -179.633 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.402 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 155.53 -33.83 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 125.852 2.739 . . . . 0.0 113.516 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.402 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 2.7 mt-10 -104.99 178.73 4.48 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 110.037 -3.256 . . . . 0.0 117.301 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . 0.251 7.7 m-20 -144.94 79.9 1.61 Allowed 'General case' 0 N--CA 1.489 1.49 2 CA-C-N 106.535 -4.848 . . . . 0.0 101.732 179.447 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.402 ' C ' ' HG3' ' A' ' 98' ' ' GLN . 2.5 tpt180 -101.21 -3.3 29.3 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 126.376 2.989 . . . . 0.0 114.172 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -52.15 103.53 0.12 Allowed Glycine 0 N--CA 1.426 -1.968 1 CA-C-N 107.271 -4.513 . . . . 0.0 118.724 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.45 ' C ' ' HD2' ' A' ' 108' ' ' LYS . 0.1 OUTLIER -97.16 146.46 25.04 Favored 'General case' 0 C--O 1.214 -0.778 0 O-C-N 129.299 3.588 . . . . 0.0 110.283 178.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.604 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -163.08 177.19 9.35 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 128.747 3.779 . . . . 0.0 113.097 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.916 ' HG2' HD13 ' A' ' 116' ' ' LEU . 1.1 mp0 -143.12 173.37 11.63 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 116.26 -2.176 . . . . 0.0 108.324 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.604 ' CH2' ' HG3' ' A' ' 108' ' ' LYS 0.29 0.0 OUTLIER -159.23 24.77 0.2 Allowed 'General case' 0 CA--C 1.501 -0.912 1 O-C-N 129.623 4.327 . . . . 0.0 117.542 179.551 . . . . . . . . 5 4 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 32.0 t 23.68 78.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 CA-C-O 127.973 3.749 . . . . 0.0 117.432 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -90.13 57.73 3.86 Favored 'General case' 0 CA--C 1.484 -1.562 0 O-C-N 118.753 -2.467 . . . . 0.0 112.441 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.09 -126.23 7.37 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 111.685 -2.507 . . . . 0.0 111.424 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -106.69 39.49 1.83 Allowed 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 113.875 -1.162 . . . . 0.0 113.139 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.9 pttt -170.48 142.3 2.08 Favored 'General case' 0 C--N 1.316 -0.867 1 O-C-N 130.104 4.627 . . . . 0.0 105.836 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.916 HD13 ' HG2' ' A' ' 109' ' ' GLN . 3.7 pp -115.49 133.89 55.6 Favored 'General case' 0 C--O 1.194 -1.855 0 O-C-N 128.093 3.371 . . . . 0.0 111.202 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.428 ' O ' ' N ' ' A' ' 119' ' ' GLU . 2.9 m-85 -77.7 92.81 4.18 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 109.441 -3.527 . . . . 0.0 114.364 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -74.73 76.88 2.07 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 109.096 -3.684 . . . . 0.0 106.197 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 117' ' ' TYR . 40.8 mt-10 -85.29 101.86 12.89 Favored 'General case' 0 CA--C 1.485 -1.539 0 O-C-N 129.094 3.996 . . . . 0.0 110.682 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.44 154.67 33.35 Favored 'General case' 0 CA--C 1.487 -1.472 1 O-C-N 129.311 4.132 . . . . 0.0 111.686 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.0 m -111.89 160.01 17.81 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 110.458 -3.065 . . . . 0.0 105.738 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 3.3 m -151.85 33.85 0.54 Allowed 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.541 1.064 . . . . 0.0 111.647 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.71 -41.26 2.25 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 22.6 t70 172.12 91.45 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.295 0 C-N-CA 125.941 1.697 . . . . 0.0 108.609 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -167.78 -53.47 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 111.067 -2.788 . . . . 0.0 105.435 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.424 HG12 ' O ' ' A' ' 126' ' ' VAL . 4.1 t 58.26 54.22 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.686 1 O-C-N 130.14 4.65 . . . . 0.0 113.716 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 49.6 t -42.11 124.69 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 124.663 1.227 . . . . 0.0 110.193 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.48 92.89 4.31 Favored 'General case' 0 CA--C 1.486 -1.506 0 CA-C-N 113.732 -1.576 . . . . 0.0 114.043 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -74.17 157.21 36.35 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 114.919 -2.712 . . . . 0.0 113.658 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 130' ' ' VAL . 52.0 t -142.51 86.97 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 CA-C-O 125.066 2.365 . . . . 0.0 108.068 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.532 ' CE2' ' HB2' ' A' ' 9' ' ' TRP 0.266 6.2 m-85 -72.2 -179.33 2.8 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 109.583 -3.462 . . . . 0.0 116.335 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.67 120.95 0.93 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 109.118 -3.673 . . . . 0.0 103.607 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.556 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 3.2 ttpm? -70.72 90.37 0.77 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 112.111 -2.313 . . . . 0.0 115.048 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.405 ' HD3' HG22 ' A' ' 8' ' ' THR . 3.9 ttpt . . . . . 0 CA--C 1.482 -1.664 0 CA-C-O 114.149 -2.834 . . . . 0.0 118.186 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 116.196 1.924 . . . . 0.0 116.196 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -106.82 97.94 7.66 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -92.76 -124.42 0.09 Allowed 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 115.354 -2.26 . . . . 0.0 107.261 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 71.52 100.02 0.07 Allowed 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 130.329 3.452 . . . . 0.0 112.542 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.27 -130.44 1.18 Allowed Glycine 0 CA--C 1.534 1.242 0 CA-C-O 114.789 -3.228 . . . . 0.0 113.759 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.534 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -169.6 147.35 3.5 Favored 'General case' 0 C--O 1.214 -0.811 1 O-C-N 133.59 6.112 . . . . 0.0 104.519 -179.892 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.534 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -148.24 109.42 4.32 Favored 'General case' 0 CA--C 1.494 -1.176 1 O-C-N 130.941 5.151 . . . . 0.0 114.78 -179.894 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -78.41 119.99 22.51 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 127.4 2.937 . . . . 0.0 111.576 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.531 ' HB3' ' HG2' ' A' ' 39' ' ' GLN . 3.4 ttp -57.54 96.05 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 O-C-N 126.243 2.215 . . . . 0.0 106.53 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.59 -14.23 40.3 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 130.207 3.403 . . . . 0.0 111.688 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.415 ' HB3' HG23 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -173.8 158.29 3.22 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.609 -1.632 . . . . 0.0 113.262 -179.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.422 ' HB3' ' CE ' ' A' ' 11' ' ' MET . 14.1 p-10 -133.86 129.47 36.48 Favored 'General case' 0 CA--C 1.493 -1.228 0 O-C-N 127.947 3.28 . . . . 0.0 111.337 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -101.25 -71.31 0.71 Allowed 'General case' 0 CA--C 1.477 -1.833 1 O-C-N 129.779 4.425 . . . . 0.0 115.247 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.98 -71.07 0.51 Allowed 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 118.845 -2.409 . . . . 0.0 115.697 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 71.73 -72.58 0.11 Allowed 'General case' 0 C--O 1.198 -1.609 0 O-C-N 126.546 2.403 . . . . 0.0 112.156 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.49 ' CB ' ' HB3' ' A' ' 31' ' ' ARG . 0.1 OUTLIER -76.49 -30.44 57.25 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.987 -179.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.47 -22.97 77.89 Favored Glycine 0 N--CA 1.484 1.843 1 O-C-N 130.345 4.778 . . . . 0.0 108.404 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.58 -46.65 53.3 Favored 'General case' 0 C--O 1.194 -1.837 0 CA-C-O 126.006 2.813 . . . . 0.0 108.933 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.7 mtt -59.93 -29.5 68.43 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 110.451 -3.068 . . . . 0.0 112.928 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -79.72 -23.93 42.01 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 127.757 3.16 . . . . 0.0 112.008 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.37 -29.09 64.55 Favored 'General case' 0 C--O 1.205 -1.243 1 O-C-N 132.211 5.944 . . . . 0.0 114.419 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.484 HD11 ' O ' ' A' ' 78' ' ' LEU . 0.9 OUTLIER -111.06 20.06 17.82 Favored 'General case' 0 CA--C 1.539 0.538 1 O-C-N 129.807 4.442 . . . . 0.0 108.529 179.975 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 20.45 86.75 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.571 1 O-C-N 130.053 4.596 . . . . 0.0 110.279 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.419 ' CG2' ' N ' ' A' ' 27' ' ' ASP . 6.4 tp -98.77 -39.78 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 CA-C-O 127.045 3.307 . . . . 0.0 112.017 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.419 ' N ' ' CG2' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -171.61 -158.61 0.13 Allowed 'General case' 0 C--N 1.359 0.994 0 O-C-N 119.241 -2.162 . . . . 0.0 109.183 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -143.84 49.14 1.39 Allowed 'General case' 0 C--O 1.207 -1.152 0 O-C-N 121.441 -0.787 . . . . 0.0 112.335 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 152.19 78.98 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.792 0 O-C-N 127.942 3.277 . . . . 0.0 107.699 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.5 m -139.17 22.42 2.59 Favored 'General case' 0 CA--C 1.504 -0.798 2 CA-C-N 106.282 -4.963 . . . . 0.0 113.357 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.49 ' HB3' ' CB ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.44 24.05 10.89 Favored 'General case' 0 CA--C 1.509 -0.603 0 O-C-N 128.186 3.429 . . . . 0.0 113.945 179.744 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.501 ' O ' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -114.45 15.19 17.93 Favored 'General case' 0 CA--C 1.488 -1.441 0 O-C-N 127.284 2.865 . . . . 0.0 112.464 -179.44 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.506 ' N ' HD12 ' A' ' 33' ' ' ILE . 0.4 OUTLIER -170.04 74.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.362 1.132 1 CA-C-N 107.931 -4.213 . . . . 0.0 109.493 -179.791 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 33' ' ' ILE . . . 172.32 -38.25 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.182 0 O-C-N 120.367 -1.458 . . . . 0.0 109.079 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 51.1 t -17.95 -47.85 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 O-C-N 128.935 3.897 . . . . 0.0 112.717 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.654 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 159.42 114.68 0.0 OUTLIER 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 108.955 -3.748 . . . . 0.0 113.333 179.515 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.944 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -145.53 85.94 1.73 Allowed 'General case' 0 C--O 1.212 -0.905 1 CA-C-N 108.249 -4.069 . . . . 0.0 107.138 179.722 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.5 m 72.91 47.35 0.21 Allowed 'General case' 0 N--CA 1.485 1.318 1 O-C-N 133.973 7.046 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 11' ' ' MET . 4.0 tt0 -79.52 135.36 36.61 Favored 'General case' 0 CA--C 1.492 -1.257 0 C-N-CA 118.393 -1.323 . . . . 0.0 113.277 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.4 m -152.52 120.47 6.17 Favored 'General case' 0 C--O 1.212 -0.905 0 C-N-CA 130.26 3.424 . . . . 0.0 111.5 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.782 ' HE2' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -103.62 152.97 21.13 Favored 'General case' 0 N--CA 1.48 1.048 1 O-C-N 129.169 4.043 . . . . 0.0 103.486 179.853 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.502 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.2 mp -140.0 156.64 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 O-C-N 126.886 2.616 . . . . 0.0 109.71 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.502 ' N ' HG22 ' A' ' 42' ' ' ILE 0.295 1.4 tt -127.38 138.08 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.495 0 O-C-N 128.217 3.448 . . . . 0.0 109.45 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.8 t -137.14 87.69 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.274 0 CA-C-N 112.038 -2.346 . . . . 0.0 109.704 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -99.61 102.99 14.66 Favored 'General case' 0 C--O 1.21 -0.982 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.86 -14.27 23.32 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 128.012 3.32 . . . . 0.0 112.477 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.69 -96.23 0.18 Allowed Glycine 0 C--O 1.203 -1.795 0 CA-C-O 122.955 1.308 . . . . 0.0 111.208 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.628 ' O ' HG23 ' A' ' 66' ' ' THR . 96.1 m-20 -86.36 -13.6 45.98 Favored 'General case' 0 C--O 1.21 -1.002 0 CA-C-N 110.872 -2.664 . . . . 0.0 110.661 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.47 HD22 ' N ' ' A' ' 49' ' ' ASN . 2.4 m-80 -109.69 93.34 4.45 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 128.438 3.586 . . . . 0.0 109.57 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.877 ' CD2' HD13 ' A' ' 94' ' ' LEU . 91.3 t80 -108.15 101.04 10.3 Favored 'General case' 0 CA--C 1.501 -0.926 1 O-C-N 129.66 4.35 . . . . 0.0 115.446 -179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 30.4 mttt -112.35 85.98 2.26 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 119.022 2.971 . . . . 0.0 119.022 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.428 ' O ' HG22 ' A' ' 52' ' ' THR . 0.9 OUTLIER -65.25 120.47 12.8 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 128.255 3.472 . . . . 0.0 106.222 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -125.43 150.82 46.94 Favored 'General case' 0 CA--C 1.493 -1.232 0 O-C-N 126.513 2.383 . . . . 0.0 112.31 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -98.14 175.3 6.14 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 125.407 1.692 . . . . 0.0 110.457 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.486 ' HB2' HD11 ' A' ' 42' ' ' ILE . 2.4 t-20 -148.65 35.75 0.78 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.827 -1.988 . . . . 0.0 115.483 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.542 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 9.6 p -73.04 167.86 20.25 Favored 'General case' 0 C--N 1.323 -0.549 1 O-C-N 130.66 4.975 . . . . 0.0 111.927 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 57' ' ' THR . 10.3 m -101.56 -1.84 31.98 Favored 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 128.738 3.774 . . . . 0.0 110.746 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.944 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -108.93 -58.95 1.95 Allowed 'General case' 0 C--O 1.218 -0.597 0 O-C-N 123.962 0.789 . . . . 0.0 110.864 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.7 mtt85 -137.8 122.59 18.78 Favored 'General case' 0 C--N 1.357 0.899 1 O-C-N 130.183 4.677 . . . . 0.0 116.186 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.4 99.38 5.81 Favored 'General case' 0 N--CA 1.439 -0.988 1 O-C-N 129.168 4.042 . . . . 0.0 111.209 -179.894 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.58 -67.78 0.92 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 110.177 -3.192 . . . . 0.0 107.653 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.441 ' HB2' ' CB ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER 98.02 176.81 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.364 5.415 . . . . 0.0 110.692 179.963 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 65' ' ' PHE . 8.6 tp -113.92 49.91 0.96 Allowed 'General case' 0 N--CA 1.436 -1.155 0 O-C-N 127.183 2.802 . . . . 0.0 112.643 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.509 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 14.9 t70 -59.59 89.37 0.01 OUTLIER 'General case' 0 C--O 1.211 -0.958 0 O-C-N 128.742 3.776 . . . . 0.0 105.923 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.548 ' CD2' HG11 ' A' ' 87' ' ' VAL . 0.8 OUTLIER -125.81 -174.1 3.0 Favored 'General case' 0 CA--C 1.495 -1.165 1 CA-C-O 128.994 4.235 . . . . 0.0 110.141 -179.763 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.628 HG23 ' O ' ' A' ' 48' ' ' ASP . 1.0 OUTLIER -167.12 122.15 1.07 Allowed 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 109.856 -3.338 . . . . 0.0 106.374 179.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.851 HG13 ' HA ' ' A' ' 88' ' ' THR . 3.7 t -36.92 119.9 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.202 -1.412 1 O-C-N 129.638 4.336 . . . . 0.0 115.769 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.32 23.8 70.03 Favored Glycine 0 N--CA 1.487 2.05 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.3 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.575 HG23 ' HB ' ' A' ' 66' ' ' THR . 1.2 t -69.09 -32.39 53.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.508 0 CA-C-N 112.162 -2.019 . . . . 0.0 109.939 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 57.03 73.99 0.43 Allowed 'General case' 0 C--N 1.356 0.867 1 O-C-N 130.555 4.909 . . . . 0.0 108.697 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -84.29 122.97 29.65 Favored 'General case' 0 CA--C 1.498 -1.042 1 O-C-N 129.352 4.157 . . . . 0.0 119.225 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -91.49 54.71 2.58 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.091 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HG2' HG23 ' A' ' 75' ' ' THR . 5.5 tt0 -21.94 109.01 0.02 OUTLIER 'General case' 0 CA--C 1.483 -1.617 0 CA-C-O 126.051 2.834 . . . . 0.0 113.257 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.82 54.73 0.86 Allowed 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 110.3 -3.137 . . . . 0.0 112.044 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.475 HG23 ' HG2' ' A' ' 73' ' ' GLU . 0.8 OUTLIER -53.16 169.95 0.1 Allowed 'General case' 0 C--O 1.201 -1.471 0 CA-C-N 110.809 -2.905 . . . . 0.0 112.316 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.441 ' HA ' ' CA ' ' A' ' 80' ' ' GLY . 0.1 OUTLIER 158.89 -32.19 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.807 1 O-C-N 130.036 4.585 . . . . 0.0 115.807 -179.917 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.59 -21.49 57.89 Favored Glycine 0 C--O 1.218 -0.868 0 CA-C-N 108.441 -3.981 . . . . 0.0 112.843 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.484 ' O ' HD11 ' A' ' 24' ' ' LEU 0.311 5.6 tp -171.32 36.47 0.02 OUTLIER 'General case' 0 CA--C 1.503 -0.849 1 O-C-N 132.977 5.751 . . . . 0.0 113.477 -179.844 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.475 ' HB3' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -170.65 -58.47 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.66 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . 0.441 ' CA ' ' HA ' ' A' ' 76' ' ' LYS . . . 67.36 58.33 8.06 Favored Glycine 0 C--O 1.204 -1.734 0 C-N-CA 125.976 1.75 . . . . 0.0 111.463 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.28 -170.24 1.6 Allowed 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 129.707 3.828 . . . . 0.0 115.255 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -163.43 81.62 0.46 Allowed 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 113.445 -1.707 . . . . 0.0 109.411 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.519 HG11 ' HG2' ' A' ' 98' ' ' GLN . 3.6 t -125.02 155.37 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 0 O-C-N 127.528 3.017 . . . . 0.0 117.511 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -87.25 86.08 7.24 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 109.686 -3.416 . . . . 0.0 111.22 -179.79 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.4 m -90.52 85.64 6.19 Favored 'General case' 0 C--O 1.206 -1.201 0 O-C-N 127.202 2.814 . . . . 0.0 111.2 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.7 tt -79.85 146.97 31.93 Favored 'General case' 0 CA--C 1.511 -0.534 2 CA-C-N 106.521 -4.854 . . . . 0.0 112.019 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.548 HG11 ' CD2' ' A' ' 65' ' ' PHE . 1.4 p -134.9 143.4 37.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 125.792 1.637 . . . . 0.0 112.126 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.851 ' HA ' HG13 ' A' ' 67' ' ' VAL . 5.8 t -166.98 169.48 12.95 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-O 126.75 3.166 . . . . 0.0 112.209 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.705 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.8 m95 -91.83 145.01 24.9 Favored 'General case' 0 CA--C 1.509 -0.628 0 O-C-N 117.579 -3.201 . . . . 0.0 105.732 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.565 ' HB3' HG22 ' A' ' 93' ' ' THR . 1.1 tm-20 -85.9 -59.54 2.27 Favored 'General case' 0 C--O 1.203 -1.374 0 CA-C-O 127.813 3.673 . . . . 0.0 111.077 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.71 59.52 0.01 OUTLIER Glycine 0 C--O 1.195 -2.33 2 N-CA-C 100.818 -4.913 . . . . 0.0 100.818 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.491 ' O ' ' HB ' ' A' ' 93' ' ' THR . 11.6 t30 99.2 93.06 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 2 O-C-N 131.929 5.135 . . . . 0.0 104.142 -178.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.565 HG22 ' HB3' ' A' ' 90' ' ' GLU . 1.2 t 127.04 152.47 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.389 0 C-N-CA 130.291 3.436 . . . . 0.0 118.352 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.877 HD13 ' CD2' ' A' ' 50' ' ' PHE 0.268 0.6 OUTLIER -93.64 97.69 10.64 Favored 'General case' 0 CA--C 1.486 -1.495 0 CA-C-N 110.209 -3.178 . . . . 0.0 117.585 -179.407 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.529 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.418 42.3 t -92.65 151.1 3.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 CA-C-N 112.803 -1.999 . . . . 0.0 113.883 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.652 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 0.8 OUTLIER -165.84 157.23 13.9 Favored 'General case' 0 C--O 1.204 -1.328 0 O-C-N 126.977 2.673 . . . . 0.0 105.041 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.422 HG22 ' C ' ' A' ' 96' ' ' CYS 0.286 0.0 OUTLIER -150.93 115.33 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.741 2 O-C-N 129.746 4.404 . . . . 0.0 115.259 -179.869 . . . . . . . . 5 4 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.519 ' HG2' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -78.25 98.14 5.79 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 126.329 2.966 . . . . 0.0 109.444 -179.873 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -85.27 84.62 7.61 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 109.595 -3.457 . . . . 0.0 110.898 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.469 ' CA ' HG13 ' A' ' 83' ' ' VAL . . . -94.4 -155.95 31.96 Favored Glycine 0 C--O 1.2 -2.016 0 CA-C-O 125.53 2.739 . . . . 0.0 108.058 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -93.02 -47.42 7.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 110.528 -2.836 . . . . 0.0 113.066 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.458 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -111.29 -61.32 1.71 Allowed 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -75.31 167.19 22.38 Favored 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 111.391 -2.641 . . . . 0.0 117.385 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.43 ' O ' ' HB ' ' A' ' 121' ' ' THR . 44.9 m-80 -121.6 86.71 2.62 Favored 'General case' 0 CA--C 1.537 0.471 1 CA-C-N 107.353 -4.476 . . . . 0.0 103.592 179.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.502 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 28.4 mmm-85 -87.8 175.03 8.02 Favored 'General case' 0 N--CA 1.48 1.066 1 O-C-N 129.672 4.357 . . . . 0.0 107.374 179.549 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.23 -167.39 33.9 Favored Glycine 0 C--O 1.207 -1.554 1 O-C-N 130.705 5.003 . . . . 0.0 115.693 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.652 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 1.6 p90 -175.52 16.44 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.76 1 O-C-N 131.977 5.163 . . . . 0.0 121.15 178.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.54 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -45.24 133.33 7.03 Favored 'General case' 0 C--O 1.208 -1.126 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 -176.83 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.401 ' O ' ' CE3' ' A' ' 110' ' ' TRP . 24.5 mm-40 -93.06 168.09 11.36 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 113.975 -2.916 . . . . 0.0 109.525 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.54 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 10.8 m95 -125.07 -38.58 2.31 Favored 'General case' 0 C--O 1.211 -0.956 1 O-C-N 130.226 4.704 . . . . 0.0 114.231 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.5 t 67.3 51.99 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.81 1 CA-C-O 129.721 4.581 . . . . 0.0 109.048 -175.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -98.97 122.72 42.59 Favored 'General case' 0 CA--C 1.475 -1.916 1 CA-C-N 107.043 -4.617 . . . . 0.0 119.009 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 35.35 74.2 0.09 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 118.147 2.019 . . . . 0.0 118.147 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 73.57 -30.85 0.21 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 129.398 3.079 . . . . 0.0 119.257 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.462 ' HG3' ' CE1' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -106.12 174.65 5.79 Favored 'General case' 0 CA--C 1.498 -1.034 1 O-C-N 130.272 4.733 . . . . 0.0 109.756 -179.784 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.782 HD22 ' HE2' ' A' ' 41' ' ' LYS . 4.4 tt -121.04 94.97 4.51 Favored 'General case' 0 C--O 1.197 -1.708 1 O-C-N 129.951 4.532 . . . . 0.0 112.269 179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.462 ' CE1' ' HG3' ' A' ' 115' ' ' LYS . 5.9 m-30 -66.39 131.26 45.68 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 109.938 -3.301 . . . . 0.0 111.123 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.592 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -109.21 102.98 11.88 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 111.171 -2.74 . . . . 0.0 107.947 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -107.44 139.08 42.49 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.705 HD12 ' O ' ' A' ' 121' ' ' THR . 0.1 OUTLIER -137.29 149.91 47.42 Favored 'General case' 0 CA--C 1.485 -1.546 1 O-C-N 129.941 4.525 . . . . 0.0 108.487 -179.568 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.705 ' O ' HD12 ' A' ' 120' ' ' LEU . 4.0 m -111.23 156.48 21.4 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.21 -2.144 . . . . 0.0 105.21 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.24 88.66 0.67 Allowed 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 119.13 -1.028 . . . . 0.0 110.959 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 46.24 39.93 10.05 Favored Glycine 0 CA--C 1.508 -0.399 0 CA-C-O 122.725 1.18 . . . . 0.0 114.776 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 t70 71.21 92.31 0.09 Allowed 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 126.275 1.83 . . . . 0.0 110.432 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.22 -53.1 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.374 1 O-C-N 130.275 4.734 . . . . 0.0 105.467 179.813 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.623 HG22 HG23 ' A' ' 121' ' ' THR . 15.8 t 61.78 78.02 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 CA-C-N 108.834 -3.803 . . . . 0.0 117.953 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.429 ' HB3' HD23 ' A' ' 120' ' ' LEU . 4.5 t -58.89 125.99 25.82 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 113.436 -1.711 . . . . 0.0 108.671 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -110.72 100.41 9.18 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 125.606 1.816 . . . . 0.0 110.615 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -93.6 163.93 13.36 Favored 'General case' 0 CA--C 1.489 -1.398 0 O-C-N 124.691 1.244 . . . . 0.0 112.258 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.415 HG23 ' HB3' ' A' ' 13' ' ' SER . 0.7 OUTLIER -136.46 137.34 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-O 126.288 2.947 . . . . 0.0 106.996 -179.882 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.592 ' CE1' ' HB2' ' A' ' 118' ' ' LEU 0.273 64.1 m-85 -124.56 177.41 5.95 Favored 'General case' 0 CA--C 1.497 -1.09 1 CA-C-N 108.055 -4.157 . . . . 0.0 116.612 179.855 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.77 139.31 19.61 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 110.622 -2.99 . . . . 0.0 103.774 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.506 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 4.9 ttmm -79.17 119.62 22.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-O 116.654 -1.641 . . . . 0.0 111.939 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.404 ' HB3' HG22 ' A' ' 8' ' ' THR . 13.7 ptpt . . . . . 0 CA--C 1.49 -1.348 0 O-C-N 128.885 3.865 . . . . 0.0 118.863 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.415 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 1.2 ptmm? . . . . . 0 N--CA 1.435 -1.176 0 N-CA-C 117.988 2.588 . . . . 0.0 117.988 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -148.63 71.98 1.17 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -133.2 160.28 37.71 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -147.25 165.66 29.41 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.632 3.708 . . . . 0.0 112.614 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.3 -149.53 9.89 Favored Glycine 0 C--O 1.203 -1.802 0 CA-C-O 116.619 -2.212 . . . . 0.0 112.693 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.7 t -163.65 41.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 129.236 3.551 . . . . 0.0 105.155 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.731 ' CZ2' HD23 ' A' ' 116' ' ' LEU 0.307 0.1 OUTLIER -36.69 103.43 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.816 1 O-C-N 131.45 5.469 . . . . 0.0 112.179 -179.208 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.41 -51.17 60.49 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.689 2.493 . . . . 0.0 114.884 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.2 ttt 93.41 86.85 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.669 1 O-C-N 129.904 4.503 . . . . 0.0 103.591 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -43.9 -47.54 8.37 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 129.059 3.974 . . . . 0.0 110.802 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -158.33 -179.77 8.41 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 111.214 -2.721 . . . . 0.0 112.111 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -156.22 151.8 27.01 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 17' ' ' PHE . 3.1 mm-40 -93.82 -164.07 1.13 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 108.628 -3.896 . . . . 0.0 110.769 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.412 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 11.3 p30 -30.21 83.69 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 C-N-CA 127.401 2.28 . . . . 0.0 111.85 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.4 ' N ' ' O ' ' A' ' 15' ' ' GLU . 13.3 t80 -69.7 -31.12 68.96 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.342 3.925 . . . . 0.0 107.898 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.533 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -73.69 -49.17 27.11 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 110.649 -2.978 . . . . 0.0 111.48 179.659 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.433 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -53.57 -22.44 16.98 Favored Glycine 0 CA--C 1.487 -1.7 1 O-C-N 130.425 4.828 . . . . 0.0 113.506 179.784 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.54 ' OH ' HD21 ' A' ' 78' ' ' LEU . 6.5 t80 -79.72 -38.02 34.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.576 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -77.25 -20.59 54.94 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 113.046 -1.888 . . . . 0.0 112.055 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.433 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 2.3 ttmt -73.48 -39.99 64.47 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 110.468 -3.06 . . . . 0.0 111.659 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.53 -40.18 85.05 Favored 'General case' 0 C--O 1.211 -0.933 1 O-C-N 130.429 4.831 . . . . 0.0 111.383 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.673 HD13 HD13 ' A' ' 26' ' ' ILE 0.322 15.1 mt -70.53 -29.74 66.3 Favored 'General case' 0 C--O 1.208 -1.107 2 O-C-N 130.002 4.564 . . . . 0.0 104.861 -179.885 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t0 56.55 43.97 24.83 Favored 'General case' 0 C--O 1.202 -1.425 3 O-C-N 131.696 5.622 . . . . 0.0 103.806 -177.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.673 HD13 HD13 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -70.9 -9.91 13.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 1 CA-C-N 105.665 -5.243 . . . . 0.0 112.592 -178.403 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 50.2 -157.45 0.09 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 109.015 -3.721 . . . . 0.0 114.133 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 1.9 m-30 79.98 -20.38 0.39 Allowed 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 127.956 3.285 . . . . 0.0 115.741 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.49 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . . . 58.25 60.62 2.58 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 103.721 -2.696 . . . . 0.0 103.721 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 30' ' ' THR . 34.2 m -127.87 42.76 3.26 Favored 'General case' 0 N--CA 1.475 0.786 2 CA-C-N 105.369 -5.378 . . . . 0.0 115.294 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.533 ' HB2' ' HA ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.06 -34.69 3.81 Favored 'General case' 0 CA--C 1.499 -1.017 1 O-C-N 129.457 4.223 . . . . 0.0 113.536 -179.629 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.472 ' N ' ' HG2' ' A' ' 31' ' ' ARG 0.258 19.7 tttm -99.11 55.6 1.01 Allowed 'General case' 0 C--N 1.309 -1.158 0 O-C-N 125.762 1.914 . . . . 0.0 107.7 179.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.73 -49.77 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.293 2 O-C-N 132.67 6.231 . . . . 0.0 109.732 -179.703 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.554 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -89.57 11.71 18.81 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.511 179.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.2 t -37.15 -46.22 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 O-C-N 125.897 1.998 . . . . 0.0 111.167 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.585 ' HD2' ' HB3' ' A' ' 39' ' ' GLN . 0.8 OUTLIER 169.13 100.6 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.63 1 O-C-N 130.103 4.627 . . . . 0.0 115.351 -179.991 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.711 HD23 ' CD2' ' A' ' 58' ' ' PHE . 1.4 pp -96.71 -8.72 30.69 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 128.329 3.518 . . . . 0.0 107.314 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.648 ' N ' HD12 ' A' ' 37' ' ' LEU . 1.8 m 143.94 112.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.128 1 O-C-N 133.109 6.506 . . . . 0.0 110.282 -179.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.585 ' HB3' ' HD2' ' A' ' 36' ' ' ARG . 61.8 tt0 -127.47 148.2 50.3 Favored 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.619 3.074 . . . . 0.0 115.301 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.417 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 41.7 m -144.46 119.37 9.95 Favored 'General case' 0 C--N 1.318 -0.769 1 O-C-N 131.469 5.481 . . . . 0.0 111.147 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -103.7 107.91 18.97 Favored 'General case' 0 C--N 1.351 0.631 0 O-C-N 127.471 2.982 . . . . 0.0 103.761 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.534 HD11 ' HB2' ' A' ' 55' ' ' ASN . 3.9 mp -98.02 158.26 3.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 O-C-N 127.252 2.845 . . . . 0.0 110.699 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.519 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -134.77 144.83 33.65 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 110.188 -3.187 . . . . 0.0 109.005 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.441 HG21 ' NZ ' ' A' ' 53' ' ' LYS . 56.9 t -149.1 78.85 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.33 0 CA-C-N 111.82 -2.446 . . . . 0.0 111.951 -179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' A' ' 3' ' ' LYS . 0.8 OUTLIER -77.75 150.48 34.39 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -166.64 91.18 0.42 Allowed 'General case' 0 CA--C 1.498 -1.036 1 O-C-N 129.42 4.2 . . . . 0.0 111.747 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 54.55 -89.48 0.01 OUTLIER Glycine 0 C--N 1.345 1.066 0 CA-C-O 119.833 -0.426 . . . . 0.0 112.523 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -99.55 -39.71 8.19 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 126.796 2.115 . . . . 0.0 116.458 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -85.84 112.98 21.62 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 126.086 2.116 . . . . 0.0 111.975 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.495 ' CE2' HD22 ' A' ' 94' ' ' LEU . 76.8 t80 -112.8 97.98 6.91 Favored 'General case' 0 C--N 1.316 -0.89 1 O-C-N 129.707 4.379 . . . . 0.0 112.315 -179.915 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -117.21 89.36 3.1 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 119.282 3.068 . . . . 0.0 119.282 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.537 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -76.86 158.42 30.8 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 127.443 2.964 . . . . 0.0 106.691 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.441 ' NZ ' HG21 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -155.31 148.94 25.25 Favored 'General case' 0 CA--C 1.486 -1.482 0 O-C-N 127.654 3.096 . . . . 0.0 109.575 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.2 t -105.4 116.87 32.67 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.652 2.781 . . . . 0.0 107.196 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.534 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -82.31 15.75 2.32 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 117.037 2.236 . . . . 0.0 117.037 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.409 ' O ' ' ND2' ' A' ' 60' ' ' ASN . 0.5 OUTLIER -56.81 155.81 7.35 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 127.356 2.91 . . . . 0.0 109.248 -179.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.419 ' H ' HD11 ' A' ' 37' ' ' LEU . 7.0 p -89.77 -34.2 16.26 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 128.977 3.923 . . . . 0.0 104.01 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.711 ' CD2' HD23 ' A' ' 37' ' ' LEU . 1.3 m-85 -57.97 -65.15 0.69 Allowed 'General case' 0 C--O 1.24 0.562 0 O-C-N 126.922 2.639 . . . . 0.0 111.223 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -151.56 110.2 3.82 Favored 'General case' 0 C--N 1.362 1.151 1 CA-C-N 108.24 -4.073 . . . . 0.0 116.726 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.409 ' ND2' ' O ' ' A' ' 56' ' ' SER . 0.0 OUTLIER -111.64 87.75 2.63 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 127.316 2.885 . . . . 0.0 108.934 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.57 -56.46 4.0 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 128.708 3.755 . . . . 0.0 107.377 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER 89.6 154.35 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.646 1 O-C-N 132.924 6.39 . . . . 0.0 115.697 -179.944 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.603 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 11.6 tp -99.34 47.25 0.96 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 111.536 -2.574 . . . . 0.0 112.376 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.83 94.75 1.44 Allowed 'General case' 0 C--O 1.206 -1.205 0 O-C-N 123.903 0.752 . . . . 0.0 109.054 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.526 ' CD2' HG21 ' A' ' 87' ' ' VAL . 0.5 OUTLIER -127.15 178.54 5.96 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-O 127.116 3.341 . . . . 0.0 108.558 -179.681 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -151.53 143.47 23.84 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 112.583 -2.099 . . . . 0.0 105.44 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.836 HG21 ' NE1' ' A' ' 89' ' ' TRP . 1.6 t -70.07 152.12 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 0 O-C-N 127.223 2.827 . . . . 0.0 114.194 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 47.37 37.49 12.07 Favored Glycine 0 N--CA 1.469 0.883 0 CA-C-N 111.238 -2.71 . . . . 0.0 114.373 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.262 9.9 p -98.16 -14.37 7.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.042 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.478 ' HA ' HD12 ' A' ' 86' ' ' LEU . 1.3 tt0 55.68 74.14 0.39 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 128.665 3.728 . . . . 0.0 110.884 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.579 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 6.4 t80 -64.35 70.63 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.903 1 O-C-N 129.745 4.403 . . . . 0.0 113.67 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -51.83 87.59 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.32 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.505 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 40.11 -160.72 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 O-C-N 126.934 2.646 . . . . 0.0 112.924 179.54 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 91.62 90.98 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.341 -2.209 . . . . 0.0 116.436 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.466 ' C ' ' HG2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -148.01 153.66 39.27 Favored 'General case' 0 C--O 1.201 -1.492 0 CA-C-N 111.251 -2.704 . . . . 0.0 112.0 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.466 ' HG2' ' C ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 178.99 136.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.795 1 O-C-N 129.111 4.007 . . . . 0.0 111.271 -179.887 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.47 7.41 42.74 Favored Glycine 0 C--O 1.204 -1.725 0 CA-C-N 111.232 -2.713 . . . . 0.0 109.993 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.608 ' HA ' HD11 ' A' ' 26' ' ' ILE . 4.0 tp -165.6 36.38 0.06 Allowed 'General case' 0 C--N 1.351 0.648 0 O-C-N 128.439 3.082 . . . . 0.0 116.36 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.465 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 7.6 t0 159.3 -66.54 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.044 2.715 . . . . 0.0 113.189 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.67 78.61 0.82 Allowed Glycine 0 C--O 1.204 -1.719 0 O-C-N 126.097 2.123 . . . . 0.0 110.144 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.27 -146.53 0.15 Allowed 'General case' 0 CA--C 1.494 -1.182 0 O-C-N 129.44 3.671 . . . . 0.0 113.193 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.505 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 15.2 m-20 -163.38 112.91 1.31 Allowed 'General case' 0 C--O 1.202 -1.431 0 CA-C-O 117.471 -1.252 . . . . 0.0 108.934 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.7 HG22 ' HA2' ' A' ' 100' ' ' GLY . 71.1 t -146.95 131.83 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 N-CA-C 117.833 2.531 . . . . 0.0 117.833 -178.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -60.48 115.56 3.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 110.657 -2.974 . . . . 0.0 107.701 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.579 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 40.8 m -122.4 74.31 1.17 Allowed 'General case' 0 C--O 1.198 -1.656 0 O-C-N 127.915 3.26 . . . . 0.0 115.633 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.491 ' HB3' ' CG2' ' A' ' 97' ' ' VAL . 5.3 tp -67.33 143.44 56.38 Favored 'General case' 0 N--CA 1.437 -1.079 2 CA-C-N 106.037 -5.074 . . . . 0.0 108.908 -179.684 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.526 HG21 ' CD2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -123.34 131.09 73.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 O-C-N 126.402 2.314 . . . . 0.0 107.415 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 89' ' ' TRP 0.333 1.7 m -151.3 159.42 44.33 Favored 'General case' 0 CA--C 1.479 -1.782 0 CA-C-N 113.027 -1.897 . . . . 0.0 109.585 -179.562 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.836 ' NE1' HG21 ' A' ' 67' ' ' VAL . 58.8 m95 -87.07 143.66 27.22 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 114.509 -2.662 . . . . 0.0 106.503 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.841 ' HB3' HG22 ' A' ' 93' ' ' THR . 11.0 tp10 -90.28 -35.45 15.27 Favored 'General case' 0 CA--C 1.479 -1.752 1 CA-C-O 133.074 6.178 . . . . 0.0 112.469 179.798 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.18 -41.75 0.27 Allowed Glycine 0 C--O 1.206 -1.602 1 CA-C-N 107.009 -4.632 . . . . 0.0 103.2 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.533 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -155.65 67.64 0.63 Allowed 'General case' 0 C--O 1.197 -1.69 1 O-C-N 131.267 4.745 . . . . 0.0 107.897 -179.787 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.841 HG22 ' HB3' ' A' ' 90' ' ' GLU . 14.6 t 159.18 147.19 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 118.051 2.611 . . . . 0.0 118.051 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.681 HD23 ' NE2' ' A' ' 109' ' ' GLN . 0.7 OUTLIER -85.97 82.66 8.04 Favored 'General case' 0 CA--C 1.495 -1.165 1 O-C-N 132.679 6.237 . . . . 0.0 116.816 179.491 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.538 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.343 54.5 t -84.12 135.71 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 CA-C-O 115.558 -2.163 . . . . 0.0 112.663 179.492 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.11 137.77 29.38 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.491 ' CG2' ' HB3' ' A' ' 86' ' ' LEU . 16.4 m -113.14 118.49 58.19 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.996 1 O-C-N 130.098 4.624 . . . . 0.0 117.15 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.402 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 3.7 mm-40 -94.95 99.02 11.12 Favored 'General case' 0 C--O 1.221 -0.416 0 O-C-N 119.373 -2.079 . . . . 0.0 108.766 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.2 OUTLIER -93.74 77.6 4.26 Favored 'General case' 0 C--O 1.201 -1.47 0 CA-C-N 111.059 -2.791 . . . . 0.0 108.324 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.7 ' HA2' HG22 ' A' ' 83' ' ' VAL . . . -81.65 -117.98 0.46 Allowed Glycine 0 C--O 1.207 -1.573 0 CA-C-N 112.286 -2.234 . . . . 0.0 112.082 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 174.03 94.62 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.984 -2.108 . . . . 0.0 111.731 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? 128.19 -28.62 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 129.159 2.984 . . . . 0.0 111.772 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.35 174.33 10.73 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 110.091 -3.231 . . . . 0.0 116.552 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -125.38 97.36 5.17 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 113.579 -3.105 . . . . 0.0 105.888 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.473 ' HD3' ' HA ' ' A' ' 122' ' ' CYS 0.285 17.9 mmt180 -91.47 6.76 44.28 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 128.844 3.84 . . . . 0.0 113.809 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.402 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -49.0 97.14 0.01 OUTLIER Glycine 0 CA--C 1.533 1.194 2 O-C-N 133.166 6.541 . . . . 0.0 111.48 179.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.603 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.263 0.0 OUTLIER -104.16 137.92 41.4 Favored 'General case' 0 C--N 1.317 -0.815 1 O-C-N 130.97 4.571 . . . . 0.0 108.55 178.541 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.401 ' HA ' HE21 ' A' ' 109' ' ' GLN . 0.0 OUTLIER -152.65 -179.46 7.63 Favored 'General case' 0 C--O 1.204 -1.302 1 O-C-N 131.853 5.721 . . . . 0.0 115.101 -178.047 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.681 ' NE2' HD23 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -139.77 177.37 8.0 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 109.147 -3.661 . . . . 0.0 107.747 -179.835 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.466 ' CD1' ' HB3' ' A' ' 117' ' ' TYR 0.27 0.5 OUTLIER 177.93 100.45 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.642 1 O-C-N 132.694 6.246 . . . . 0.0 115.713 178.637 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.4 t -46.62 96.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.486 -1.491 0 CA-C-O 126.416 3.008 . . . . 0.0 115.63 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.91 96.7 6.41 Favored 'General case' 0 CA--C 1.484 -1.595 0 CA-C-O 125.221 2.439 . . . . 0.0 115.945 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.76 72.78 0.47 Allowed Glycine 0 N--CA 1.439 -1.141 0 CA-C-N 112.049 -2.341 . . . . 0.0 117.101 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 49.48 63.08 2.3 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 126.587 1.992 . . . . 0.0 116.057 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 160.63 148.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.667 1 O-C-N 130.003 4.564 . . . . 0.0 109.419 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.731 HD23 ' CZ2' ' A' ' 9' ' ' TRP . 1.2 mm? -83.19 -174.82 5.51 Favored 'General case' 0 CA--C 1.495 -1.149 0 O-C-N 127.156 2.785 . . . . 0.0 111.679 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.466 ' HB3' ' CD1' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -155.81 69.53 0.67 Allowed 'General case' 0 C--O 1.203 -1.355 0 O-C-N 128.053 3.346 . . . . 0.0 110.751 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.83 87.24 0.06 Allowed 'General case' 0 CA--C 1.505 -0.767 1 CA-C-N 107.512 -4.404 . . . . 0.0 109.022 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -105.78 97.64 7.44 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 125.644 1.84 . . . . 0.0 111.081 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.574 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -102.74 162.66 12.74 Favored 'General case' 0 C--N 1.365 1.24 0 O-C-N 126.645 2.466 . . . . 0.0 108.406 179.568 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.469 ' O ' HD12 ' A' ' 120' ' ' LEU . 0.6 OUTLIER -139.53 160.84 38.91 Favored 'General case' 0 C--O 1.2 -1.518 0 O-C-N 128.372 3.545 . . . . 0.0 105.541 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.473 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -159.11 59.66 0.41 Allowed 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 126.795 3.188 . . . . 0.0 110.185 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.97 -69.97 0.5 Allowed Glycine 0 N--CA 1.435 -1.397 0 CA-C-N 110.282 -3.145 . . . . 0.0 111.075 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -162.45 64.13 0.22 Allowed 'General case' 0 C--O 1.206 -1.228 0 CA-C-N 110.646 -2.777 . . . . 0.0 109.197 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -158.09 36.96 0.25 Allowed 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 111.336 -2.665 . . . . 0.0 105.562 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.519 ' O ' HG13 ' A' ' 126' ' ' VAL . 7.9 p -35.06 111.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 O-C-N 128.847 3.842 . . . . 0.0 113.792 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.6 t -89.71 119.44 30.12 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 119.352 -2.092 . . . . 0.0 107.577 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -106.55 111.46 24.02 Favored 'General case' 0 N--CA 1.477 0.913 1 O-C-N 129.3 4.125 . . . . 0.0 110.678 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -108.76 164.89 11.98 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 126.175 2.172 . . . . 0.0 112.763 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -127.1 157.19 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 N-CA-C 103.24 -2.874 . . . . 0.0 103.24 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -136.22 173.51 11.63 Favored 'General case' 0 CA--C 1.477 -1.863 0 CA-C-N 108.712 -3.858 . . . . 0.0 117.84 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.321 0.5 OUTLIER -162.17 97.02 1.01 Allowed 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 110.575 -3.011 . . . . 0.0 103.827 -179.621 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.52 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 12.2 pttt -33.39 -44.42 0.14 Allowed 'General case' 0 C--O 1.198 -1.607 1 O-C-N 131.168 5.293 . . . . 0.0 117.521 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.447 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 30.0 ttmt . . . . . 0 CA--C 1.481 -1.698 0 CA-C-O 114.745 -2.55 . . . . 0.0 111.817 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.536 ' HB2' ' CH2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.508 -0.669 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -63.07 104.35 0.56 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 103.443 -2.799 . . . . 0.0 103.443 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -138.4 -177.59 4.92 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 111.684 -2.507 . . . . 0.0 104.96 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -178.54 145.72 0.33 Allowed 'General case' 0 C--O 1.22 -0.482 1 O-C-N 129.499 4.249 . . . . 0.0 111.554 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -176.23 -151.56 8.92 Favored Glycine 0 C--O 1.201 -1.923 0 CA-C-O 115.652 -2.749 . . . . 0.0 115.066 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 ' HD2' ' A' ' 134' ' ' LYS . 5.5 t -167.05 42.73 0.05 OUTLIER 'General case' 0 C--O 1.204 -1.32 1 O-C-N 134.444 6.614 . . . . 0.0 107.791 179.727 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.539 ' CZ2' HD12 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -34.42 136.74 0.13 Allowed 'General case' 0 C--O 1.242 0.673 1 O-C-N 132.073 5.858 . . . . 0.0 112.024 179.926 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.494 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.4 mt-10 -103.84 53.36 0.75 Allowed 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 117.715 -1.594 . . . . 0.0 110.934 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.421 ' O ' ' N ' ' A' ' 13' ' ' SER . 15.8 ttp -4.92 67.28 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 O-C-N 128.978 3.924 . . . . 0.0 108.957 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.494 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.6 tt0 -12.82 -45.09 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.803 1 O-C-N 133.182 6.551 . . . . 0.0 112.427 -178.518 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 11' ' ' MET . 1.2 t -173.7 161.69 3.95 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 109.524 -3.489 . . . . 0.0 109.886 -179.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -116.08 156.61 26.09 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 109.686 -3.416 . . . . 0.0 112.735 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -117.77 -56.66 2.18 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 127.067 2.729 . . . . 0.0 110.609 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -116.68 113.41 22.6 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 119.8 -1.812 . . . . 0.0 107.822 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . 0.296 25.0 t80 -115.29 -47.41 2.85 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 127.659 3.6 . . . . 0.0 112.524 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -76.38 -48.75 18.78 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 110.969 -2.832 . . . . 0.0 114.274 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -53.4 -21.84 14.09 Favored Glycine 0 CA--C 1.484 -1.869 0 O-C-N 124.982 1.426 . . . . 0.0 113.465 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.512 ' N ' HE21 ' A' ' 125' ' ' GLN . 0.1 OUTLIER -69.14 -48.0 63.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.206 -1.775 . . . . 0.0 106.206 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.462 ' O ' HG22 ' A' ' 26' ' ' ILE . 1.7 mtm -70.42 -32.28 69.82 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 111.807 -2.451 . . . . 0.0 112.472 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.68 -23.39 56.21 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 128.569 2.748 . . . . 0.0 114.998 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.0 -32.13 50.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 110.226 -3.17 . . . . 0.0 108.804 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.49 HD13 ' HB2' ' A' ' 79' ' ' ASP 0.291 3.3 mt -74.03 -23.99 59.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 111.229 -2.714 . . . . 0.0 104.464 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 t70 63.24 58.86 1.35 Allowed 'General case' 0 C--O 1.216 -0.705 1 CA-C-O 128.514 4.006 . . . . 0.0 106.416 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.608 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 1.3 tt -71.72 -47.44 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.983 1 CA-C-N 106.73 -4.759 . . . . 0.0 110.594 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 178.59 123.25 0.05 OUTLIER 'General case' 0 C--N 1.361 1.102 0 CA-C-N 113.981 -1.463 . . . . 0.0 109.231 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.449 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 93.1 m-85 -72.65 121.71 20.23 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 117.093 -1.843 . . . . 0.0 114.512 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 78.93 51.65 0.03 OUTLIER 'General case' 0 C--O 1.209 -1.054 0 C-N-CA 126.995 2.118 . . . . 0.0 110.527 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.423 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.4 OUTLIER -87.67 -52.64 5.21 Favored 'General case' 0 C--N 1.355 0.848 2 O-C-N 130.018 4.574 . . . . 0.0 112.001 -179.921 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.535 ' HD3' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.25 -138.42 0.01 OUTLIER 'General case' 0 C--O 1.244 0.777 0 CA-C-O 112.437 -3.649 . . . . 0.0 111.92 -179.734 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.535 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER 98.18 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 O-C-N 128.633 3.708 . . . . 0.0 111.071 -179.864 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.694 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -117.44 8.42 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 1 O-C-N 131.057 5.223 . . . . 0.0 110.383 -179.787 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -116.28 22.04 13.17 Favored 'General case' 0 C--N 1.346 0.429 0 O-C-N 124.735 1.272 . . . . 0.0 107.779 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.4 t -49.77 -36.37 11.15 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.344 0 CA-C-O 123.881 1.801 . . . . 0.0 111.483 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.58 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.5 OUTLIER 171.36 128.7 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.828 1 CA-C-N 108.22 -4.082 . . . . 0.0 110.858 179.837 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 37' ' ' LEU . 1.4 mt -97.74 -50.24 4.53 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 129.038 3.961 . . . . 0.0 104.049 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.3 m -170.23 142.96 2.31 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.727 5.642 . . . . 0.0 112.008 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.533 ' HG2' ' N ' ' A' ' 40' ' ' THR . 0.1 OUTLIER -125.03 150.43 46.76 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 126.074 2.109 . . . . 0.0 114.853 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.533 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 66.2 m 178.23 109.11 0.03 OUTLIER 'General case' 0 N--CA 1.433 -1.287 1 O-C-N 129.478 4.237 . . . . 0.0 111.904 178.815 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.89 152.56 19.63 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 127.928 3.267 . . . . 0.0 105.272 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 43' ' ' ILE . 5.1 mp -137.48 157.81 34.3 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.369 0 C-N-CA 117.635 -1.626 . . . . 0.0 110.467 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.552 HG12 ' CE1' ' A' ' 50' ' ' PHE 0.251 3.4 tt -136.43 125.71 38.14 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 2 O-C-N 131.646 5.591 . . . . 0.0 109.07 -179.685 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 59.7 t -124.94 102.97 11.61 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 CA-C-N 111.837 -2.438 . . . . 0.0 111.988 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.593 ' HG3' ' CD1' ' A' ' 50' ' ' PHE . 9.6 mt-30 -121.83 89.47 3.13 Favored 'General case' 0 CA--C 1.488 -1.429 0 CA-C-O 125.137 2.399 . . . . 0.0 114.743 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -78.64 -8.41 58.63 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-N 108.788 -3.824 . . . . 0.0 113.006 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.51 -106.8 0.25 Allowed Glycine 0 C--O 1.203 -1.841 0 CA-C-O 123.504 1.613 . . . . 0.0 113.741 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.559 ' O ' HG23 ' A' ' 67' ' ' VAL . 2.0 m-20 -98.62 -1.19 41.47 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 112.728 -1.736 . . . . 0.0 113.059 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.88 90.25 3.3 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 127.793 3.183 . . . . 0.0 108.907 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.593 ' CD1' ' HG3' ' A' ' 45' ' ' GLN . 6.4 t80 -96.44 103.66 15.58 Favored 'General case' 0 CA--C 1.496 -1.108 0 O-C-N 128.278 3.486 . . . . 0.0 113.305 -179.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.0 73.25 1.01 Allowed 'General case' 0 CA--C 1.496 -1.124 0 O-C-N 128.169 3.418 . . . . 0.0 118.202 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.633 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -52.28 165.55 0.23 Allowed 'General case' 0 C--N 1.358 0.95 0 CA-C-N 112.221 -2.263 . . . . 0.0 108.87 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.511 ' N ' HG23 ' A' ' 52' ' ' THR . 0.0 OUTLIER -170.91 153.31 3.84 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 114.843 -2.743 . . . . 0.0 106.653 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.406 HG22 ' HA ' ' A' ' 60' ' ' ASN . 0.7 OUTLIER -108.11 152.34 24.66 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 127.382 2.927 . . . . 0.0 107.847 178.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -104.84 10.44 34.44 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 125.562 1.789 . . . . 0.0 115.258 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.533 ' HB3' ' CD1' ' A' ' 58' ' ' PHE . 54.4 m -44.35 152.2 0.21 Allowed 'General case' 0 N--CA 1.477 0.924 1 O-C-N 129.199 4.062 . . . . 0.0 105.513 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.552 HG23 HD12 ' A' ' 37' ' ' LEU 0.266 7.3 t -83.51 -35.24 25.0 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-N 111.752 -2.476 . . . . 0.0 110.719 -179.049 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.651 ' CE2' HD21 ' A' ' 37' ' ' LEU 0.251 0.0 OUTLIER -60.2 -38.34 83.02 Favored 'General case' 0 C--N 1.366 1.301 0 O-C-N 126.811 2.57 . . . . 0.0 111.524 -179.475 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 168.57 162.43 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.516 1 O-C-N 130.723 5.014 . . . . 0.0 112.05 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.406 ' HA ' HG22 ' A' ' 54' ' ' THR . 1.1 m120 -113.38 127.65 56.2 Favored 'General case' 0 C--O 1.209 -1.074 1 O-C-N 130.366 4.791 . . . . 0.0 107.903 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -106.38 28.42 7.79 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 126.331 2.269 . . . . 0.0 108.39 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -13.62 112.52 0.02 OUTLIER 'General case' 0 C--O 1.205 -1.257 1 O-C-N 130.287 4.742 . . . . 0.0 117.502 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.832 HD21 ' CZ ' ' A' ' 65' ' ' PHE . 9.9 tt -68.16 121.82 16.99 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 127.503 3.002 . . . . 0.0 108.796 177.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -141.02 83.08 1.87 Allowed 'General case' 0 CA--C 1.485 -1.549 0 C-N-CA 113.956 -3.098 . . . . 0.0 112.237 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.947 ' CD1' HG21 ' A' ' 87' ' ' VAL . 5.3 p90 -142.49 167.42 22.14 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 126.076 2.846 . . . . 0.0 110.926 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -119.88 157.3 29.02 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 112.647 -2.069 . . . . 0.0 108.115 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 48' ' ' ASP . 1.9 t -51.67 141.74 4.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.119 0 O-C-N 127.027 2.705 . . . . 0.0 115.085 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 23.37 47.55 0.01 OUTLIER Glycine 0 CA--C 1.5 -0.875 1 O-C-N 131.501 5.5 . . . . 0.0 117.857 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -97.84 0.12 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 59.03 73.59 0.48 Allowed 'General case' 0 C--N 1.357 0.892 0 O-C-N 128.947 3.904 . . . . 0.0 109.254 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.46 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 5.3 t80 -67.59 138.14 56.21 Favored 'General case' 0 N--CA 1.451 -0.405 2 O-C-N 129.602 4.314 . . . . 0.0 116.652 -179.801 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -112.79 93.63 4.52 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 113.171 -1.832 . . . . 0.0 110.62 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -72.39 154.21 41.02 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-O 126.517 3.056 . . . . 0.0 109.796 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -131.78 74.15 1.57 Allowed 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 108.984 -3.735 . . . . 0.0 109.764 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 70.3 p -49.85 -79.49 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 114.265 -2.779 . . . . 0.0 116.19 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 13.0 97.32 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.816 1 O-C-N 129.656 4.347 . . . . 0.0 115.782 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 142.01 -29.14 2.22 Favored Glycine 0 C--O 1.213 -1.212 0 CA-C-N 110.345 -3.116 . . . . 0.0 107.666 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.608 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 12.6 tp -141.13 50.01 1.63 Allowed 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 108.481 -3.86 . . . . 0.0 115.395 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.498 ' N ' HD12 ' A' ' 26' ' ' ILE . 5.6 t70 151.73 -67.78 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.893 1.996 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.03 65.28 1.18 Allowed Glycine 0 C--O 1.229 -0.217 0 O-C-N 126.235 2.21 . . . . 0.0 112.818 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.46 ' CG ' ' N ' ' A' ' 82' ' ' ASN 0.267 3.3 tpt180 -139.97 -122.05 0.12 Allowed 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 113.836 -2.983 . . . . 0.0 112.936 -179.721 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.46 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER 156.15 101.81 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 O-C-N 128.299 3.499 . . . . 0.0 108.665 -179.275 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.771 HG13 ' HA2' ' A' ' 100' ' ' GLY . 1.9 t -134.33 165.18 32.29 Favored 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 127.043 2.714 . . . . 0.0 117.684 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.48 ' N ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -75.24 163.88 27.05 Favored 'General case' 0 C--O 1.218 -0.56 2 O-C-N 133.426 6.704 . . . . 0.0 107.503 179.19 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.46 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.1 m -168.76 98.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.983 1 O-C-N 130.799 5.062 . . . . 0.0 110.152 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.06 93.55 7.44 Favored 'General case' 0 C--O 1.209 -1.043 2 O-C-N 130.911 5.132 . . . . 0.0 116.626 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.947 HG21 ' CD1' ' A' ' 65' ' ' PHE . 26.1 t -68.4 131.66 33.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.197 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -157.95 160.77 37.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 124.188 1.947 . . . . 0.0 111.711 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.741 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 70.3 m95 -88.8 142.5 27.61 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 114.649 -2.596 . . . . 0.0 106.708 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.871 ' HB2' HG23 ' A' ' 93' ' ' THR . 0.0 OUTLIER -92.76 -60.37 1.83 Allowed 'General case' 0 CA--C 1.48 -1.718 1 CA-C-O 132.477 5.894 . . . . 0.0 113.456 179.552 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.02 61.72 0.03 OUTLIER Glycine 0 CA--C 1.542 1.778 1 CA-C-N 107.84 -4.255 . . . . 0.0 104.428 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.1 m120 92.39 66.08 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.038 1 O-C-N 132.388 5.405 . . . . 0.0 105.701 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.871 HG23 ' HB2' ' A' ' 90' ' ' GLU . 1.9 t 166.21 141.95 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 50' ' ' PHE . 4.8 tp -86.05 106.5 17.25 Favored 'General case' 0 CA--C 1.487 -1.458 1 O-C-N 131.239 5.337 . . . . 0.0 114.161 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.735 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.376 40.8 t -109.87 148.68 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.014 0 CA-C-N 109.385 -3.552 . . . . 0.0 114.418 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.22 133.07 17.0 Favored 'General case' 0 C--O 1.219 -0.532 0 O-C-N 125.739 1.899 . . . . 0.0 106.544 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.8 t -103.11 73.46 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.598 0 CA-C-N 110.133 -3.212 . . . . 0.0 115.256 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.575 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -53.36 101.4 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 122.383 1.087 . . . . 0.0 109.084 179.664 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -95.98 98.23 10.22 Favored 'General case' 0 C--O 1.205 -1.254 0 CA-C-N 109.315 -3.584 . . . . 0.0 112.358 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.771 ' HA2' HG13 ' A' ' 83' ' ' VAL . . . -94.19 -136.72 8.32 Favored Glycine 0 C--O 1.212 -1.239 0 O-C-N 127.94 3.275 . . . . 0.0 111.063 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -154.66 -47.39 0.09 Allowed 'General case' 0 CA--C 1.502 -0.891 1 CA-C-N 107.695 -4.252 . . . . 0.0 109.631 179.675 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.433 ' C ' ' HD3' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -101.86 3.6 39.4 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 123.408 1.575 . . . . 0.0 115.033 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.78 174.62 13.64 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 110.222 -3.172 . . . . 0.0 117.307 -179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.2 96.59 5.15 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 108.838 -3.801 . . . . 0.0 101.637 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.418 ' HB3' ' CD ' ' A' ' 98' ' ' GLN . 12.2 mmm-85 -87.68 -2.41 58.59 Favored 'General case' 0 C--O 1.208 -1.122 1 O-C-N 129.506 4.254 . . . . 0.0 111.593 -179.693 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.575 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.66 95.52 0.01 OUTLIER Glycine 0 C--O 1.208 -1.501 2 O-C-N 133.719 6.887 . . . . 0.0 115.551 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.517 ' CD1' ' C ' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -110.46 137.69 47.83 Favored 'General case' 0 C--N 1.319 -0.754 1 O-C-N 130.997 4.586 . . . . 0.0 108.242 178.04 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -163.19 177.84 8.72 Favored 'General case' 0 CA--C 1.506 -0.717 1 O-C-N 130.454 4.846 . . . . 0.0 111.403 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.532 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 1.1 mp0 -139.71 -174.33 3.87 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 113.849 -2.977 . . . . 0.0 108.133 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.431 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.2 OUTLIER 179.4 89.17 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.235 1 O-C-N 130.377 4.798 . . . . 0.0 117.683 178.961 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . 0.25 70.3 t -34.71 104.57 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-O 125.051 2.358 . . . . 0.0 112.187 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.526 ' HG2' ' CD2' ' A' ' 117' ' ' TYR . 0.7 OUTLIER -107.29 28.87 7.66 Favored 'General case' 0 CA--C 1.478 -1.811 0 CA-C-N 111.534 -2.575 . . . . 0.0 117.81 -179.633 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.42 95.36 0.84 Allowed Glycine 0 C--O 1.21 -1.392 0 O-C-N 119.576 -1.952 . . . . 0.0 117.944 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 61.83 35.03 16.77 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 165.19 154.91 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.153 1 O-C-N 130.729 5.018 . . . . 0.0 110.015 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.539 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 1.1 mt -91.69 -172.75 3.32 Favored 'General case' 0 CA--C 1.484 -1.575 0 O-C-N 127.378 2.924 . . . . 0.0 112.399 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.526 ' CD2' ' HG2' ' A' ' 112' ' ' GLU . 0.0 OUTLIER -150.46 83.86 1.36 Allowed 'General case' 0 C--N 1.362 1.142 0 CA-C-N 111.659 -2.519 . . . . 0.0 113.182 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.479 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -73.33 88.14 1.54 Allowed 'General case' 0 N--CA 1.475 0.778 2 CA-C-N 107.989 -4.187 . . . . 0.0 109.562 -179.894 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -100.47 102.34 13.5 Favored 'General case' 0 CA--C 1.499 -0.985 0 O-C-N 128.863 3.852 . . . . 0.0 109.803 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.516 HD11 ' SG ' ' A' ' 122' ' ' CYS . 0.2 OUTLIER -121.52 155.27 35.33 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 128.136 3.397 . . . . 0.0 109.347 -179.847 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.1 t -133.59 154.76 50.63 Favored 'General case' 0 C--N 1.311 -1.103 1 O-C-N 129.56 4.288 . . . . 0.0 104.759 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.516 ' SG ' HD11 ' A' ' 120' ' ' LEU 0.273 2.8 m -139.43 39.78 2.06 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.887 1.327 . . . . 0.0 110.962 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 132.93 -57.51 0.71 Allowed Glycine 0 CA--C 1.526 0.781 0 CA-C-N 111.696 -2.502 . . . . 0.0 108.526 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -172.77 49.64 0.02 OUTLIER 'General case' 0 CA--C 1.491 -1.294 0 CA-C-N 109.845 -3.177 . . . . 0.0 106.955 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.512 HE21 ' N ' ' A' ' 20' ' ' TYR . 1.4 tm0? -103.38 -22.93 13.6 Favored 'General case' 0 C--O 1.208 -1.122 0 C-N-CA 116.666 -2.014 . . . . 0.0 110.369 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.511 ' O ' HG13 ' A' ' 126' ' ' VAL . 11.8 p 27.1 63.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 CA-C-O 125.297 2.475 . . . . 0.0 117.11 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.412 ' N ' ' O ' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -57.71 149.29 22.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 118.923 -2.361 . . . . 0.0 108.191 -179.691 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -135.09 87.71 2.36 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 128.181 3.426 . . . . 0.0 111.002 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -83.02 164.52 20.3 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.42 139.45 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 123.963 1.839 . . . . 0.0 106.078 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.479 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 39.6 m-85 -123.02 179.66 4.59 Favored 'General case' 0 CA--C 1.492 -1.263 0 CA-C-O 126.716 3.15 . . . . 0.0 117.42 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.415 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.297 0.0 OUTLIER -165.76 122.41 1.39 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 109.903 -3.317 . . . . 0.0 104.473 -179.936 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.492 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 19.7 ttpt -71.6 57.35 0.28 Allowed 'General case' 0 C--O 1.202 -1.445 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.518 ' HD2' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.796 0 N-CA-C 117.976 2.584 . . . . 0.0 117.976 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.462 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 17.0 mttt . . . . . 0 N--CA 1.446 -0.664 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.71 104.53 5.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 104.006 -2.59 . . . . 0.0 104.006 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . 0.262 7.7 mt-30 -139.39 145.75 39.33 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 103.616 -2.735 . . . . 0.0 103.616 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 156.7 126.16 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.919 1 O-C-N 131.571 5.545 . . . . 0.0 112.108 179.944 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 150.48 -169.91 30.39 Favored Glycine 0 C--O 1.2 -1.97 0 O-C-N 127.054 2.721 . . . . 0.0 110.224 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.553 HG23 HG23 ' A' ' 40' ' ' THR . 0.9 OUTLIER -129.57 145.08 51.51 Favored 'General case' 0 C--N 1.318 -0.8 1 O-C-N 131.963 5.155 . . . . 0.0 107.664 -179.962 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.573 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -138.04 109.2 6.82 Favored 'General case' 0 CA--C 1.498 -1.028 1 O-C-N 131.199 5.312 . . . . 0.0 112.177 -179.773 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -56.02 -15.25 3.28 Favored 'General case' 0 C--N 1.316 -0.863 0 O-C-N 126.828 2.58 . . . . 0.0 115.415 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.9 ttp 59.02 81.49 0.16 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -35.27 -43.95 0.25 Allowed 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 128.879 3.862 . . . . 0.0 110.993 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.268 4.8 p -157.97 162.76 38.23 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 112.046 -2.343 . . . . 0.0 111.535 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -132.3 124.8 29.56 Favored 'General case' 0 CA--C 1.482 -1.664 1 CA-C-N 107.898 -4.228 . . . . 0.0 112.223 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.33 -149.42 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 128.173 3.42 . . . . 0.0 107.65 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -44.61 139.47 2.86 Favored 'General case' 0 C--O 1.2 -1.514 0 CA-C-N 119.551 1.069 . . . . 0.0 112.815 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -126.75 -44.27 1.67 Allowed 'General case' 0 C--O 1.197 -1.669 0 CA-C-O 125.695 2.664 . . . . 0.0 111.648 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.66 -22.17 47.2 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-N 111.348 -2.66 . . . . 0.0 115.542 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.81 -31.03 62.84 Favored Glycine 0 N--CA 1.474 1.21 0 O-C-N 128.129 3.393 . . . . 0.0 108.29 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.424 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -70.12 -34.32 72.95 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-O 124.7 2.191 . . . . 0.0 108.958 -179.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.596 ' O ' HG22 ' A' ' 26' ' ' ILE . 2.1 mtm -73.16 -24.09 60.52 Favored 'General case' 0 CA--C 1.484 -1.568 0 C-N-CA 114.749 -2.78 . . . . 0.0 113.765 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -78.33 -24.33 46.61 Favored 'General case' 0 CA--C 1.538 0.512 1 O-C-N 132.184 5.928 . . . . 0.0 110.585 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.38 -32.18 73.69 Favored 'General case' 0 C--O 1.202 -1.406 1 O-C-N 130.664 4.978 . . . . 0.0 112.857 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.424 HD23 ' O ' ' A' ' 20' ' ' TYR . 0.7 OUTLIER -118.56 19.93 13.13 Favored 'General case' 0 N--CA 1.472 0.634 1 O-C-N 129.411 4.194 . . . . 0.0 107.42 179.648 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.35 -64.03 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 128.37 3.544 . . . . 0.0 112.675 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.596 HG22 ' O ' ' A' ' 21' ' ' MET . 8.3 tt 36.65 34.42 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.828 1 CA-C-O 129.095 4.283 . . . . 0.0 113.768 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.88 175.08 0.13 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 109.415 -3.539 . . . . 0.0 111.786 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.439 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.9 m-85 -112.65 168.78 9.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 113.703 -1.589 . . . . 0.0 113.476 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 83.71 103.37 0.05 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.442 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.8 OUTLIER 176.81 -45.63 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.394 2.934 . . . . 0.0 112.625 -179.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 30' ' ' THR . 0.0 OUTLIER -53.25 -9.37 0.16 Allowed 'General case' 0 CA--C 1.497 -1.074 0 C-N-CA 129.698 3.199 . . . . 0.0 114.458 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -31.47 27.36 Favored 'General case' 0 CA--C 1.482 -1.668 0 C-N-CA 117.212 -1.795 . . . . 0.0 114.365 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.714 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -135.11 15.26 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.913 1 O-C-N 129.45 4.219 . . . . 0.0 114.877 -179.925 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -114.94 12.47 16.82 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 118.919 -1.113 . . . . 0.0 112.469 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.4 t -52.7 -39.18 29.58 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.527 0 CA-C-O 122.888 1.328 . . . . 0.0 111.983 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.723 ' C ' HD23 ' A' ' 37' ' ' LEU . 1.0 OUTLIER 173.93 131.74 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 108.493 -3.958 . . . . 0.0 111.178 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.819 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -101.68 -60.56 1.51 Allowed 'General case' 0 N--CA 1.435 -1.194 1 O-C-N 129.676 4.36 . . . . 0.0 105.798 -179.523 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.52 ' O ' HG22 ' A' ' 38' ' ' THR . 22.1 m -153.23 36.63 0.47 Allowed 'General case' 0 CA--C 1.489 -1.399 1 O-C-N 131.102 5.251 . . . . 0.0 112.032 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.442 ' HB3' ' HD3' ' A' ' 36' ' ' ARG . 6.7 tt0 -63.59 118.22 7.9 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 116.355 1.983 . . . . 0.0 116.355 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.553 HG23 HG23 ' A' ' 8' ' ' THR . 1.4 m -121.99 132.61 54.62 Favored 'General case' 0 C--O 1.204 -1.306 1 O-C-N 129.246 4.091 . . . . 0.0 110.183 179.312 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -107.87 141.4 39.52 Favored 'General case' 0 N--CA 1.475 0.811 1 O-C-N 129.372 4.17 . . . . 0.0 107.497 -179.84 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.659 HD13 ' CD ' ' A' ' 53' ' ' LYS . 2.9 mp -132.46 155.44 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 O-C-N 126.788 2.555 . . . . 0.0 110.776 179.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.515 ' N ' HG22 ' A' ' 42' ' ' ILE . 13.4 tt -132.94 129.02 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.543 0 CA-C-O 126.139 2.876 . . . . 0.0 109.46 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.427 ' O ' HG12 ' A' ' 44' ' ' VAL . 3.0 t -124.56 48.46 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.372 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -55.97 108.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.563 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -123.64 14.29 9.42 Favored 'General case' 0 CA--C 1.476 -1.877 1 O-C-N 129.532 4.27 . . . . 0.0 117.751 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.32 103.28 2.71 Favored Glycine 0 C--O 1.214 -1.156 0 C-N-CA 119.282 -1.437 . . . . 0.0 112.153 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 73.09 -65.47 0.35 Allowed 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 127.821 2.719 . . . . 0.0 112.072 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -96.81 86.72 4.11 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 129.054 3.971 . . . . 0.0 109.818 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.526 ' CD2' HD13 ' A' ' 94' ' ' LEU . 1.7 t80 -98.1 109.91 22.59 Favored 'General case' 0 N--CA 1.475 0.8 1 O-C-N 130.39 4.806 . . . . 0.0 110.999 -179.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -120.25 99.46 6.6 Favored 'General case' 0 CA--C 1.487 -1.477 1 O-C-N 129.885 4.49 . . . . 0.0 119.933 -179.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.539 HG22 ' CB ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -72.71 173.62 8.78 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 126.921 2.638 . . . . 0.0 106.506 178.224 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.659 ' CD ' HD13 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -172.53 145.64 1.62 Allowed 'General case' 0 CA--C 1.488 -1.423 0 C-N-CA 115.975 -2.29 . . . . 0.0 111.515 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.3 t -98.13 126.82 43.75 Favored 'General case' 0 CA--C 1.496 -1.104 0 O-C-N 128.209 3.443 . . . . 0.0 109.68 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -96.76 35.11 1.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.407 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 0.9 OUTLIER -79.88 110.11 14.94 Favored 'General case' 0 N--CA 1.473 0.687 1 O-C-N 130.187 4.68 . . . . 0.0 105.176 179.642 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.47 -36.97 46.58 Favored 'General case' 0 C--O 1.209 -1.027 1 O-C-N 129.759 4.412 . . . . 0.0 108.407 -179.638 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.515 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 1.2 p90 -74.63 -23.83 58.75 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -173.77 100.76 0.11 Allowed 'General case' 0 C--O 1.21 -0.993 1 O-C-N 131.417 5.448 . . . . 0.0 116.389 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -107.52 89.79 3.1 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 108.802 -3.817 . . . . 0.0 105.718 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -77.36 -29.08 53.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.37 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 t0 69.16 131.5 0.03 OUTLIER 'General case' 0 CA--C 1.499 -0.993 0 O-C-N 127.435 2.959 . . . . 0.0 112.902 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.539 ' CB ' HG22 ' A' ' 52' ' ' THR . 3.9 tp -100.32 58.93 0.98 Allowed 'General case' 0 C--O 1.214 -0.805 0 O-C-N 125.102 1.501 . . . . 0.0 109.868 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -99.43 98.66 9.55 Favored 'General case' 0 C--O 1.203 -1.388 0 O-C-N 126.911 2.632 . . . . 0.0 112.89 -178.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.527 ' CE2' ' CZ2' ' A' ' 107' ' ' TRP . 6.8 p90 -132.73 -179.16 5.29 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 124.031 1.872 . . . . 0.0 106.396 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.761 HG22 HG23 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -129.87 155.72 45.54 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 104.165 -2.532 . . . . 0.0 104.165 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 p -78.77 135.12 26.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.072 0 O-C-N 126.775 2.547 . . . . 0.0 114.344 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 23.59 75.97 Favored Glycine 0 N--CA 1.488 2.129 0 C-N-CA 116.372 -2.823 . . . . 0.0 116.103 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.761 HG23 HG22 ' A' ' 66' ' ' THR . 3.0 t -73.28 -25.16 21.11 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.89 74.59 0.4 Allowed 'General case' 0 C--N 1.364 1.203 1 O-C-N 130.458 4.848 . . . . 0.0 109.509 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.449 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 4.4 m-85 -43.83 147.47 0.46 Allowed 'General case' 0 CA--C 1.503 -0.865 0 O-C-N 128.277 3.485 . . . . 0.0 118.324 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -107.63 56.31 0.64 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 115.995 -1.955 . . . . 0.0 112.491 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.604 ' CB ' ' CA ' ' A' ' 83' ' ' VAL . 0.6 OUTLIER 19.16 84.47 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.813 1 CA-C-O 129.267 4.365 . . . . 0.0 114.544 179.765 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.415 ' H ' ' HB2' ' A' ' 82' ' ' ASN . 47.1 t60 -169.7 125.69 0.85 Allowed 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 109.518 -3.492 . . . . 0.0 118.057 178.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.594 ' HB ' ' ND2' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -161.64 168.82 22.73 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.143 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.46 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -152.91 161.89 41.98 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 125.652 2.644 . . . . 0.0 114.514 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.83 -7.1 82.33 Favored Glycine 0 C--O 1.217 -0.91 0 CA-C-N 111.155 -2.748 . . . . 0.0 113.475 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.627 HD23 HH22 ' A' ' 105' ' ' ARG . 2.8 tp -123.67 -63.88 1.19 Allowed 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -118.78 -58.15 1.98 Allowed 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 113.762 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.58 64.26 0.59 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 127.715 2.578 . . . . 0.0 110.949 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ttm105 151.64 146.38 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 O-C-N 128.556 3.151 . . . . 0.0 109.142 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.594 ' ND2' ' HB ' ' A' ' 75' ' ' THR . 1.1 t-20 -132.45 5.89 4.08 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.676 -178.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.604 ' CA ' ' CB ' ' A' ' 73' ' ' GLU 0.32 16.2 t 49.49 178.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 1 O-C-N 130.199 4.687 . . . . 0.0 116.177 -178.936 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.587 ' N ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -76.85 82.2 3.43 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 124.193 1.949 . . . . 0.0 106.71 177.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.494 HG23 ' SG ' ' A' ' 96' ' ' CYS . 83.6 m -93.09 69.14 4.41 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 109.305 -3.589 . . . . 0.0 117.209 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 3.9 tt -63.6 150.89 43.1 Favored 'General case' 0 N--CA 1.432 -1.366 2 CA-C-N 106.631 -4.804 . . . . 0.0 110.338 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.7 t -130.58 143.02 42.19 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.108 0 C-N-CA 124.374 1.07 . . . . 0.0 109.308 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.1 173.47 14.3 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-O 125.854 2.74 . . . . 0.0 111.848 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.706 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 60.1 m95 -92.78 154.02 18.54 Favored 'General case' 0 CA--C 1.508 -0.672 0 C-N-CA 128.537 2.735 . . . . 0.0 106.473 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.51 ' HG3' ' CG2' ' A' ' 95' ' ' VAL . 0.3 OUTLIER -111.13 -52.23 2.8 Favored 'General case' 0 CA--C 1.485 -1.533 1 CA-C-O 129.735 4.588 . . . . 0.0 115.976 179.588 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 156.91 84.82 0.05 OUTLIER Glycine 0 C--O 1.196 -2.248 2 N-CA-C 101.829 -4.508 . . . . 0.0 101.829 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.4 p30 67.37 46.15 1.48 Allowed 'General case' 0 C--O 1.216 -0.67 1 O-C-N 136.371 7.748 . . . . 0.0 110.211 -179.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.459 HG23 ' N ' ' A' ' 94' ' ' LEU . 0.5 OUTLIER -179.19 157.36 0.82 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 179.379 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.526 HD13 ' CD2' ' A' ' 50' ' ' PHE . 1.6 tp -87.68 136.57 32.9 Favored 'General case' 0 CA--C 1.477 -1.863 1 O-C-N 130.898 5.124 . . . . 0.0 114.044 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.51 ' CG2' ' HG3' ' A' ' 90' ' ' GLU 0.361 54.8 t -144.64 134.49 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.114 0 CA-C-N 112.387 -2.188 . . . . 0.0 116.737 179.738 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.494 ' SG ' HG23 ' A' ' 85' ' ' THR . 0.0 OUTLIER -136.67 148.94 47.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.844 2.59 . . . . 0.0 104.394 179.622 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.3 t -125.93 83.23 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.937 0 N-CA-C 118.224 2.675 . . . . 0.0 118.224 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.434 ' HG3' ' C ' ' A' ' 105' ' ' ARG . 2.6 mt-30 -58.3 105.17 0.26 Allowed 'General case' 0 C--N 1.359 0.987 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -139.08 86.83 2.16 Favored 'General case' 0 C--O 1.203 -1.392 0 O-C-N 128.775 3.797 . . . . 0.0 114.669 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 83' ' ' VAL . . . -149.7 -66.63 0.01 OUTLIER Glycine 0 C--N 1.342 0.892 0 CA-C-O 125.827 2.904 . . . . 0.0 109.367 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.81 169.8 9.61 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 108.682 -3.759 . . . . 0.0 112.222 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.43 -63.84 0.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 127.551 3.032 . . . . 0.0 114.868 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -59.7 145.56 44.52 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 111.21 -2.723 . . . . 0.0 117.714 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -111.24 87.74 2.62 Favored 'General case' 0 N--CA 1.49 1.56 1 CA-C-N 107.869 -4.241 . . . . 0.0 101.756 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.627 HH22 HD23 ' A' ' 78' ' ' LEU . 1.3 mmm180 -104.91 3.72 31.15 Favored 'General case' 0 C--O 1.199 -1.591 1 O-C-N 132.227 5.955 . . . . 0.0 113.198 -179.117 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -55.13 107.91 0.86 Allowed Glycine 0 N--CA 1.426 -2.002 2 CA-C-N 106.192 -5.004 . . . . 0.0 114.896 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.527 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE 0.262 0.0 OUTLIER -96.56 148.55 22.72 Favored 'General case' 0 C--O 1.207 -1.172 0 O-C-N 128.266 2.98 . . . . 0.0 110.38 179.344 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.453 ' N ' ' CD1' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -163.51 176.91 9.28 Favored 'General case' 0 C--O 1.2 -1.509 1 O-C-N 129.106 4.004 . . . . 0.0 113.423 -178.82 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.516 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -147.2 175.6 10.62 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.845 -2.434 . . . . 0.0 108.95 -179.48 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.462 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.1 OUTLIER -172.28 39.5 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.01 1 O-C-N 129.172 4.045 . . . . 0.0 117.816 179.863 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.401 HG22 HD12 ' A' ' 116' ' ' LEU 0.255 12.8 t 6.92 82.66 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.227 0 C-N-CA 127.55 2.34 . . . . 0.0 115.009 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -84.03 32.14 0.49 Allowed 'General case' 0 CA--C 1.488 -1.419 0 N-CA-C 117.205 2.298 . . . . 0.0 117.205 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 93.56 105.52 1.77 Allowed Glycine 0 C--O 1.21 -1.399 0 N-CA-C 117.409 1.724 . . . . 0.0 117.409 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 1.4 m-20 58.04 15.93 3.48 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 118.66 2.837 . . . . 0.0 118.66 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.424 ' HD2' ' HB2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -167.58 156.35 9.66 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 129.04 3.963 . . . . 0.0 110.13 -179.634 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.401 HD12 HG22 ' A' ' 111' ' ' VAL . 0.4 OUTLIER -111.97 106.32 14.98 Favored 'General case' 0 CA--C 1.482 -1.646 0 O-C-N 128.254 3.471 . . . . 0.0 117.574 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.421 ' CD2' ' HE2' ' A' ' 115' ' ' LYS . 1.2 m-85 -66.34 99.54 0.56 Allowed 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 116.238 -2.185 . . . . 0.0 115.985 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.08 70.8 8.44 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 114.881 -2.727 . . . . 0.0 106.498 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -83.93 111.86 19.63 Favored 'General case' 0 CA--C 1.502 -0.901 0 O-C-N 127.488 2.993 . . . . 0.0 111.268 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.75 156.21 43.9 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 128.651 3.72 . . . . 0.0 110.952 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.403 HG22 ' H ' ' A' ' 123' ' ' GLY . 59.4 m -112.24 160.26 17.79 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 126.951 2.657 . . . . 0.0 105.438 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.9 m -146.18 25.52 1.25 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 120.411 1.46 . . . . 0.0 112.799 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . 0.403 ' H ' HG22 ' A' ' 121' ' ' THR . . . 106.68 29.37 4.72 Favored Glycine 0 N--CA 1.437 -1.235 0 O-C-N 125.834 1.959 . . . . 0.0 114.49 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 126.39 -31.18 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 130.169 3.387 . . . . 0.0 110.996 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -79.15 81.97 5.36 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 128.132 3.395 . . . . 0.0 111.653 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.489 HG12 ' O ' ' A' ' 126' ' ' VAL . 39.1 t -68.34 94.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-N 110.068 -3.242 . . . . 0.0 111.489 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.1 m -72.75 106.12 4.6 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 116.289 -1.815 . . . . 0.0 109.884 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.9 75.98 4.19 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 128.309 3.505 . . . . 0.0 112.917 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -56.54 146.7 24.14 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 115.573 -2.156 . . . . 0.0 110.442 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.2 t -122.63 100.63 8.49 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.424 ' HB2' ' HD2' ' A' ' 115' ' ' LYS . 6.0 m-85 -75.93 176.18 8.11 Favored 'General case' 0 CA--C 1.48 -1.748 0 CA-C-N 109.753 -3.385 . . . . 0.0 116.878 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.423 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.411 0.0 OUTLIER -171.05 110.14 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 110.393 -3.094 . . . . 0.0 103.747 179.795 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.56 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 32.3 ttpt -49.58 127.78 16.28 Favored 'General case' 0 C--O 1.218 -0.576 1 O-C-N 130.149 4.655 . . . . 0.0 110.588 179.476 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 37.7 pttt . . . . . 0 CA--C 1.491 -1.322 0 O-C-N 126.903 2.627 . . . . 0.0 117.545 -179.561 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.489 ' HD3' ' CH2' ' A' ' 89' ' ' TRP . 1.1 ptpt . . . . . 0 CA--C 1.496 -1.112 0 N-CA-C 117.84 2.533 . . . . 0.0 117.84 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.27 116.43 31.93 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 102.848 -3.019 . . . . 0.0 102.848 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -133.13 -102.41 0.26 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 115.229 -2.32 . . . . 0.0 109.331 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 m120 35.38 41.4 0.09 Allowed 'General case' 0 C--N 1.307 -1.272 0 O-C-N 127.957 3.286 . . . . 0.0 114.427 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -101.43 -120.09 4.61 Favored Glycine 0 C--O 1.204 -1.766 0 CA-C-O 115.524 -2.82 . . . . 0.0 112.174 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.445 ' OG1' HG23 ' A' ' 42' ' ' ILE . 2.2 m 170.13 147.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.664 1 O-C-N 131.14 4.67 . . . . 0.0 104.132 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.588 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -142.68 91.68 2.33 Favored 'General case' 0 C--N 1.323 -0.577 1 O-C-N 133.422 6.701 . . . . 0.0 116.937 179.935 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 12' ' ' GLU . 10.6 mt-10 -61.66 111.87 2.01 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 116.321 -2.151 . . . . 0.0 107.945 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 37.0 ttp -61.4 74.24 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.715 0 O-C-N 127.096 2.748 . . . . 0.0 106.733 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.402 ' N ' ' O ' ' A' ' 10' ' ' GLU . 1.7 tt0 -23.67 -47.28 0.01 OUTLIER 'General case' 0 C--O 1.2 -1.502 0 O-C-N 128.285 3.491 . . . . 0.0 111.749 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.262 0.3 OUTLIER -145.08 152.2 39.72 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 109.013 -3.721 . . . . 0.0 111.573 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -116.31 104.46 11.51 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-N 109.716 -3.402 . . . . 0.0 112.976 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -50.85 31.82 Favored 'General case' 0 CA--C 1.503 -0.846 1 O-C-N 130.107 4.629 . . . . 0.0 112.364 179.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.465 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -161.05 150.34 16.78 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-O 125.239 2.447 . . . . 0.0 110.421 -179.797 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.51 ' CD1' ' N ' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -121.77 -58.15 1.76 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 124.926 2.298 . . . . 0.0 110.02 179.706 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 19' ' ' GLY . 9.2 pt-20 -71.32 -28.55 64.17 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 113.756 -1.566 . . . . 0.0 114.537 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.465 ' N ' ' OD1' ' A' ' 16' ' ' ASN . . . -70.71 -23.27 77.95 Favored Glycine 0 N--CA 1.488 2.148 0 O-C-N 128.549 3.656 . . . . 0.0 109.374 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.422 ' CD2' HD11 ' A' ' 120' ' ' LEU . 2.7 t80 -75.38 -28.28 59.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 119.049 1.425 . . . . 0.0 108.751 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.547 ' HG2' HG21 ' A' ' 26' ' ' ILE . 21.9 mtt -76.95 -33.3 57.69 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-N 113.245 -1.798 . . . . 0.0 107.838 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.481 ' CE ' ' HA ' ' A' ' 22' ' ' LYS . 4.7 mmpt? -68.59 -30.04 68.7 Favored 'General case' 0 C--O 1.203 -1.363 0 O-C-N 128.558 3.661 . . . . 0.0 114.159 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.5 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -73.48 -39.17 65.1 Favored 'General case' 0 C--O 1.208 -1.114 2 O-C-N 130.994 5.184 . . . . 0.0 114.773 179.688 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.614 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -103.7 0.24 30.33 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 127.627 3.079 . . . . 0.0 108.314 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 40.06 98.53 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.251 1 CA-C-O 129.32 4.39 . . . . 0.0 109.804 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.547 HG21 ' HG2' ' A' ' 21' ' ' MET . 6.4 tp -127.09 -45.01 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.108 0 CA-C-N 109.637 -3.438 . . . . 0.0 113.137 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -151.07 142.91 23.83 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 119.119 -2.238 . . . . 0.0 108.849 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.515 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 7.6 m-85 -80.95 65.33 6.05 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 72.19 73.47 0.16 Allowed 'General case' 0 C--O 1.203 -1.35 0 O-C-N 127.331 2.894 . . . . 0.0 107.848 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.15 -40.96 64.44 Favored 'General case' 0 N--CA 1.479 1.023 1 CA-C-N 106.658 -4.792 . . . . 0.0 114.141 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.667 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -71.01 -120.55 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.019 1 O-C-N 130.317 4.76 . . . . 0.0 112.636 -179.827 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.23 9.5 2.14 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 129.021 3.951 . . . . 0.0 108.335 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 31' ' ' ARG . 2.7 mp -142.17 -49.51 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 111.415 -2.63 . . . . 0.0 108.175 -179.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -93.2 35.29 1.08 Allowed 'General case' 0 C--O 1.205 -1.264 0 CA-C-O 122.228 1.013 . . . . 0.0 111.877 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.504 HG13 ' CZ ' ' A' ' 17' ' ' PHE . 55.0 t -50.47 -34.95 12.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.705 0 C-N-CA 127.48 2.312 . . . . 0.0 115.897 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 153.74 122.82 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 1 O-C-N 129.394 4.184 . . . . 0.0 111.487 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.817 HD12 ' N ' ' A' ' 38' ' ' THR . 1.3 pp -106.27 -11.52 16.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 113.937 -2.935 . . . . 0.0 110.87 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.817 ' N ' HD12 ' A' ' 37' ' ' LEU . 6.3 m 145.96 98.85 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.082 1 O-C-N 134.132 7.145 . . . . 0.0 111.039 -179.694 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.96 114.78 26.99 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 127.089 2.743 . . . . 0.0 117.562 -179.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 m -106.43 112.14 25.02 Favored 'General case' 0 C--O 1.209 -1.061 1 O-C-N 130.522 4.889 . . . . 0.0 110.824 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.544 ' NZ ' HD12 ' A' ' 43' ' ' ILE . 2.4 tmtt? -105.55 119.94 40.38 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 127.908 3.255 . . . . 0.0 107.593 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.572 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.7 mp -109.86 159.93 9.18 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 128.645 3.715 . . . . 0.0 111.625 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.572 ' N ' HG22 ' A' ' 42' ' ' ILE 0.307 1.0 OUTLIER -132.37 146.83 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-N 109.443 -3.526 . . . . 0.0 106.898 179.668 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 55.8 t -156.88 113.66 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.34 0 O-C-N 126.389 2.305 . . . . 0.0 110.428 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.456 ' HG2' ' CD2' ' A' ' 50' ' ' PHE . 1.1 mt-30 -114.73 134.37 55.15 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-O 125.159 2.409 . . . . 0.0 112.88 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -130.04 40.84 3.5 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 108.445 -3.979 . . . . 0.0 110.741 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.0 114.76 0.02 OUTLIER Glycine 0 C--N 1.349 1.304 0 CA-C-N 112.525 -2.125 . . . . 0.0 110.646 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 73.5 -68.9 0.2 Allowed 'General case' 0 C--O 1.217 -0.612 0 O-C-N 126.796 2.115 . . . . 0.0 111.735 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -78.85 92.96 4.92 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.754 1.622 . . . . 0.0 109.934 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.697 ' CE1' HD22 ' A' ' 94' ' ' LEU . 44.8 t80 -98.18 117.59 32.89 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.006 5.191 . . . . 0.0 111.259 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -130.35 86.76 2.42 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 128.236 3.46 . . . . 0.0 117.713 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.524 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -68.77 153.19 44.22 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 128.181 3.426 . . . . 0.0 106.725 179.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.467 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -156.33 147.1 21.89 Favored 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 128.007 3.317 . . . . 0.0 108.294 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.404 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 1.0 OUTLIER -108.83 151.9 25.61 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 127.001 2.688 . . . . 0.0 107.756 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -134.79 52.51 2.04 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.62 -92.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 1 O-C-N 131.859 5.724 . . . . 0.0 110.315 179.845 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 m 148.15 -53.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.448 1 O-C-N 130.795 5.06 . . . . 0.0 102.288 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.495 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 3.0 m-85 -51.42 -58.77 5.34 Favored 'General case' 0 N--CA 1.474 0.771 1 O-C-N 130.725 5.016 . . . . 0.0 108.231 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -154.47 111.12 3.3 Favored 'General case' 0 C--N 1.364 1.232 1 CA-C-N 106.952 -4.658 . . . . 0.0 113.823 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.404 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 0.0 OUTLIER -105.39 97.84 7.62 Favored 'General case' 0 C--O 1.218 -0.566 1 O-C-N 130.565 4.916 . . . . 0.0 110.329 179.89 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.0 89.91 3.21 Favored 'General case' 0 C--N 1.318 -0.763 1 O-C-N 129.36 4.163 . . . . 0.0 105.899 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.467 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 21.8 p30 -84.11 165.19 18.7 Favored 'General case' 0 C--O 1.199 -1.579 1 O-C-N 130.688 4.993 . . . . 0.0 115.987 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.769 HD21 ' HZ2' ' A' ' 107' ' ' TRP . 10.8 tp -100.58 54.06 0.87 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 111.43 -2.623 . . . . 0.0 112.268 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.41 100.12 12.79 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 124.266 1.984 . . . . 0.0 112.771 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.556 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -151.0 -137.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 112.774 -2.012 . . . . 0.0 110.47 179.478 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.6 m -156.14 153.44 29.31 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.478 HG11 ' CD1' ' A' ' 89' ' ' TRP . 3.4 t -76.32 151.91 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.313 0 O-C-N 125.194 1.559 . . . . 0.0 113.81 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 43.64 30.21 1.44 Allowed Glycine 0 C--O 1.215 -1.08 1 O-C-N 130.663 4.977 . . . . 0.0 115.241 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.266 0.8 OUTLIER -102.54 -5.52 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 112.679 -1.761 . . . . 0.0 109.829 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 66.37 99.45 0.05 OUTLIER 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 127.138 2.774 . . . . 0.0 111.78 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.573 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 2.4 t80 -83.38 95.48 8.23 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 127.417 2.948 . . . . 0.0 118.591 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 36.3 p-10 -74.21 76.33 1.8 Allowed 'General case' 0 C--O 1.202 -1.437 0 CA-C-O 123.991 1.853 . . . . 0.0 109.238 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -48.4 128.71 15.02 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 125.044 2.354 . . . . 0.0 113.747 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.32 49.66 2.28 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 127.067 3.318 . . . . 0.0 110.522 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.403 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 8.5 t -70.97 -172.99 0.74 Allowed 'General case' 0 C--O 1.203 -1.372 0 CA-C-N 111.161 -2.745 . . . . 0.0 110.893 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.403 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -165.77 -51.05 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 126.459 3.028 . . . . 0.0 114.262 179.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -90.72 61.56 3.09 Favored Glycine 0 N--CA 1.473 1.141 0 CA-C-N 109.352 -3.567 . . . . 0.0 112.792 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.514 ' O ' HD11 ' A' ' 24' ' ' LEU 0.268 8.4 tp 176.27 -32.43 0.0 OUTLIER 'General case' 0 C--O 1.241 0.612 0 CA-C-N 109.822 -3.189 . . . . 0.0 115.487 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.554 ' HA ' HD11 ' A' ' 24' ' ' LEU . 15.8 t0 -141.16 -53.68 0.47 Allowed 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.23 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 62.83 65.88 2.88 Favored Glycine 0 C--O 1.206 -1.623 0 CA-C-O 125.481 2.712 . . . . 0.0 111.519 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -127.65 -86.82 0.58 Allowed 'General case' 0 C--N 1.364 1.211 1 CA-C-N 107.043 -4.578 . . . . 0.0 114.372 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 132.36 73.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.117 1 O-C-N 129.271 4.107 . . . . 0.0 108.646 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.67 178.17 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 128.281 3.488 . . . . 0.0 115.929 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -108.85 158.06 18.02 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 133.401 6.688 . . . . 0.0 107.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.573 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.7 m -156.1 75.47 0.89 Allowed 'General case' 0 C--O 1.199 -1.602 0 O-C-N 128.267 3.479 . . . . 0.0 111.547 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.06 146.05 44.31 Favored 'General case' 0 N--CA 1.429 -1.507 1 CA-C-N 107.243 -4.526 . . . . 0.0 109.644 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 t -131.28 148.98 32.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 C-N-CA 127.08 2.152 . . . . 0.0 107.648 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.44 ' CG2' ' N ' ' A' ' 89' ' ' TRP 0.345 0.9 OUTLIER -166.88 165.89 15.84 Favored 'General case' 0 CA--C 1.473 -2.007 0 CA-C-O 125.893 2.759 . . . . 0.0 112.414 -179.712 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.618 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 38.4 m95 -96.3 113.73 25.34 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-O 113.472 -3.156 . . . . 0.0 109.284 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.702 ' CB ' HG23 ' A' ' 93' ' ' THR . 4.9 tp10 -73.74 -45.87 49.37 Favored 'General case' 0 CA--C 1.477 -1.858 1 CA-C-O 131.861 5.601 . . . . 0.0 112.784 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.78 -46.36 0.15 Allowed Glycine 0 CA--C 1.542 1.775 0 CA-C-N 108.692 -3.867 . . . . 0.0 104.94 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -144.16 57.44 1.33 Allowed 'General case' 0 N--CA 1.427 -1.622 0 O-C-N 128.121 2.895 . . . . 0.0 111.268 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.702 HG23 ' CB ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER 170.83 151.93 0.05 OUTLIER 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 108.537 -3.938 . . . . 0.0 117.688 179.475 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.697 HD22 ' CE1' ' A' ' 50' ' ' PHE . 0.4 OUTLIER -85.21 3.9 37.14 Favored 'General case' 0 CA--C 1.476 -1.873 1 O-C-N 131.548 5.53 . . . . 0.0 119.637 -178.941 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.481 HG12 ' O ' ' A' ' 95' ' ' VAL 0.435 27.4 t -3.45 117.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -131.14 149.11 52.74 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-O 123.538 1.637 . . . . 0.0 109.019 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.6 122.35 54.96 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.597 0 CA-C-N 111.854 -2.43 . . . . 0.0 117.369 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.457 ' CG ' ' HB3' ' A' ' 105' ' ' ARG . 1.2 tt0 -90.22 117.54 29.04 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 120.821 -1.174 . . . . 0.0 108.295 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.0 tppt? -47.94 -36.19 12.01 Favored 'General case' 0 N--CA 1.486 1.341 1 O-C-N 129.476 4.235 . . . . 0.0 108.659 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 65.91 -83.22 0.09 OUTLIER Glycine 0 C--O 1.199 -2.063 0 CA-C-N 112.543 -2.117 . . . . 0.0 113.269 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 91.31 35.32 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.052 1 CA-C-N 107.177 -4.511 . . . . 0.0 110.477 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.574 ' CD ' ' HG2' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 169.69 -42.79 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 110.952 -2.84 . . . . 0.0 113.556 -179.881 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.574 ' HG2' ' CD ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -129.38 151.56 49.88 Favored 'General case' 0 N--CA 1.433 -1.321 0 O-C-N 127.096 2.747 . . . . 0.0 115.236 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -82.82 103.06 12.02 Favored 'General case' 0 N--CA 1.491 1.59 1 O-C-N 132.271 5.982 . . . . 0.0 101.888 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.616 ' NH2' HD13 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -118.96 28.02 8.53 Favored 'General case' 0 C--N 1.31 -1.126 1 O-C-N 130.57 4.919 . . . . 0.0 110.562 -178.88 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -93.7 131.05 10.58 Favored Glycine 0 N--CA 1.427 -1.936 1 CA-C-N 106.583 -4.826 . . . . 0.0 112.703 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.769 ' HZ2' HD21 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -111.78 147.01 36.58 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 129.133 3.49 . . . . 0.0 107.047 177.383 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.464 ' HB2' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -138.97 -176.16 4.4 Favored 'General case' 0 C--O 1.215 -0.721 1 O-C-N 129.724 4.39 . . . . 0.0 111.111 -179.102 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.678 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -156.18 115.61 3.54 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 115.308 -2.557 . . . . 0.0 111.119 -176.168 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.52 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -132.7 124.26 27.85 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 117.422 2.379 . . . . 0.0 117.422 179.506 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 42.3 t -59.5 103.98 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.819 0 CA-C-O 123.718 1.723 . . . . 0.0 112.497 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -101.21 40.34 1.3 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 112.239 -2.255 . . . . 0.0 114.406 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.85 -112.7 3.7 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-N 111.789 -2.46 . . . . 0.0 115.036 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -68.15 -49.51 60.51 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -98.27 -179.08 4.25 Favored 'General case' 0 C--O 1.22 -0.48 0 O-C-N 128.963 3.915 . . . . 0.0 107.568 -179.712 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.422 ' HG ' ' N ' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -143.73 136.72 27.54 Favored 'General case' 0 C--O 1.202 -1.41 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.503 179.722 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.52 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 10.1 m-85 -81.76 163.77 22.17 Favored 'General case' 0 C--O 1.208 -1.115 0 C-N-CA 115.538 -2.465 . . . . 0.0 114.133 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.564 ' O ' HD23 ' A' ' 118' ' ' LEU . 2.2 tt -130.34 21.0 5.23 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 128.264 3.477 . . . . 0.0 106.804 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -28.58 125.55 0.1 Allowed 'General case' 0 N--CA 1.48 1.053 1 O-C-N 131.372 5.42 . . . . 0.0 109.922 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.616 HD13 ' NH2' ' A' ' 105' ' ' ARG . 0.2 OUTLIER -143.78 155.8 44.28 Favored 'General case' 0 CA--C 1.488 -1.406 0 C-N-CA 116.012 -2.275 . . . . 0.0 110.518 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.546 ' O ' HD12 ' A' ' 120' ' ' LEU . 23.5 m -114.82 158.8 21.42 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.358 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.5 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -157.66 49.6 0.42 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 126.379 2.99 . . . . 0.0 113.612 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . 0.426 ' CA ' ' HB2' ' A' ' 103' ' ' GLU . . . 93.09 -100.95 2.72 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 112.968 -1.923 . . . . 0.0 108.699 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.92 -59.93 2.49 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 111.665 -2.267 . . . . 0.0 112.236 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -73.59 174.87 7.68 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 128.031 3.332 . . . . 0.0 108.963 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.1 t -150.35 71.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.821 2 O-C-N 131.307 5.38 . . . . 0.0 113.219 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 114.63 1.45 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 116.337 -1.792 . . . . 0.0 110.696 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.12 79.89 1.66 Allowed 'General case' 0 CA--C 1.497 -1.063 0 O-C-N 128.608 3.693 . . . . 0.0 114.171 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -56.13 129.59 40.7 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.277 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.25 0.4 OUTLIER -110.12 136.92 44.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 123.905 1.812 . . . . 0.0 108.753 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.497 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 67.4 m-85 -128.09 168.23 15.65 Favored 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 111.111 -2.768 . . . . 0.0 116.92 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.484 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.354 0.0 OUTLIER -143.61 30.13 1.37 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 116.234 -1.841 . . . . 0.0 108.813 179.881 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.588 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 62.2 176.65 0.13 Allowed 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 117.449 -1.7 . . . . 0.0 111.42 -179.43 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.448 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.259 1.594 0 CA-C-O 116.224 -1.846 . . . . 0.0 114.963 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.497 -1.083 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 63.5 t0 67.53 84.54 0.15 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 102.709 -3.071 . . . . 0.0 102.709 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -116.31 46.36 1.6 Allowed 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 44' ' ' VAL . 5.1 t-20 -34.13 137.5 0.11 Allowed 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 126.172 2.17 . . . . 0.0 113.976 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 160.26 -163.53 33.94 Favored Glycine 0 C--O 1.218 -0.887 0 CA-C-O 115.271 -2.961 . . . . 0.0 112.463 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.477 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -136.91 144.47 43.5 Favored 'General case' 0 C--O 1.202 -1.434 1 O-C-N 132.725 5.603 . . . . 0.0 103.688 -179.828 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.554 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.283 0.0 OUTLIER -141.56 137.16 31.77 Favored 'General case' 0 CA--C 1.496 -1.119 1 O-C-N 131.832 5.708 . . . . 0.0 112.891 -179.191 . . . . . . . . 5 4 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.5 mm-40 -81.5 5.12 18.82 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 125.52 1.763 . . . . 0.0 115.551 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.0 ttp 58.61 -91.01 0.03 OUTLIER 'General case' 0 C--O 1.246 0.919 0 CA-C-O 111.955 -3.879 . . . . 0.0 104.134 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.8 tt0 119.54 -45.56 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.985 1 O-C-N 129.495 4.247 . . . . 0.0 110.106 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.96 155.84 5.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.479 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.84 169.89 12.77 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 110.563 -3.017 . . . . 0.0 111.882 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.405 ' HB3' ' O ' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -121.93 124.96 45.3 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 128.812 3.82 . . . . 0.0 113.118 179.923 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 t30 46.35 84.5 0.03 OUTLIER 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 124.051 1.881 . . . . 0.0 112.645 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -92.12 -30.56 15.91 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-N 112.769 -2.014 . . . . 0.0 112.871 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.468 ' HG3' ' CZ ' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -71.24 -56.78 5.35 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.064 -2.398 . . . . 0.0 112.608 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.448 ' HA2' ' HB2' ' A' ' 22' ' ' LYS . . . -53.87 -23.59 23.25 Favored Glycine 0 CA--C 1.489 -1.57 1 O-C-N 132.276 5.985 . . . . 0.0 113.252 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.87 -49.58 19.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 126.843 3.211 . . . . 0.0 108.128 179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.468 ' O ' HG22 ' A' ' 26' ' ' ILE . 19.7 mmm -68.77 -20.54 64.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 119.73 -1.856 . . . . 0.0 112.345 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.448 ' HB2' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.8 -22.77 42.69 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.55 3.031 . . . . 0.0 110.341 179.754 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -37.33 63.71 Favored 'General case' 0 C--O 1.207 -1.177 1 O-C-N 131.745 5.653 . . . . 0.0 112.806 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.84 9.36 40.78 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 128.446 3.591 . . . . 0.0 108.802 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 32.53 66.94 0.17 Allowed 'General case' 0 CA--C 1.482 -1.647 0 CA-C-O 127.008 3.29 . . . . 0.0 113.348 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.666 HD12 ' O ' ' A' ' 78' ' ' LEU . 10.7 tt -87.5 -31.48 5.91 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-O 126.685 3.136 . . . . 0.0 112.355 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.05 -176.55 0.25 Allowed 'General case' 0 C--N 1.36 1.044 0 CA-C-N 112.72 -2.036 . . . . 0.0 112.832 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.445 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 26.4 m-85 -125.0 35.73 4.73 Favored 'General case' 0 CA--C 1.501 -0.915 0 O-C-N 126.517 2.386 . . . . 0.0 111.127 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.52 177.36 6.71 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.258 3.474 . . . . 0.0 106.736 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.602 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.8 OUTLIER 76.97 -62.46 0.4 Allowed 'General case' 0 C--O 1.214 -0.807 0 O-C-N 128.747 3.78 . . . . 0.0 111.423 -179.564 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.468 ' CZ ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -38.4 -19.74 0.01 OUTLIER 'General case' 0 C--O 1.243 0.755 1 O-C-N 130.735 5.022 . . . . 0.0 113.079 -179.86 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -86.81 -32.4 20.34 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 127.668 3.105 . . . . 0.0 111.906 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 30' ' ' THR . 0.2 OUTLIER -111.42 36.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 128.665 3.728 . . . . 0.0 115.071 -179.586 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.26 23.25 11.95 Favored 'General case' 0 C--O 1.201 -1.491 0 CA-C-O 126.081 2.848 . . . . 0.0 108.568 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.431 ' O ' ' CE1' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -62.96 178.74 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 108.785 -3.825 . . . . 0.0 106.65 176.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.412 ' HD2' ' HA ' ' A' ' 36' ' ' ARG . 4.2 mpt_? -49.04 -30.39 6.19 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 127.584 3.052 . . . . 0.0 112.254 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.863 HD21 ' HB3' ' A' ' 58' ' ' PHE . 3.8 pp 29.84 108.48 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 2 O-C-N 134.822 7.576 . . . . 0.0 113.479 177.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.6 m 57.17 42.95 24.77 Favored 'General case' 0 CA--C 1.479 -1.767 0 CA-C-N 110.793 -2.912 . . . . 0.0 118.333 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.512 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.3 OUTLIER -159.34 -97.59 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.517 ' CG2' ' N ' ' A' ' 41' ' ' LYS . 1.3 m 172.56 159.15 0.11 Allowed 'General case' 0 C--O 1.199 -1.566 0 O-C-N 128.842 3.839 . . . . 0.0 112.387 -175.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.517 ' N ' ' CG2' ' A' ' 40' ' ' THR . 0.0 OUTLIER -111.98 158.21 19.79 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 101.708 -3.441 . . . . 0.0 101.708 178.43 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.783 HD11 ' HB2' ' A' ' 55' ' ' ASN . 2.1 mp -134.32 156.85 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 119.912 1.233 . . . . 0.0 111.587 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.556 ' N ' HG22 ' A' ' 42' ' ' ILE . 5.3 tt -132.31 135.74 57.49 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 0 CA-C-N 111.248 -2.705 . . . . 0.0 107.828 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.693 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.3 t -110.49 -64.97 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 N-CA-C 116.323 1.971 . . . . 0.0 116.323 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.693 ' N ' HG12 ' A' ' 44' ' ' VAL . 1.7 tm0? 65.32 140.24 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 125.851 2.739 . . . . 0.0 112.071 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -165.6 71.93 0.16 Allowed 'General case' 0 C--N 1.363 1.189 0 CA-C-N 110.244 -3.162 . . . . 0.0 114.007 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.06 -89.07 1.5 Allowed Glycine 0 C--O 1.216 -1.025 0 CA-C-O 122.893 1.274 . . . . 0.0 110.793 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -108.76 -44.47 4.02 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 109.586 -3.307 . . . . 0.0 110.788 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.16 95.49 0.13 Allowed 'General case' 0 C--N 1.357 0.904 0 O-C-N 127.269 2.856 . . . . 0.0 109.172 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.631 ' CD2' HD22 ' A' ' 94' ' ' LEU . 42.5 t80 -95.91 95.75 8.46 Favored 'General case' 0 CA--C 1.496 -1.134 1 O-C-N 129.539 4.274 . . . . 0.0 113.021 -179.933 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.442 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 43.7 mttt -105.65 165.63 11.03 Favored 'General case' 0 CA--C 1.491 -1.297 0 O-C-N 128.789 3.806 . . . . 0.0 113.84 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.54 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -148.61 111.35 4.79 Favored 'General case' 0 CA--C 1.499 -0.997 1 O-C-N 131.047 5.217 . . . . 0.0 107.797 179.713 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.57 153.17 42.55 Favored 'General case' 0 C--O 1.208 -1.128 0 C-N-CA 117.666 -1.614 . . . . 0.0 111.289 -179.468 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.6 157.67 17.02 Favored 'General case' 0 C--N 1.313 -0.979 0 O-C-N 125.878 1.986 . . . . 0.0 111.073 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.783 ' HB2' HD11 ' A' ' 42' ' ' ILE . 1.7 t-20 -107.82 -18.58 13.78 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-O 113.824 -2.989 . . . . 0.0 115.233 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.475 ' HA ' ' HB3' ' A' ' 39' ' ' GLN . 16.5 p -16.85 152.22 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.181 1 O-C-N 135.703 8.127 . . . . 0.0 113.566 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.84 -33.19 57.94 Favored 'General case' 0 CA--C 1.504 -0.819 1 CA-C-N 107.588 -4.369 . . . . 0.0 109.038 179.519 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.863 ' HB3' HD21 ' A' ' 37' ' ' LEU . 5.8 p90 -68.14 -53.31 26.1 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 126.938 2.648 . . . . 0.0 114.438 -179.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -172.47 130.81 0.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 O-C-N 127.985 3.303 . . . . 0.0 110.183 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 90.64 5.81 Favored 'General case' 0 C--O 1.204 -1.318 0 O-C-N 127.604 3.065 . . . . 0.0 113.409 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.58 141.68 37.46 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 109.083 -3.689 . . . . 0.0 109.047 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.91 161.52 14.38 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 126.877 2.611 . . . . 0.0 116.095 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.54 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 11.1 tp -109.99 62.22 0.6 Allowed 'General case' 0 C--O 1.214 -0.781 0 O-C-N 129.096 3.997 . . . . 0.0 110.753 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.442 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 7.2 p-10 -71.11 93.99 1.09 Allowed 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 112.568 -2.106 . . . . 0.0 111.141 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.675 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -127.85 169.36 13.99 Favored 'General case' 0 CA--C 1.494 -1.181 0 CA-C-O 126.686 3.136 . . . . 0.0 109.31 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.63 HG22 ' HB ' ' A' ' 69' ' ' VAL . 0.6 OUTLIER -147.97 172.82 13.61 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 110.302 -3.135 . . . . 0.0 106.972 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.447 HG12 ' N ' ' A' ' 68' ' ' GLY . 21.3 t -87.59 142.82 12.44 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.463 0 O-C-N 126.459 2.35 . . . . 0.0 115.664 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 67' ' ' VAL . . . 37.78 33.55 0.14 Allowed Glycine 0 C--N 1.342 0.894 1 O-C-N 129.806 4.441 . . . . 0.0 116.721 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.63 ' HB ' HG22 ' A' ' 66' ' ' THR . 13.4 p -81.24 -14.22 12.6 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.941 0 C-N-CA 117.797 -1.561 . . . . 0.0 108.459 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 72' ' ' ASP . 24.6 tt0 58.31 75.77 0.37 Allowed 'General case' 0 C--N 1.355 0.815 0 O-C-N 128.692 3.745 . . . . 0.0 109.361 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.569 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.2 OUTLIER -62.11 81.13 0.02 OUTLIER 'General case' 0 C--N 1.345 0.409 1 O-C-N 131.983 5.802 . . . . 0.0 111.039 179.769 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 70' ' ' GLU . 24.3 t70 -60.27 76.74 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.427 ' HG2' ' CA ' ' A' ' 83' ' ' VAL 0.272 32.6 mt-10 57.45 111.48 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.207 0 O-C-N 125.823 1.952 . . . . 0.0 113.698 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.525 ' CE1' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER 176.2 69.17 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 108.667 -3.879 . . . . 0.0 111.923 179.558 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 82.4 p -99.26 -27.97 13.54 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 110.318 -3.128 . . . . 0.0 115.675 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.525 ' HE2' ' CE1' ' A' ' 74' ' ' HIS . 0.1 OUTLIER -35.92 153.94 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 1 O-C-N 130.049 4.593 . . . . 0.0 114.772 -179.819 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.6 24.12 Favored Glycine 0 C--O 1.218 -0.89 0 CA-C-N 111.218 -2.719 . . . . 0.0 110.664 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.666 ' O ' HD12 ' A' ' 26' ' ' ILE . 10.8 tp -163.73 -47.75 0.03 OUTLIER 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 126.963 3.268 . . . . 0.0 112.505 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.79 -67.04 1.03 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 110.562 -3.017 . . . . 0.0 113.24 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.98 69.93 1.16 Allowed Glycine 0 C--O 1.209 -1.44 0 CA-C-O 125.727 2.848 . . . . 0.0 110.842 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.521 ' NE ' ' HA ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -114.47 -156.04 0.59 Allowed 'General case' 0 N--CA 1.49 1.567 1 CA-C-N 107.399 -4.4 . . . . 0.0 107.944 -179.585 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.415 ' CG ' ' HB3' ' A' ' 73' ' ' GLU . 0.3 OUTLIER -174.52 82.21 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 127.544 3.027 . . . . 0.0 108.118 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.438 HG13 ' HA3' ' A' ' 100' ' ' GLY . 2.3 t -138.09 153.54 27.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 N-CA-C 118.17 2.655 . . . . 0.0 118.17 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -55.97 147.05 20.59 Favored 'General case' 0 C--O 1.239 0.524 1 O-C-N 129.592 4.307 . . . . 0.0 106.334 179.448 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.569 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 2.1 m -152.83 70.79 0.9 Allowed 'General case' 0 C--O 1.199 -1.553 1 O-C-N 130.589 4.931 . . . . 0.0 112.066 -179.161 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 70' ' ' GLU . 2.0 tp -70.65 140.88 51.67 Favored 'General case' 0 C--O 1.209 -1.039 1 CA-C-N 107.114 -4.585 . . . . 0.0 115.298 -179.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.532 HG12 HD11 ' A' ' 94' ' ' LEU . 2.2 t -116.79 142.31 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 111.728 -2.487 . . . . 0.0 107.012 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.253 16.4 m -159.1 161.82 36.45 Favored 'General case' 0 CA--C 1.48 -1.75 0 O-C-N 126.175 2.172 . . . . 0.0 111.499 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.663 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 33.5 m95 -98.87 143.97 28.6 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 128.309 2.644 . . . . 0.0 107.957 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.686 ' HB3' HG22 ' A' ' 93' ' ' THR . 9.7 tp10 -99.46 -30.78 11.98 Favored 'General case' 0 C--O 1.195 -1.794 1 CA-C-O 128.521 4.01 . . . . 0.0 112.09 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.44 -40.25 0.51 Allowed Glycine 0 C--O 1.21 -1.371 1 N-CA-C 102.751 -4.14 . . . . 0.0 102.751 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -149.54 31.04 0.74 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.767 5.04 . . . . 0.0 111.579 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.686 HG22 ' HB3' ' A' ' 90' ' ' GLU . 5.5 t -167.74 149.67 5.59 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 117.672 2.471 . . . . 0.0 117.672 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.631 HD22 ' CD2' ' A' ' 50' ' ' PHE . 1.6 tp -85.81 87.24 7.38 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 118.036 2.606 . . . . 0.0 118.036 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.556 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.335 53.4 t -81.79 120.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.361 1.101 0 O-C-N 128.006 3.317 . . . . 0.0 112.451 179.712 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.524 ' HB2' ' CZ3' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -143.07 143.69 31.96 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 126.79 3.185 . . . . 0.0 108.916 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.9 m -133.55 144.08 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 108.459 -3.973 . . . . 0.0 117.813 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 101.03 12.58 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 110.692 -2.958 . . . . 0.0 106.959 178.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -92.31 96.11 10.09 Favored 'General case' 0 CA--C 1.496 -1.101 0 C-N-CA 114.449 -2.9 . . . . 0.0 114.229 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.438 ' HA3' HG13 ' A' ' 83' ' ' VAL . . . 138.86 160.49 8.4 Favored Glycine 0 C--N 1.348 1.218 1 CA-C-O 128.055 4.142 . . . . 0.0 114.267 179.137 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.16 178.19 0.06 Allowed 'General case' 0 CA--C 1.499 -1.016 1 CA-C-N 106.631 -4.785 . . . . 0.0 108.553 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.86 -68.35 0.2 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 117.218 2.303 . . . . 0.0 117.218 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -56.31 158.87 3.9 Favored 'General case' 0 C--O 1.2 -1.511 0 CA-C-N 111.253 -2.703 . . . . 0.0 116.671 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.82 105.98 11.23 Favored 'General case' 0 N--CA 1.492 1.637 2 O-C-N 130.094 4.621 . . . . 0.0 102.493 179.719 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 122' ' ' CYS . 19.5 mmm-85 -108.05 31.78 5.26 Favored 'General case' 0 C--N 1.32 -0.68 1 O-C-N 130.308 4.755 . . . . 0.0 112.272 -179.68 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -62.77 83.78 0.04 OUTLIER Glycine 0 N--CA 1.428 -1.848 2 O-C-N 131.209 5.318 . . . . 0.0 113.564 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.675 ' CH2' ' CE2' ' A' ' 65' ' ' PHE 0.283 0.0 OUTLIER -99.44 128.38 45.55 Favored 'General case' 0 C--N 1.319 -0.728 1 O-C-N 131.817 5.069 . . . . 0.0 109.962 179.721 . . . . . . . . 5 4 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.529 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.8 OUTLIER -160.92 150.13 16.83 Favored 'General case' 0 CA--C 1.508 -0.647 1 O-C-N 130.074 4.609 . . . . 0.0 117.052 -177.007 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.444 HE22 HD23 ' A' ' 118' ' ' LEU . 28.0 mm-40 -106.42 179.01 4.39 Favored 'General case' 0 C--N 1.359 0.984 0 CA-C-O 113.497 -3.144 . . . . 0.0 109.648 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.529 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 0.7 OUTLIER 173.37 82.69 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.279 1 O-C-N 131.726 5.641 . . . . 0.0 117.71 178.526 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 80.6 t -45.57 102.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.761 0 CA-C-O 127.973 3.749 . . . . 0.0 116.239 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -85.31 20.28 2.04 Favored 'General case' 0 N--CA 1.484 1.238 1 CA-C-N 108.345 -4.025 . . . . 0.0 116.042 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.49 -101.28 0.33 Allowed Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.148 1.219 . . . . 0.0 116.148 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.53 12.69 25.88 Favored 'General case' 0 C--O 1.207 -1.137 0 N-CA-C 118.302 2.705 . . . . 0.0 118.302 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.417 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.7 OUTLIER -143.7 172.89 12.2 Favored 'General case' 0 C--N 1.32 -0.705 2 O-C-N 132.192 5.933 . . . . 0.0 109.388 179.837 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.737 ' O ' HD23 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -138.78 121.05 15.88 Favored 'General case' 0 CA--C 1.48 -1.74 1 O-C-N 129.88 4.487 . . . . 0.0 111.713 179.942 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.484 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 4.7 m-85 -76.83 158.51 30.77 Favored 'General case' 0 C--O 1.213 -0.857 0 C-N-CA 115.888 -2.325 . . . . 0.0 116.097 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.511 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -137.95 46.49 2.07 Favored 'General case' 0 C--N 1.349 0.572 2 O-C-N 130.039 4.587 . . . . 0.0 108.261 179.789 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -62.03 157.32 19.07 Favored 'General case' 0 CA--C 1.506 -0.739 0 C-N-CA 127.067 2.147 . . . . 0.0 109.338 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.81 177.08 5.93 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 116.735 -1.986 . . . . 0.0 111.305 179.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 47.7 m -135.8 155.71 49.93 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.2 OUTLIER -159.05 72.28 0.55 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 126.01 2.814 . . . . 0.0 114.155 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.27 58.15 9.24 Favored Glycine 0 CA--C 1.532 1.131 0 CA-C-N 112.039 -2.346 . . . . 0.0 111.273 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 62.98 52.6 2.55 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 126.523 1.929 . . . . 0.0 109.594 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -137.46 26.23 2.86 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-N 111.684 -2.507 . . . . 0.0 109.191 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 126' ' ' VAL . 89.6 t -18.63 86.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.963 1 O-C-N 129.688 4.367 . . . . 0.0 111.653 179.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.42 150.78 31.2 Favored 'General case' 0 CA--C 1.49 -1.357 0 CA-C-N 111.936 -2.393 . . . . 0.0 112.843 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 3.9 ttp85 -124.71 151.13 45.41 Favored 'General case' 0 C--N 1.353 0.749 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.333 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -136.95 166.31 23.95 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 127.015 2.697 . . . . 0.0 114.862 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.3 t -150.94 143.26 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-O 128.117 3.818 . . . . 0.0 105.99 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.511 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 29.6 m-85 -137.34 -175.83 4.19 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-N 108.988 -3.733 . . . . 0.0 114.48 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -168.77 122.74 0.85 Allowed 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 178.767 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.554 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 35.7 ttpt -50.54 95.55 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 112.467 -2.152 . . . . 0.0 116.013 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt . . . . . 0 C--O 1.259 1.556 0 O-C-N 126.789 2.556 . . . . 0.0 116.499 179.604 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm . . . . . 0 CA--C 1.493 -1.22 0 N-CA-C 118.654 2.835 . . . . 0.0 118.654 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.405 ' HA ' ' CG2' ' A' ' 111' ' ' VAL . 22.9 m-20 53.1 -104.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -170.22 -146.96 0.05 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 114.96 -2.447 . . . . 0.0 105.888 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -170.77 104.94 0.25 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 130.513 3.525 . . . . 0.0 113.242 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -179.81 -117.43 0.55 Allowed Glycine 0 C--O 1.201 -1.953 0 CA-C-O 116.844 -2.087 . . . . 0.0 113.725 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 40' ' ' THR . 30.8 m -167.69 145.61 4.55 Favored 'General case' 0 C--O 1.216 -0.664 1 O-C-N 130.26 4.153 . . . . 0.0 108.439 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.778 ' CZ2' HD12 ' A' ' 116' ' ' LEU 0.287 0.0 OUTLIER -132.65 125.27 29.97 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 128.441 3.588 . . . . 0.0 112.489 -179.785 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -75.37 -4.06 37.2 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 127.16 2.787 . . . . 0.0 115.004 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.531 ' HG3' ' CE1' ' A' ' 131' ' ' PHE 0.27 16.0 ttm 57.86 62.0 2.22 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 116.209 -1.853 . . . . 0.0 107.266 179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -34.91 -34.7 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 127.766 3.166 . . . . 0.0 111.842 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.29 0.2 OUTLIER -151.39 154.67 37.11 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-O 124.889 2.281 . . . . 0.0 112.254 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -129.92 125.2 34.95 Favored 'General case' 0 CA--C 1.503 -0.864 1 CA-C-N 107.629 -4.351 . . . . 0.0 116.695 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.416 ' HB3' ' HB3' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -112.34 122.88 48.98 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 132.042 5.839 . . . . 0.0 113.892 179.934 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.5 t30 49.99 84.64 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 124.024 1.868 . . . . 0.0 114.323 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.62 -37.58 9.08 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-O 125.725 2.679 . . . . 0.0 111.88 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.255 28.9 tt0 -79.24 -36.25 40.25 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 110.708 -2.951 . . . . 0.0 113.032 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.05 -22.92 76.15 Favored Glycine 0 CA--C 1.486 -1.775 0 O-C-N 128.914 3.884 . . . . 0.0 112.286 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -29.75 65.94 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 123.274 1.511 . . . . 0.0 108.899 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.43 -29.99 57.23 Favored 'General case' 0 CA--C 1.49 -1.338 0 C-N-CA 116.616 -2.034 . . . . 0.0 110.648 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -75.6 -29.76 59.37 Favored 'General case' 0 C--N 1.313 -0.981 0 O-C-N 128.089 3.368 . . . . 0.0 111.25 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.502 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -58.19 -48.71 79.47 Favored 'General case' 0 C--N 1.315 -0.91 1 O-C-N 129.979 4.549 . . . . 0.0 114.485 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 79' ' ' ASP . 1.0 OUTLIER -90.15 -12.33 38.54 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 110.262 -3.154 . . . . 0.0 108.789 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.424 ' N ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER 53.27 104.83 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 O-C-N 128.279 3.487 . . . . 0.0 107.387 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 9.6 tt -112.17 -43.05 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 CA-C-N 110.656 -2.975 . . . . 0.0 109.18 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -170.09 33.69 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 118.489 -2.632 . . . . 0.0 112.844 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.463 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.2 OUTLIER 36.16 76.44 0.05 OUTLIER 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 76.83 63.06 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 124.96 2.314 . . . . 0.0 106.29 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -63.69 -43.28 97.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 108.531 -3.941 . . . . 0.0 109.763 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.503 ' HB3' ' HB3' ' A' ' 34' ' ' ALA 0.272 0.0 OUTLIER -74.69 -105.19 0.01 OUTLIER 'General case' 0 C--O 1.246 0.874 2 O-C-N 130.655 4.972 . . . . 0.0 110.527 179.88 . . . . . . . . 5 4 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 31' ' ' ARG . 29.9 tttm 86.77 -3.19 0.67 Allowed 'General case' 0 C--O 1.203 -1.376 0 O-C-N 128.223 3.452 . . . . 0.0 110.07 -178.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.602 ' N ' HD13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -155.42 31.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 O-C-N 127.059 2.725 . . . . 0.0 108.588 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.503 ' HB3' ' HB3' ' A' ' 31' ' ' ARG . . . -138.86 24.09 2.6 Favored 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 112.864 -1.971 . . . . 0.0 110.151 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 t -44.85 -37.37 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.168 0 CA-C-O 125.276 2.465 . . . . 0.0 109.497 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.967 ' C ' HD13 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 177.89 168.85 0.72 Allowed 'General case' 0 C--O 1.216 -0.702 1 CA-C-N 106.568 -4.833 . . . . 0.0 111.081 178.814 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.967 HD13 ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -150.64 -103.98 0.06 Allowed 'General case' 0 C--N 1.316 -0.89 2 O-C-N 132.1 5.875 . . . . 0.0 107.662 -176.922 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.494 ' O ' HG22 ' A' ' 38' ' ' THR . 35.0 m -130.15 38.65 3.76 Favored 'General case' 0 CA--C 1.488 -1.429 0 O-C-N 127.633 3.083 . . . . 0.0 111.991 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -47.2 150.28 0.86 Allowed 'General case' 0 N--CA 1.481 1.076 0 O-C-N 120.236 -1.54 . . . . 0.0 115.066 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 8' ' ' THR . 22.1 m -168.88 108.09 0.46 Allowed 'General case' 0 C--O 1.216 -0.702 1 O-C-N 130.904 5.128 . . . . 0.0 114.33 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 3.7 tmtt? -94.13 144.34 25.58 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 127.482 2.989 . . . . 0.0 107.166 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.569 HD12 ' O ' ' A' ' 53' ' ' LYS . 4.2 mt -124.9 161.67 28.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.327 0 O-C-N 126.449 2.343 . . . . 0.0 110.622 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.528 ' N ' HG22 ' A' ' 42' ' ' ILE . 12.7 tt -139.26 130.61 34.37 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.508 0 CA-C-N 110.419 -3.082 . . . . 0.0 107.517 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.0 t -106.94 -61.14 2.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 CA-C-O 115.538 -2.172 . . . . 0.0 112.117 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 50.5 130.08 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.265 0 CA-C-O 126.64 3.114 . . . . 0.0 115.946 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -163.95 32.46 0.08 Allowed 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 109.434 -3.53 . . . . 0.0 112.913 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 114.92 -118.67 4.4 Favored Glycine 0 C--N 1.345 1.04 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -79.57 -31.01 41.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 118.073 -1.451 . . . . 0.0 112.69 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -105.45 91.51 3.8 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.729 2.811 . . . . 0.0 108.755 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.495 ' CD1' ' C ' ' A' ' 50' ' ' PHE . 14.7 t80 -103.55 137.6 41.4 Favored 'General case' 0 CA--C 1.48 -1.73 1 O-C-N 129.642 4.339 . . . . 0.0 114.766 -179.444 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.481 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -147.99 99.8 3.11 Favored 'General case' 0 C--O 1.203 -1.363 0 N-CA-C 118.317 2.71 . . . . 0.0 118.317 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.588 ' HB ' HD23 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -73.87 153.88 39.68 Favored 'General case' 0 C--O 1.245 0.822 0 O-C-N 128.629 3.706 . . . . 0.0 105.739 177.807 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.569 ' O ' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -159.69 134.76 8.08 Favored 'General case' 0 CA--C 1.483 -1.62 0 C-N-CA 115.197 -2.601 . . . . 0.0 111.876 -178.554 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -97.64 152.52 18.99 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.736 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -144.49 36.21 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 114.267 -1.333 . . . . 0.0 114.021 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.451 ' O ' HG22 ' A' ' 57' ' ' THR . 3.4 p -37.73 -46.48 0.9 Allowed 'General case' 0 C--N 1.317 -0.824 0 O-C-N 128.535 3.647 . . . . 0.0 106.171 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 57' ' ' THR . 0.6 OUTLIER 88.95 10.35 0.09 Allowed 'General case' 0 N--CA 1.481 1.101 1 O-C-N 130.959 5.162 . . . . 0.0 106.219 -179.941 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -110.4 -51.99 2.82 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 110.765 -2.925 . . . . 0.0 110.998 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.517 ' NH2' ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -164.73 90.56 0.54 Allowed 'General case' 0 C--N 1.359 1.019 0 CA-C-N 109.076 -3.693 . . . . 0.0 109.985 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.415 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 0.0 OUTLIER -91.85 126.27 36.87 Favored 'General case' 0 N--CA 1.431 -1.418 1 CA-C-N 108.061 -4.154 . . . . 0.0 111.854 -179.708 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.517 ' CE1' ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -128.55 47.57 2.43 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 128.722 3.764 . . . . 0.0 107.184 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -28.86 133.54 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 O-C-N 128.937 3.898 . . . . 0.0 113.769 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.588 HD23 ' HB ' ' A' ' 52' ' ' THR . 11.7 tp -82.48 56.31 3.25 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -92.4 99.89 12.56 Favored 'General case' 0 C--O 1.205 -1.252 0 O-C-N 126.182 2.176 . . . . 0.0 112.823 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.513 ' HE2' HD11 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -147.89 -157.19 0.79 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 126.526 1.931 . . . . 0.0 107.386 179.134 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.44 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.5 OUTLIER -128.27 179.27 5.71 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 178.209 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.957 HG11 ' CD1' ' A' ' 89' ' ' TRP . 4.1 t -118.97 115.58 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.8 1 O-C-N 129.714 4.384 . . . . 0.0 109.96 -179.206 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.72 -24.34 22.06 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 116.448 -2.787 . . . . 0.0 111.561 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 69' ' ' VAL . 20.8 t -92.48 89.69 2.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 112.587 -1.806 . . . . 0.0 109.378 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.434 ' CG ' HD12 ' A' ' 86' ' ' LEU . 1.4 tm-20 -37.28 102.71 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.761 1 O-C-N 129.879 4.487 . . . . 0.0 113.137 179.472 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.404 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.1 OUTLIER -70.44 86.95 0.63 Allowed 'General case' 0 C--N 1.355 0.828 0 O-C-N 126.045 2.091 . . . . 0.0 111.432 -179.879 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -48.04 85.3 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.51 0 CA-C-N 112.153 -2.294 . . . . 0.0 116.193 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.403 ' CD ' ' HB2' ' A' ' 82' ' ' ASN . 9.8 mt-10 57.84 -165.76 0.16 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 120.827 1.649 . . . . 0.0 108.824 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 92.08 112.83 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.963 0 CA-C-N 110.251 -3.159 . . . . 0.0 110.48 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.418 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 71.4 p -134.11 -105.81 0.23 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 110.921 -2.854 . . . . 0.0 113.462 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.418 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 58.56 162.89 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 126.235 2.922 . . . . 0.0 114.613 -179.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 64.23 19.95 64.6 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-N 108.582 -3.917 . . . . 0.0 107.713 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.541 ' O ' HD11 ' A' ' 24' ' ' LEU . 9.9 tp -159.15 -52.75 0.06 Allowed 'General case' 0 N--CA 1.475 0.796 0 O-C-N 127.485 2.52 . . . . 0.0 114.826 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.542 ' CB ' HD13 ' A' ' 24' ' ' LEU . 38.7 t0 -125.13 -66.23 0.97 Allowed 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 125.679 2.657 . . . . 0.0 110.421 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.35 74.07 1.21 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.665 2.079 . . . . 0.0 116.608 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -150.65 -130.97 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 112.045 -2.078 . . . . 0.0 113.672 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.403 ' HB2' ' CD ' ' A' ' 73' ' ' GLU . 1.4 p-10 -169.4 115.67 0.58 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.659 1.118 . . . . 0.0 108.843 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.571 HG11 ' OE1' ' A' ' 98' ' ' GLN . 75.6 t -138.09 149.61 24.74 Favored 'Isoleucine or valine' 0 C--N 1.365 1.254 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -179.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -63.39 103.86 0.56 Allowed 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 112.281 -2.236 . . . . 0.0 106.877 178.7 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.404 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 14.4 m -115.95 78.47 1.19 Allowed 'General case' 0 C--O 1.208 -1.131 0 O-C-N 126.994 2.684 . . . . 0.0 111.557 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 2.5 tp -86.6 148.95 25.26 Favored 'General case' 0 C--O 1.209 -1.072 1 CA-C-N 106.572 -4.831 . . . . 0.0 109.647 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.607 HG22 ' HB2' ' A' ' 96' ' ' CYS . 49.7 t -135.82 147.33 28.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 125.826 1.651 . . . . 0.0 107.602 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.487 ' O ' HG23 ' A' ' 88' ' ' THR . 8.7 t -167.71 126.96 1.31 Allowed 'General case' 0 CA--C 1.474 -1.979 0 CA-C-O 127.561 3.553 . . . . 0.0 111.934 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.957 ' CD1' HG11 ' A' ' 67' ' ' VAL . 21.2 m95 -64.09 144.38 57.15 Favored 'General case' 0 C--N 1.346 0.454 0 O-C-N 116.877 -3.639 . . . . 0.0 102.792 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.7 OUTLIER -104.33 -3.48 24.12 Favored 'General case' 0 CA--C 1.471 -2.087 1 CA-C-O 131.673 5.511 . . . . 0.0 118.689 -177.83 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 116.08 -13.51 16.7 Favored Glycine 0 C--O 1.198 -2.126 1 N-CA-C 102.883 -4.087 . . . . 0.0 102.883 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.473 ' O ' ' HB ' ' A' ' 93' ' ' THR . 1.1 p-10 179.33 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.609 1 O-C-N 131.325 4.78 . . . . 0.0 111.891 -179.979 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.645 HG23 ' CG2' ' A' ' 95' ' ' VAL 0.315 12.6 t 161.49 130.26 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 128.093 2.557 . . . . 0.0 116.386 179.448 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.576 ' N ' ' CZ3' ' A' ' 89' ' ' TRP . 6.4 tp -52.48 -38.16 58.83 Favored 'General case' 0 CA--C 1.482 -1.66 0 N-CA-C 118.63 2.826 . . . . 0.0 118.63 -177.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.645 ' CG2' HG23 ' A' ' 93' ' ' THR . 18.1 t 28.7 120.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.285 0 N-CA-C 120.63 3.567 . . . . 0.0 120.63 -178.082 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.607 ' HB2' HG22 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -139.52 137.79 35.77 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 103.416 -2.809 . . . . 0.0 103.416 179.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.41 ' O ' ' N ' ' A' ' 99' ' ' LYS . 3.5 t -119.93 96.57 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 119.439 3.125 . . . . 0.0 119.439 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.571 ' OE1' HG11 ' A' ' 83' ' ' VAL . 5.1 mm-40 -66.0 94.12 0.22 Allowed 'General case' 0 C--N 1.364 1.215 0 CA-C-O 123.992 1.853 . . . . 0.0 106.504 178.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' A' ' 97' ' ' VAL . 3.4 tttp -91.59 -56.19 3.21 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 110.036 -3.257 . . . . 0.0 114.404 -178.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.556 ' O ' HG22 ' A' ' 83' ' ' VAL . . . -49.58 146.13 7.56 Favored Glycine 0 C--O 1.206 -1.612 0 CA-C-O 124.426 2.125 . . . . 0.0 112.599 -179.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 69.98 165.79 0.28 Allowed 'General case' 0 CA--C 1.498 -1.046 1 CA-C-N 107.808 -4.196 . . . . 0.0 108.865 179.8 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.43 ' HD2' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -43.57 -48.68 7.56 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.468 2.307 . . . . 0.0 113.09 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.43 ' N ' ' HD2' ' A' ' 102' ' ' LYS . 3.3 mm-40 -42.27 147.72 0.24 Allowed 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 109.964 -3.289 . . . . 0.0 116.147 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.411 ' O ' ' HB ' ' A' ' 121' ' ' THR . 2.8 m120 -125.15 71.4 1.19 Allowed 'General case' 0 N--CA 1.492 1.632 1 CA-C-N 106.451 -4.886 . . . . 0.0 101.971 179.573 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 28.8 mmm-85 -88.65 1.85 54.3 Favored 'General case' 0 C--O 1.204 -1.326 1 O-C-N 131.749 5.656 . . . . 0.0 114.045 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.412 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.65 98.43 0.01 OUTLIER Glycine 0 N--CA 1.43 -1.764 2 O-C-N 134.256 7.222 . . . . 0.0 116.596 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.609 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.283 0.0 OUTLIER -108.89 126.92 53.58 Favored 'General case' 0 C--O 1.214 -0.764 1 O-C-N 131.074 4.632 . . . . 0.0 109.068 178.725 . . . . . . . . 5 4 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.543 ' HG3' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -162.48 178.57 8.49 Favored 'General case' 0 C--O 1.209 -1.055 1 O-C-N 130.877 5.111 . . . . 0.0 112.81 -179.074 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.474 ' CG ' ' HB3' ' A' ' 94' ' ' LEU 0.286 0.0 OUTLIER -133.28 -177.22 4.42 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 112.985 -3.388 . . . . 0.0 107.644 -179.825 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.543 ' CZ3' ' HG3' ' A' ' 108' ' ' LYS . 0.6 OUTLIER 174.93 92.66 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.416 1 O-C-N 131.445 5.466 . . . . 0.0 118.183 178.221 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.405 ' CG2' ' HA ' ' A' ' 4' ' ' ASP 0.277 77.5 t -31.64 100.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.783 0 O-C-N 119.134 -2.229 . . . . 0.0 115.774 179.714 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.546 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -101.41 4.05 41.03 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 112.348 -2.205 . . . . 0.0 116.617 -179.595 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 151.0 -94.08 0.15 Allowed Glycine 0 N--CA 1.435 -1.368 0 O-C-N 120.767 -1.208 . . . . 0.0 113.789 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -118.62 24.66 10.76 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 117.692 2.479 . . . . 0.0 117.692 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.429 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -172.79 153.38 2.68 Favored 'General case' 0 CA--C 1.508 -0.654 1 O-C-N 129.931 4.519 . . . . 0.0 110.477 -179.792 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.778 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 2.3 mt -96.26 112.53 24.24 Favored 'General case' 0 C--O 1.199 -1.565 1 O-C-N 129.386 4.179 . . . . 0.0 114.667 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.546 ' CD1' ' HB2' ' A' ' 112' ' ' GLU . 17.6 m-85 -74.0 98.11 2.99 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 114.596 -2.842 . . . . 0.0 115.661 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.438 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -80.27 79.14 6.89 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 128.73 3.769 . . . . 0.0 108.047 179.786 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -93.88 122.34 36.28 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 125.373 1.671 . . . . 0.0 109.783 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.444 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -134.03 150.47 51.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 126.363 2.29 . . . . 0.0 109.025 179.856 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.439 HG23 HG22 ' A' ' 126' ' ' VAL . 2.5 m -106.24 168.04 9.41 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.472 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -162.72 41.91 0.12 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 125.991 2.805 . . . . 0.0 115.618 -179.704 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 76.06 70.62 1.25 Allowed Glycine 0 C--O 1.218 -0.876 0 CA-C-N 109.547 -3.478 . . . . 0.0 111.731 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 102.72 -50.01 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.977 0 C-N-CA 129.088 2.955 . . . . 0.0 110.672 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.502 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 3.3 mm-40 -73.64 143.38 46.32 Favored 'General case' 0 C--O 1.217 -0.657 1 O-C-N 129.197 4.061 . . . . 0.0 108.562 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.439 HG22 HG23 ' A' ' 121' ' ' THR . 94.9 t -124.81 87.02 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 O-C-N 128.114 3.384 . . . . 0.0 112.523 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.9 t -56.83 143.46 37.05 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . 0.416 ' HB3' ' HB3' ' A' ' 15' ' ' GLU . 4.8 ttp180 -127.51 135.68 50.7 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 128.495 3.622 . . . . 0.0 110.467 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -124.42 135.56 53.36 Favored 'General case' 0 N--CA 1.481 1.122 1 O-C-N 129.157 4.036 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 130' ' ' VAL . 54.1 t -127.99 74.74 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.202 -1.445 0 N-CA-C 102.996 -2.965 . . . . 0.0 102.996 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 2.5 m-85 -54.86 -176.34 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.807 2 CA-C-N 104.677 -5.692 . . . . 0.0 111.52 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -164.16 107.71 0.95 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 114.846 -2.502 . . . . 0.0 105.271 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.583 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -51.99 129.55 27.44 Favored 'General case' 0 N--CA 1.475 0.795 1 O-C-N 130.536 4.897 . . . . 0.0 108.682 178.521 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.423 ' HD3' ' HB ' ' A' ' 8' ' ' THR . 1.2 pttt . . . . . 0 CA--C 1.504 -0.819 0 N-CA-C 118.075 2.62 . . . . 0.0 118.075 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.486 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.505 -0.761 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.455 ' HA ' ' NE2' ' A' ' 45' ' ' GLN . 1.4 m-20 -77.09 132.19 38.75 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -154.3 66.4 0.7 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 116.938 -1.905 . . . . 0.0 107.62 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -44.31 146.3 0.69 Allowed 'General case' 0 N--CA 1.44 -0.959 1 O-C-N 129.96 4.538 . . . . 0.0 111.579 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.38 -169.81 33.87 Favored Glycine 0 C--O 1.207 -1.536 0 C-N-CA 117.546 -2.264 . . . . 0.0 111.993 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.474 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -127.64 147.98 50.37 Favored 'General case' 0 C--O 1.203 -1.381 1 O-C-N 131.954 5.149 . . . . 0.0 104.515 179.704 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.518 ' CZ3' ' HG3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.05 105.92 3.99 Favored 'General case' 0 C--N 1.32 -0.717 0 O-C-N 128.499 3.624 . . . . 0.0 116.705 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' N ' ' A' ' 12' ' ' GLU . 3.1 mt-10 -78.75 107.96 11.83 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 127.258 2.849 . . . . 0.0 108.997 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.428 ' HB3' ' HG2' ' A' ' 39' ' ' GLN 0.273 5.8 ttp -64.08 85.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 103.507 -2.775 . . . . 0.0 103.507 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 10' ' ' GLU . 36.8 tt0 -45.24 -30.28 1.19 Allowed 'General case' 0 C--N 1.312 -1.042 1 O-C-N 130.988 5.18 . . . . 0.0 112.006 -179.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.1 m -144.7 149.53 35.78 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 113.377 -1.738 . . . . 0.0 111.447 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.421 ' ND2' ' CE ' ' A' ' 11' ' ' MET . 5.9 t-20 -128.59 110.18 12.02 Favored 'General case' 0 C--O 1.206 -1.236 1 O-C-N 129.503 4.252 . . . . 0.0 112.665 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -110.97 125.31 53.57 Favored 'General case' 0 CA--C 1.496 -1.103 1 O-C-N 131.348 5.405 . . . . 0.0 113.717 179.446 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 57.66 85.97 0.08 Allowed 'General case' 0 C--O 1.209 -1.07 0 CA-C-O 122.277 1.037 . . . . 0.0 109.393 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.678 ' CE2' HG22 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -105.4 -29.36 10.29 Favored 'General case' 0 CA--C 1.487 -1.449 0 CA-C-O 124.944 2.307 . . . . 0.0 109.148 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.451 ' HG3' ' HB3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -78.7 -48.68 14.5 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 114.982 -2.437 . . . . 0.0 110.601 179.154 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -59.58 -20.88 53.29 Favored Glycine 0 N--CA 1.475 1.241 0 O-C-N 128.43 3.581 . . . . 0.0 111.214 178.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.44 -38.69 48.95 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-O 127.434 3.492 . . . . 0.0 105.611 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.451 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -69.12 -36.3 77.35 Favored 'General case' 0 C--O 1.214 -0.789 0 CA-C-N 111.194 -2.73 . . . . 0.0 109.617 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.82 -22.57 60.78 Favored 'General case' 0 C--O 1.207 -1.164 1 O-C-N 134.03 7.081 . . . . 0.0 114.617 -179.328 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.14 -27.65 61.79 Favored 'General case' 0 N--CA 1.477 0.924 2 O-C-N 132.082 5.864 . . . . 0.0 109.11 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.729 HD12 ' HB ' ' A' ' 26' ' ' ILE . 0.6 OUTLIER -122.95 25.53 8.54 Favored 'General case' 0 CA--C 1.542 0.651 1 O-C-N 130.362 4.789 . . . . 0.0 105.484 179.775 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.402 ' C ' ' N ' ' A' ' 27' ' ' ASP . 1.6 m-20 57.72 -73.72 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.646 0 C-N-CA 130.826 3.65 . . . . 0.0 111.786 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.729 ' HB ' HD12 ' A' ' 24' ' ' LEU . 4.5 tt 28.54 49.8 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.046 3 CA-C-O 130.333 4.873 . . . . 0.0 106.84 179.557 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -67.87 62.41 0.08 Allowed 'General case' 0 N--CA 1.49 1.552 1 CA-C-N 107.992 -4.186 . . . . 0.0 113.844 -177.454 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.488 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 2.8 m-30 -106.72 -43.14 4.77 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 118.153 2.649 . . . . 0.0 118.153 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' A' ' 28' ' ' PHE . . . 158.36 155.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 104.328 -2.471 . . . . 0.0 104.328 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.769 HG23 ' O ' ' A' ' 34' ' ' ALA . 2.4 m 154.04 -50.26 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.099 1 O-C-N 131.148 5.28 . . . . 0.0 110.392 -178.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.48 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -50.36 -32.66 17.97 Favored 'General case' 0 N--CA 1.472 0.632 1 O-C-N 132.597 6.186 . . . . 0.0 106.288 179.234 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.48 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.6 OUTLIER -82.89 -45.69 13.9 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 127.807 3.192 . . . . 0.0 106.493 178.366 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.547 HD13 ' HA ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -172.76 97.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.383 0 CA-C-O 128.245 3.878 . . . . 0.0 115.948 177.305 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.769 ' O ' HG23 ' A' ' 30' ' ' THR . . . 169.25 46.25 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.543 0 CA-C-O 127.697 3.618 . . . . 0.0 107.732 175.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.678 HG22 ' CE2' ' A' ' 17' ' ' PHE . 58.6 t -62.03 -25.93 38.68 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.622 1 CA-C-N 106.932 -4.667 . . . . 0.0 108.282 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.537 ' C ' HD12 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 174.84 -80.83 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.868 1 CA-C-N 107.917 -4.22 . . . . 0.0 108.421 177.133 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.75 HD23 ' CD1' ' A' ' 58' ' ' PHE . 0.0 OUTLIER 123.1 2.09 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.035 1 O-C-N 132.613 6.196 . . . . 0.0 110.977 178.3 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.462 ' N ' HD13 ' A' ' 37' ' ' LEU . 1.3 m 157.85 -70.34 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.309 1 O-C-N 129.871 4.482 . . . . 0.0 112.675 179.359 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.497 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 0.5 OUTLIER 57.56 101.14 0.02 OUTLIER 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -121.44 75.22 1.16 Allowed 'General case' 0 C--O 1.2 -1.539 1 O-C-N 131.44 5.462 . . . . 0.0 109.712 179.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.411 ' C ' ' HD3' ' A' ' 41' ' ' LYS . 0.1 OUTLIER -56.82 138.0 54.02 Favored 'General case' 0 N--CA 1.49 1.564 1 O-C-N 132.373 6.046 . . . . 0.0 106.823 -179.646 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.531 ' HB ' ' HD3' ' A' ' 53' ' ' LYS . 5.3 mt -136.46 109.1 8.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 O-C-N 127.509 3.005 . . . . 0.0 111.901 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.499 HD11 ' HB2' ' A' ' 45' ' ' GLN 0.262 0.3 OUTLIER -83.97 118.62 31.65 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.672 1 CA-C-N 106.922 -4.672 . . . . 0.0 110.157 -179.432 . . . . . . . . 5 4 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 45' ' ' GLN . 0.9 OUTLIER -95.84 -40.77 11.19 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.485 0 CA-C-N 112.047 -2.342 . . . . 0.0 112.939 -179.143 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.499 ' HB2' HD11 ' A' ' 43' ' ' ILE . 47.3 tt0 18.4 102.7 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.523 0 O-C-N 127.936 3.272 . . . . 0.0 117.617 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -118.86 23.95 11.13 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-N 111.124 -2.762 . . . . 0.0 117.017 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.31 106.01 2.24 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-O 116.601 -2.222 . . . . 0.0 109.904 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 68.37 -68.13 0.18 Allowed 'General case' 0 C--O 1.211 -0.962 0 O-C-N 128.509 3.123 . . . . 0.0 109.454 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.477 ' H ' ' ND2' ' A' ' 49' ' ' ASN . 0.1 OUTLIER -71.63 99.29 2.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 112.833 -3.461 . . . . 0.0 107.58 178.379 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 50' ' ' PHE . 2.3 t80 -122.55 102.88 8.33 Favored 'General case' 0 CA--C 1.484 -1.576 1 O-C-N 130.444 4.84 . . . . 0.0 113.509 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 93.03 3.95 Favored 'General case' 0 C--O 1.194 -1.835 0 O-C-N 128.375 3.547 . . . . 0.0 115.198 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 62' ' ' ASP . 0.3 OUTLIER -69.21 155.19 40.81 Favored 'General case' 0 CA--C 1.499 -0.984 0 O-C-N 127.248 2.842 . . . . 0.0 107.322 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HD3' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -168.58 143.46 3.36 Favored 'General case' 0 CA--C 1.485 -1.52 0 C-N-CA 115.843 -2.343 . . . . 0.0 112.551 -179.712 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.7 t -90.1 175.06 7.3 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 112.905 -1.952 . . . . 0.0 108.218 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -138.85 23.58 2.62 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.657 ' CB ' HD11 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -36.48 -64.88 0.31 Allowed 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.572 5.545 . . . . 0.0 110.187 179.969 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.414 ' HB ' ' O ' ' A' ' 56' ' ' SER . 1.4 t 118.62 -36.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 O-C-N 130.076 4.61 . . . . 0.0 103.02 -179.747 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.75 ' CD1' HD23 ' A' ' 37' ' ' LEU . 2.2 m-85 -58.55 -64.83 0.79 Allowed 'General case' 0 C--O 1.241 0.632 0 O-C-N 126.849 2.593 . . . . 0.0 110.987 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.79 106.76 4.14 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 127.788 3.18 . . . . 0.0 110.291 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -99.4 64.92 1.36 Allowed 'General case' 0 C--O 1.21 -0.992 1 O-C-N 129.286 4.116 . . . . 0.0 107.508 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.76 77.89 1.74 Allowed 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 128.957 3.911 . . . . 0.0 108.692 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB3' HG22 ' A' ' 52' ' ' THR . 0.2 OUTLIER -101.83 -65.73 0.96 Allowed 'General case' 0 C--O 1.204 -1.331 0 O-C-N 126.632 2.457 . . . . 0.0 114.232 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.5 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 0.5 OUTLIER -149.41 103.86 3.33 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.916 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.442 ' C ' ' CD1' ' A' ' 65' ' ' PHE . 8.2 p-10 -126.23 70.76 1.24 Allowed 'General case' 0 CA--C 1.499 -1.018 0 C-N-CA 118.158 -1.417 . . . . 0.0 110.597 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.5 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -134.84 160.83 36.97 Favored 'General case' 0 C--N 1.353 0.743 1 CA-C-O 129.205 4.336 . . . . 0.0 111.02 179.842 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.429 HG22 HG23 ' A' ' 69' ' ' VAL . 1.2 m -107.77 102.44 11.66 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 109.454 -3.521 . . . . 0.0 102.862 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.525 HG11 ' CD1' ' A' ' 89' ' ' TRP . 14.1 t -33.52 129.39 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.489 -1.379 1 O-C-N 129.568 4.293 . . . . 0.0 115.97 -179.258 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.61 -18.39 56.58 Favored Glycine 0 N--CA 1.481 1.638 0 CA-C-N 111.517 -2.583 . . . . 0.0 112.968 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 69' ' ' VAL . 97.2 t -88.38 79.03 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 119.136 -1.025 . . . . 0.0 109.486 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.777 ' HG3' HD12 ' A' ' 86' ' ' LEU . 4.8 tt0 -38.04 105.45 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.501 2 O-C-N 132.871 6.357 . . . . 0.0 110.611 179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.491 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -64.86 92.5 0.1 Allowed 'General case' 0 CA--C 1.51 -0.569 0 O-C-N 129.043 3.964 . . . . 0.0 114.314 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -58.22 70.77 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 0 O-C-N 126.656 2.473 . . . . 0.0 113.125 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.598 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 13.9 mt-10 54.51 -165.79 0.09 Allowed 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 123.274 1.511 . . . . 0.0 110.688 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 72.84 86.31 0.11 Allowed 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 110.307 -3.133 . . . . 0.0 114.513 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.455 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 14.4 p -94.98 -70.88 0.69 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.4 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.455 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 43.54 140.62 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.954 2 O-C-N 130.218 4.699 . . . . 0.0 116.781 179.666 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.02 -15.77 61.1 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.644 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.497 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 8.2 tp -153.1 53.24 0.75 Allowed 'General case' 0 C--N 1.347 0.459 0 O-C-N 128.994 3.408 . . . . 0.0 116.028 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.5 t0 141.63 -67.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 O-C-N 128.568 3.667 . . . . 0.0 110.22 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.05 82.6 0.32 Allowed Glycine 0 C--O 1.213 -1.185 0 CA-C-N 110.073 -3.239 . . . . 0.0 110.557 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.97 -125.36 0.14 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 108.512 -3.844 . . . . 0.0 113.803 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER 178.68 93.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 120.455 1.48 . . . . 0.0 107.476 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.46 HG13 ' N ' ' A' ' 99' ' ' LYS . 68.0 t -128.88 151.6 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 O-C-N 127.8 3.187 . . . . 0.0 118.445 -178.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.492 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.3 OUTLIER -78.24 95.65 5.04 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.064 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.491 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 76.7 m -99.84 81.74 2.49 Favored 'General case' 0 C--O 1.202 -1.439 0 CA-C-N 109.41 -3.541 . . . . 0.0 116.566 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.777 HD12 ' HG3' ' A' ' 70' ' ' GLU . 0.6 OUTLIER -82.12 141.93 32.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 108.684 -3.871 . . . . 0.0 113.437 179.853 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.426 HG21 ' CD2' ' A' ' 65' ' ' PHE . 39.1 t -131.02 131.37 64.07 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 125.699 1.6 . . . . 0.0 108.673 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.441 HG22 ' N ' ' A' ' 89' ' ' TRP 0.261 99.2 m -156.42 170.73 21.64 Favored 'General case' 0 CA--C 1.476 -1.89 0 CA-C-N 113.02 -1.9 . . . . 0.0 111.412 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.68 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 31.1 m95 -100.37 143.54 30.43 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 129.134 2.973 . . . . 0.0 106.61 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.538 ' CG ' HG21 ' A' ' 95' ' ' VAL . 0.9 OUTLIER -99.07 -12.49 20.49 Favored 'General case' 0 CA--C 1.477 -1.852 0 CA-C-O 127.237 3.399 . . . . 0.0 113.286 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 128.31 -29.61 4.04 Favored Glycine 0 C--O 1.196 -2.264 0 CA-C-N 109.961 -3.29 . . . . 0.0 105.226 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -150.11 24.15 0.83 Allowed 'General case' 0 N--CA 1.434 -1.257 1 O-C-N 130.041 4.024 . . . . 0.0 111.841 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.507 HG22 ' CB ' ' A' ' 90' ' ' GLU . 5.3 t -174.01 163.48 4.01 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.562 2.43 . . . . 0.0 117.562 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.436 ' N ' ' OG1' ' A' ' 93' ' ' THR . 1.1 tp -92.99 98.41 11.33 Favored 'General case' 0 C--O 1.209 -1.046 0 CA-C-O 125.332 2.491 . . . . 0.0 114.343 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.538 HG21 ' CG ' ' A' ' 90' ' ' GLU 0.271 90.6 t -100.0 112.2 31.83 Favored 'Isoleucine or valine' 0 C--N 1.363 1.159 0 CA-C-N 110.406 -3.088 . . . . 0.0 112.623 179.672 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.416 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -139.42 150.04 44.78 Favored 'General case' 0 C--O 1.196 -1.726 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.36 139.48 43.66 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 128.102 3.376 . . . . 0.0 114.489 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.524 ' CD ' ' HB3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -111.07 107.69 17.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.328 1.851 . . . . 0.0 107.266 179.065 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.46 ' N ' HG13 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.69 98.92 3.5 Favored 'General case' 0 C--O 1.201 -1.464 0 C-N-CA 115.203 -2.599 . . . . 0.0 112.797 -179.329 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -165.92 57.36 0.25 Allowed Glycine 0 C--O 1.212 -1.239 0 CA-C-O 124.428 2.127 . . . . 0.0 111.95 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 62.3 145.65 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.188 1 CA-C-N 106.365 -4.918 . . . . 0.0 113.916 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.406 ' C ' ' HD3' ' A' ' 102' ' ' LYS . 0.3 OUTLIER 99.17 -49.71 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 110.94 -2.846 . . . . 0.0 116.348 179.357 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -156.11 -177.87 6.9 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 108.46 -3.973 . . . . 0.0 114.899 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -128.22 88.63 2.78 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 113.633 -3.079 . . . . 0.0 104.107 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.651 ' NH1' HD22 ' A' ' 24' ' ' LEU . 10.3 mmm-85 -68.59 -9.27 48.6 Favored 'General case' 0 C--O 1.201 -1.468 1 O-C-N 130.508 4.88 . . . . 0.0 113.345 179.419 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.435 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -33.43 114.85 0.11 Allowed Glycine 0 C--N 1.352 1.441 1 O-C-N 130.483 4.864 . . . . 0.0 116.983 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.416 ' CZ2' ' SG ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -123.1 142.34 50.99 Favored 'General case' 0 C--N 1.32 -0.693 1 O-C-N 132.051 5.207 . . . . 0.0 109.878 178.738 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -165.27 170.85 14.29 Favored 'General case' 0 CA--C 1.505 -0.786 1 O-C-N 129.442 4.214 . . . . 0.0 112.697 -179.292 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.453 ' C ' ' CG ' ' A' ' 110' ' ' TRP . 3.9 mp0 -132.71 -178.35 4.9 Favored 'General case' 0 C--N 1.365 1.265 0 C-N-CA 115.989 -2.284 . . . . 0.0 108.616 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.453 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.0 OUTLIER -159.67 15.75 0.15 Allowed 'General case' 0 CA--C 1.501 -0.925 1 O-C-N 129.279 4.112 . . . . 0.0 118.063 -179.823 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.3 t 39.87 71.13 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.628 0 CA-C-O 125.821 2.724 . . . . 0.0 115.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.439 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 2.8 mm-40 -97.02 84.8 3.6 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-O 125.924 2.773 . . . . 0.0 117.308 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.58 87.79 0.01 OUTLIER Glycine 0 C--O 1.197 -2.206 0 O-C-N 119.048 -2.283 . . . . 0.0 117.347 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 41.16 51.79 3.44 Favored 'General case' 0 CA--C 1.501 -0.936 0 C-N-CA 128.576 2.75 . . . . 0.0 118.39 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 6.4 pttt 177.14 146.12 0.1 Allowed 'General case' 0 C--N 1.32 -0.713 0 O-C-N 129.057 3.973 . . . . 0.0 109.982 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.406 HD13 ' CH2' ' A' ' 9' ' ' TRP . 4.9 mp -105.3 104.56 14.32 Favored 'General case' 0 C--O 1.199 -1.563 0 O-C-N 128.308 3.505 . . . . 0.0 118.605 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.479 ' HE1' HG13 ' A' ' 130' ' ' VAL . 6.8 m-30 -70.2 93.27 0.82 Allowed 'General case' 0 C--O 1.203 -1.369 0 O-C-N 127.988 3.305 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.811 HD12 ' CZ ' ' A' ' 131' ' ' PHE . 1.2 mt -82.73 69.4 9.51 Favored 'General case' 0 C--N 1.346 0.449 1 CA-C-N 108.356 -4.02 . . . . 0.0 107.338 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -73.88 111.01 8.62 Favored 'General case' 0 CA--C 1.501 -0.938 1 O-C-N 129.316 4.135 . . . . 0.0 110.26 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.44 160.13 23.73 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 126.821 2.576 . . . . 0.0 113.46 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.23 160.4 36.25 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 127.006 2.691 . . . . 0.0 105.175 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.429 ' HB3' ' CD ' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -163.95 70.57 0.21 Allowed 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 125.197 2.427 . . . . 0.0 110.952 -179.647 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.2 -57.59 0.44 Allowed Glycine 0 CA--C 1.525 0.708 0 CA-C-N 111.76 -2.473 . . . . 0.0 108.769 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.8 t0 166.8 53.05 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 125.933 1.693 . . . . 0.0 106.549 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -119.8 10.23 11.57 Favored 'General case' 0 N--CA 1.475 0.776 1 O-C-N 129.259 4.099 . . . . 0.0 109.06 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 126' ' ' VAL . 12.6 p 4.39 72.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.967 1 O-C-N 130.082 4.614 . . . . 0.0 116.761 179.914 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 64.1 m -64.33 133.44 52.67 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 119.744 -1.847 . . . . 0.0 112.019 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.28 93.32 4.43 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 128.241 3.463 . . . . 0.0 113.701 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -84.54 157.07 21.38 Favored 'General case' 0 CA--C 1.499 -1.001 0 C-N-CA 116.12 -2.232 . . . . 0.0 115.311 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.479 HG13 ' HE1' ' A' ' 117' ' ' TYR . 74.3 t -140.43 123.54 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 126.482 3.039 . . . . 0.0 106.958 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.811 ' CZ ' HD12 ' A' ' 118' ' ' LEU . 4.3 m-85 -100.74 -177.75 3.57 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 110.226 -3.17 . . . . 0.0 115.82 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.464 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.257 0.0 OUTLIER -157.89 124.29 4.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 110.751 -2.931 . . . . 0.0 103.885 179.895 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.518 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 30.6 tttt -75.66 113.77 13.48 Favored 'General case' 0 C--O 1.198 -1.643 1 O-C-N 129.147 4.029 . . . . 0.0 112.406 179.609 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt . . . . . 0 CA--C 1.498 -1.039 0 N-CA-C 116.547 2.055 . . . . 0.0 116.547 -179.968 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 89' ' ' TRP . 9.4 mttm . . . . . 0 CA--C 1.504 -0.822 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.752 ' HA ' HG21 ' A' ' 111' ' ' VAL . 83.8 m-20 -80.52 -97.32 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 102.704 -3.073 . . . . 0.0 102.704 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -175.28 -94.18 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 113.506 -3.14 . . . . 0.0 107.692 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 158.25 112.83 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.018 1 O-C-N 130.116 4.635 . . . . 0.0 111.771 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 177.65 -141.17 5.1 Favored Glycine 0 C--O 1.209 -1.456 0 CA-C-O 117.057 -1.968 . . . . 0.0 114.967 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.728 HG23 ' CG1' ' A' ' 42' ' ' ILE . 63.2 m -147.31 148.86 31.83 Favored 'General case' 0 C--O 1.215 -0.715 1 O-C-N 130.193 4.114 . . . . 0.0 104.003 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.536 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.258 0.0 OUTLIER -139.26 118.06 12.38 Favored 'General case' 0 CA--C 1.508 -0.65 1 O-C-N 130.128 4.642 . . . . 0.0 111.594 -179.112 . . . . . . . . 5 4 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.94 -6.29 32.0 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 126.891 2.62 . . . . 0.0 115.581 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.421 ' O ' ' HA ' ' A' ' 131' ' ' PHE . 1.9 ttm 83.56 -79.91 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 112.857 -3.449 . . . . 0.0 107.219 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 11' ' ' MET . 0.5 OUTLIER 123.8 -28.23 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.069 0 O-C-N 128.875 3.859 . . . . 0.0 106.62 -179.236 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.288 3.1 p 164.18 160.97 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 110.872 -2.876 . . . . 0.0 110.182 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -121.67 136.23 54.95 Favored 'General case' 0 CA--C 1.486 -1.514 0 O-C-N 128.55 3.656 . . . . 0.0 115.96 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -87.45 -137.38 0.09 Allowed 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 110.902 -2.863 . . . . 0.0 111.279 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -41.34 95.81 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.186 0 C-N-CA 124.37 1.068 . . . . 0.0 113.077 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -111.07 -36.92 5.5 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-O 126.646 3.117 . . . . 0.0 110.454 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.47 ' HG3' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.04 -29.39 60.77 Favored 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 119.758 -1.838 . . . . 0.0 115.455 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.47 ' N ' ' HG3' ' A' ' 18' ' ' GLU . . . -78.29 -23.78 64.89 Favored Glycine 0 N--CA 1.485 1.909 0 O-C-N 127.723 3.14 . . . . 0.0 109.194 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -71.79 -20.37 61.87 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 123.747 1.737 . . . . 0.0 107.966 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.503 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -78.52 -34.68 47.08 Favored 'General case' 0 CA--C 1.488 -1.417 0 C-N-CA 116.705 -1.998 . . . . 0.0 109.237 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.412 ' HD3' ' HB3' ' A' ' 28' ' ' PHE . 2.7 mtmt -71.61 -27.74 63.32 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-N 109.668 -3.424 . . . . 0.0 115.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.661 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -66.87 -31.64 72.38 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 108.764 -3.835 . . . . 0.0 111.369 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.746 HD23 ' N ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -93.36 -24.61 18.04 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 128.462 3.601 . . . . 0.0 107.579 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t0 65.7 74.88 0.36 Allowed 'General case' 0 C--O 1.2 -1.534 1 O-C-N 129.4 4.188 . . . . 0.0 105.38 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.722 HD12 HD12 ' A' ' 78' ' ' LEU . 2.1 tt -104.64 -54.88 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 CA-C-N 109.426 -3.534 . . . . 0.0 115.316 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.432 ' N ' HG23 ' A' ' 26' ' ' ILE . 1.4 t0 -167.2 32.44 0.03 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 115.138 -2.363 . . . . 0.0 113.874 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.418 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -16.99 129.35 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 O-C-N 127.975 3.297 . . . . 0.0 117.916 179.568 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 92.91 66.53 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 127.66 3.1 . . . . 0.0 107.745 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -119.69 -47.5 2.42 Favored 'General case' 0 C--O 1.218 -0.598 2 CA-C-N 105.576 -5.284 . . . . 0.0 112.949 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.51 113.51 0.46 Allowed 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 129.691 4.369 . . . . 0.0 107.805 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttt 179.62 -47.76 0.01 OUTLIER 'General case' 0 CA--C 1.491 -1.319 0 O-C-N 127.892 3.245 . . . . 0.0 110.23 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.702 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.2 OUTLIER -124.11 -11.18 6.54 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.241 0 O-C-N 126.987 2.68 . . . . 0.0 112.894 -179.831 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -101.61 19.09 18.69 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-O 124.071 1.891 . . . . 0.0 112.091 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.4 t -49.27 -37.34 10.36 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.374 0 CA-C-N 109.519 -3.491 . . . . 0.0 109.386 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.766 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -171.38 151.01 2.97 Favored 'General case' 0 C--O 1.21 -0.991 1 CA-C-N 106.42 -4.9 . . . . 0.0 112.123 179.833 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.112 HD11 ' CE1' ' A' ' 58' ' ' PHE . 2.5 pt? 153.99 -19.12 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.991 2 O-C-N 134.88 7.613 . . . . 0.0 106.282 177.026 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.51 ' HA ' ' HB2' ' A' ' 56' ' ' SER . 16.1 m -46.36 -29.46 1.69 Allowed 'General case' 0 N--CA 1.485 1.281 1 O-C-N 132.269 5.981 . . . . 0.0 109.455 175.231 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.557 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.0 OUTLIER 42.57 -171.66 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 118.556 2.798 . . . . 0.0 118.556 179.313 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.557 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 57.5 m -20.13 90.99 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 131.575 3.95 . . . . 0.0 115.522 178.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.534 ' HE3' ' CD1' ' A' ' 9' ' ' TRP 0.262 0.0 OUTLIER -75.33 161.28 29.42 Favored 'General case' 0 N--CA 1.492 1.631 1 O-C-N 129.414 4.196 . . . . 0.0 101.889 178.94 . . . . . . . . 5 4 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.728 ' CG1' HG23 ' A' ' 8' ' ' THR . 11.6 mt -137.72 164.34 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.282 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.482 ' N ' HG22 ' A' ' 42' ' ' ILE . 5.8 tt -140.02 150.02 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.485 0 O-C-N 127.489 2.993 . . . . 0.0 108.932 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.3 t -130.62 -46.67 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 C-N-CA 115.014 -2.674 . . . . 0.0 115.973 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.428 ' HB3' ' CD2' ' A' ' 50' ' ' PHE . 2.5 pp0? 32.47 101.53 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 126.052 2.834 . . . . 0.0 115.205 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.18 51.88 1.75 Allowed 'General case' 0 CA--C 1.494 -1.179 0 CA-C-N 110.465 -3.061 . . . . 0.0 114.021 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.06 98.28 0.01 OUTLIER Glycine 0 N--CA 1.475 1.267 0 CA-C-N 115.349 -0.841 . . . . 0.0 115.028 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.518 ' O ' HG23 ' A' ' 67' ' ' VAL . 0.2 OUTLIER 84.16 -60.49 0.11 Allowed 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 127.645 2.615 . . . . 0.0 110.935 -179.649 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.37 124.45 33.4 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 128.541 3.651 . . . . 0.0 107.755 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.654 ' CD1' ' CZ ' ' A' ' 65' ' ' PHE . 3.3 t80 -125.12 138.37 54.17 Favored 'General case' 0 CA--C 1.484 -1.583 1 O-C-N 131.059 5.224 . . . . 0.0 117.796 -178.56 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.408 ' HD3' ' HB3' ' A' ' 64' ' ' ASP . 54.0 mttt -145.15 100.32 3.45 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 178.137 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.577 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -84.52 160.66 20.46 Favored 'General case' 0 N--CA 1.473 0.694 1 O-C-N 129.568 4.292 . . . . 0.0 106.251 177.176 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.551 ' HG2' HD12 ' A' ' 42' ' ' ILE . 20.1 tttt -158.91 137.72 11.1 Favored 'General case' 0 CA--C 1.481 -1.696 0 C-N-CA 114.119 -3.032 . . . . 0.0 112.327 -177.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.569 HG22 ' HB3' ' A' ' 56' ' ' SER . 0.9 OUTLIER -86.94 123.39 32.0 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 110.343 -3.117 . . . . 0.0 108.877 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.436 ' O ' ' NE2' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -102.41 11.59 37.79 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 113.849 -2.977 . . . . 0.0 114.883 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.569 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.6 p -39.6 173.31 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.695 1 O-C-N 133.288 6.617 . . . . 0.0 112.385 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.72 6.08 25.37 Favored 'General case' 0 N--CA 1.48 1.031 1 CA-C-N 107.16 -4.564 . . . . 0.0 102.801 178.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 1.112 ' CE1' HD11 ' A' ' 37' ' ' LEU . 2.6 m-30 -121.57 -78.81 0.6 Allowed 'General case' 0 C--N 1.357 0.905 0 O-C-N 126.831 2.582 . . . . 0.0 116.659 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.459 ' NH1' HD22 ' A' ' 78' ' ' LEU . 5.2 mtt180 -106.85 123.55 48.32 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 109.073 -3.694 . . . . 0.0 116.143 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.37 62.35 1.52 Allowed 'General case' 0 C--O 1.198 -1.62 1 O-C-N 129.76 4.412 . . . . 0.0 105.792 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -95.75 16.29 17.87 Favored 'General case' 0 N--CA 1.448 -0.553 2 O-C-N 131.458 5.474 . . . . 0.0 111.271 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 1.89 126.42 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.131 1 O-C-N 133.076 6.485 . . . . 0.0 117.156 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.806 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 4.2 tp -78.17 61.81 2.76 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.751 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.408 ' HB3' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -101.37 101.12 11.7 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 126.354 2.284 . . . . 0.0 111.112 -179.788 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.785 ' CD2' HG21 ' A' ' 87' ' ' VAL . 17.2 p90 -133.29 -152.38 0.49 Allowed 'General case' 0 CA--C 1.486 -1.5 0 CA-C-O 124.991 2.329 . . . . 0.0 107.527 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.625 HG22 ' HB ' ' A' ' 69' ' ' VAL . 0.9 OUTLIER -159.08 141.47 13.95 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 118.408 -2.683 . . . . 0.0 104.582 -179.759 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.838 HG11 ' CD1' ' A' ' 89' ' ' TRP . 2.5 t -65.25 131.24 31.05 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.836 0 O-C-N 128.771 3.794 . . . . 0.0 115.823 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 61.92 24.73 65.09 Favored Glycine 0 N--CA 1.474 1.18 0 CA-C-N 112.188 -2.278 . . . . 0.0 116.398 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.625 ' HB ' HG22 ' A' ' 66' ' ' THR 0.316 1.8 p -93.77 -16.5 7.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 O-C-N 126.013 1.655 . . . . 0.0 110.918 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 72.88 107.37 0.07 Allowed 'General case' 0 C--N 1.355 0.814 1 O-C-N 129.405 4.19 . . . . 0.0 108.195 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.595 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.7 t80 -97.71 31.63 2.56 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 128.11 3.382 . . . . 0.0 113.649 -178.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -16.8 103.08 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.3 0 C-N-CA 127.245 2.218 . . . . 0.0 116.416 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.409 ' HG3' ' CB ' ' A' ' 82' ' ' ASN . 2.7 tt0 69.92 -168.58 0.17 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-O 124.533 2.111 . . . . 0.0 112.254 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 82.39 85.83 0.04 OUTLIER 'General case' 0 C--O 1.21 -1.002 0 CA-C-O 125.6 2.619 . . . . 0.0 116.798 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.252 0.6 OUTLIER -114.96 -52.11 2.71 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 110.525 -3.034 . . . . 0.0 111.99 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.8 pttt -27.18 111.72 0.05 OUTLIER 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 128.633 3.708 . . . . 0.0 115.302 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 155.41 -33.97 0.64 Allowed Glycine 0 C--O 1.212 -1.223 0 CA-C-N 110.993 -2.821 . . . . 0.0 112.624 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.722 HD12 HD12 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -115.02 -52.04 2.7 Favored 'General case' 0 N--CA 1.474 0.747 1 CA-C-N 106.896 -4.652 . . . . 0.0 115.587 -179.866 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.601 ' HB2' HD13 ' A' ' 24' ' ' LEU . 58.6 t0 -109.84 -60.33 1.8 Allowed 'General case' 0 C--O 1.215 -0.756 0 O-C-N 120.035 -1.666 . . . . 0.0 112.85 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.02 75.05 1.22 Allowed Glycine 0 N--CA 1.477 1.403 0 CA-C-O 126.336 3.187 . . . . 0.0 110.7 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -142.0 -130.2 0.1 Allowed 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 108.807 -3.697 . . . . 0.0 113.2 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.409 ' CB ' ' HG3' ' A' ' 73' ' ' GLU . 0.7 OUTLIER -176.3 111.39 0.1 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 120.006 1.276 . . . . 0.0 110.931 -179.865 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.492 HG22 ' HA3' ' A' ' 100' ' ' GLY . 58.8 t -137.59 144.58 31.01 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.174 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -35.77 -75.94 0.03 OUTLIER 'General case' 0 CA--C 1.507 -0.703 1 O-C-N 130.108 4.63 . . . . 0.0 110.69 -179.589 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.595 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 7.7 m 71.23 61.56 0.17 Allowed 'General case' 0 CA--C 1.497 -1.067 0 C-N-CA 128.758 2.823 . . . . 0.0 112.878 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 1.4 tp -82.23 136.38 35.1 Favored 'General case' 0 N--CA 1.43 -1.459 1 CA-C-N 107.723 -4.308 . . . . 0.0 110.44 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.785 HG21 ' CD2' ' A' ' 65' ' ' PHE . 47.8 t -108.83 147.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 125.244 1.418 . . . . 0.0 108.449 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.259 53.3 m -161.12 152.35 18.85 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 111.419 -2.628 . . . . 0.0 112.07 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.838 ' CD1' HG11 ' A' ' 67' ' ' VAL 0.268 19.1 m95 -92.47 121.97 34.45 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 127.341 2.256 . . . . 0.0 105.043 179.738 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HB2' HG23 ' A' ' 95' ' ' VAL . 3.4 tt0 -88.22 -148.75 0.16 Allowed 'General case' 0 CA--C 1.477 -1.864 0 CA-C-O 126.381 2.991 . . . . 0.0 112.189 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -42.22 95.86 Favored Glycine 0 N--CA 1.488 2.119 0 N-CA-C 103.342 -3.903 . . . . 0.0 103.342 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -169.8 67.35 0.05 Allowed 'General case' 0 C--O 1.21 -1.008 1 O-C-N 130.04 4.023 . . . . 0.0 110.809 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.42 ' O ' ' CE3' ' A' ' 89' ' ' TRP . 1.7 t 176.15 169.9 0.42 Allowed 'General case' 0 C--O 1.2 -1.549 0 N-CA-C 117.19 2.293 . . . . 0.0 117.19 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.589 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -96.8 94.22 7.14 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 129.103 2.961 . . . . 0.0 113.921 179.364 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.408 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.319 50.5 t -103.75 141.28 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.898 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 179.776 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.1 OUTLIER -143.81 127.77 17.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 125.433 1.708 . . . . 0.0 107.705 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.425 HG22 ' H ' ' A' ' 97' ' ' VAL . 35.4 m -104.63 98.8 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.442 0 CA-C-O 127.234 3.397 . . . . 0.0 118.437 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.47 ' CB ' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -73.75 92.24 1.99 Allowed 'General case' 0 C--N 1.355 0.826 0 O-C-N 117.594 -3.191 . . . . 0.0 109.045 179.683 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.424 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.5 OUTLIER -97.41 87.29 4.09 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 108.649 -3.887 . . . . 0.0 111.403 -179.761 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.492 ' HA3' HG22 ' A' ' 83' ' ' VAL . . . -145.59 91.83 0.16 Allowed Glycine 0 C--O 1.211 -1.306 0 C-N-CA 117.16 -2.448 . . . . 0.0 113.571 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 49.63 -70.78 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 110.712 -2.744 . . . . 0.0 115.401 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.431 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -100.45 -73.44 0.64 Allowed 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -179.004 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -48.78 160.21 0.2 Allowed 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -128.84 76.91 1.75 Allowed 'General case' 0 N--CA 1.491 1.599 2 O-C-N 131.759 5.662 . . . . 0.0 102.344 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.406 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 13.7 mmm-85 -87.13 -3.7 59.08 Favored 'General case' 0 C--O 1.212 -0.901 0 O-C-N 127.637 3.086 . . . . 0.0 114.383 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -34.86 86.21 0.01 OUTLIER Glycine 0 CA--C 1.535 1.322 2 CA-C-N 105.796 -5.184 . . . . 0.0 117.24 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.806 ' CZ2' HD21 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -84.66 132.44 34.47 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 127.275 2.397 . . . . 0.0 110.289 178.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.422 ' C ' ' NE2' ' A' ' 109' ' ' GLN . 0.3 OUTLIER -159.78 168.87 24.87 Favored 'General case' 0 C--O 1.2 -1.511 1 O-C-N 129.403 4.189 . . . . 0.0 118.458 -179.558 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.55 ' HB3' HD21 ' A' ' 116' ' ' LEU . 8.8 mm-40 -128.78 169.61 14.33 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 110.152 -3.204 . . . . 0.0 110.125 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.445 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.2 OUTLIER -166.46 14.39 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.074 1 O-C-N 129.351 4.157 . . . . 0.0 118.565 179.263 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.752 HG21 ' HA ' ' A' ' 4' ' ' ASP . 25.4 t 29.86 105.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.475 -1.912 0 CA-C-O 127.72 3.628 . . . . 0.0 119.673 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -123.05 49.64 1.63 Allowed 'General case' 0 N--CA 1.484 1.271 0 O-C-N 118.479 -2.638 . . . . 0.0 114.033 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.33 -132.82 6.38 Favored Glycine 0 C--O 1.202 -1.854 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.429 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.94 38.59 1.61 Allowed 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 127.677 2.391 . . . . 0.0 114.113 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.451 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 54.9 pttt -168.2 162.17 12.7 Favored 'General case' 0 CA--C 1.515 -0.384 1 O-C-N 130.747 5.029 . . . . 0.0 110.129 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.59 HD12 HG22 ' A' ' 111' ' ' VAL . 1.4 tt -118.8 104.59 10.71 Favored 'General case' 0 C--O 1.207 -1.165 0 O-C-N 126.285 2.241 . . . . 0.0 114.371 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -57.94 110.35 0.9 Allowed 'General case' 0 C--O 1.201 -1.491 1 O-C-N 129.554 4.283 . . . . 0.0 115.343 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -98.37 71.52 2.05 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 127.803 3.19 . . . . 0.0 106.533 179.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.445 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.3 mt-10 -83.5 105.58 14.55 Favored 'General case' 0 CA--C 1.484 -1.564 1 O-C-N 130.294 4.746 . . . . 0.0 112.277 -179.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.772 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -109.15 155.57 20.87 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 114.151 -1.386 . . . . 0.0 108.376 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.772 ' O ' HD12 ' A' ' 120' ' ' LEU . 1.9 m -109.9 161.48 15.44 Favored 'General case' 0 CA--C 1.489 -1.391 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.661 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -161.45 72.39 0.41 Allowed 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 121.259 1.845 . . . . 0.0 115.008 -179.957 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 34.6 67.1 0.28 Allowed Glycine 0 N--CA 1.435 -1.374 0 C-N-CA 126.397 1.951 . . . . 0.0 114.557 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 119.43 -56.15 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.342 0 O-C-N 128.888 3.346 . . . . 0.0 109.85 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.429 ' C ' HG23 ' A' ' 126' ' ' VAL . 32.2 mm-40 -75.44 162.13 28.61 Favored 'General case' 0 C--N 1.352 0.683 0 O-C-N 127.972 3.295 . . . . 0.0 107.627 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.429 HG23 ' C ' ' A' ' 125' ' ' GLN . 7.7 t -146.18 82.7 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 CA-C-N 109.214 -3.63 . . . . 0.0 113.335 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 38.8 t -51.26 144.53 9.46 Favored 'General case' 0 CA--C 1.504 -0.805 0 O-C-N 124.644 1.215 . . . . 0.0 109.614 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -135.39 63.79 1.6 Allowed 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 116.953 -1.498 . . . . 0.0 113.215 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -48.18 168.07 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.727 1 O-C-N 129.767 4.417 . . . . 0.0 115.484 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.35 120.73 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 102.71 -3.071 . . . . 0.0 102.71 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 30.8 m-85 -102.12 178.87 4.48 Favored 'General case' 0 CA--C 1.475 -1.934 0 CA-C-O 127.098 3.332 . . . . 0.0 118.538 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.451 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.1 OUTLIER -168.85 117.78 0.69 Allowed 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 110.593 -3.003 . . . . 0.0 108.947 -179.55 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.465 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 28.2 ttpt -59.38 108.07 0.66 Allowed 'General case' 0 CA--C 1.488 -1.421 0 O-C-N 128.104 3.377 . . . . 0.0 116.156 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.501 -0.91 0 CA-C-O 114.786 -2.53 . . . . 0.0 113.489 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.551 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 0.5 OUTLIER . . . . . 0 CA--C 1.498 -1.056 0 N-CA-C 119.32 3.081 . . . . 0.0 119.32 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.32 122.2 27.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -134.05 31.38 3.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 113.744 -3.026 . . . . 0.0 108.621 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.438 ' HA ' HG23 ' A' ' 43' ' ' ILE . 2.4 m120 -24.41 128.16 0.03 OUTLIER 'General case' 0 C--O 1.236 0.381 1 O-C-N 130.136 4.648 . . . . 0.0 110.63 179.568 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 42' ' ' ILE . . . -175.37 -118.15 0.51 Allowed Glycine 0 C--O 1.221 -0.693 0 C-N-CA 115.746 -3.121 . . . . 0.0 114.511 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.565 ' CG2' HG23 ' A' ' 40' ' ' THR . 98.4 m 177.67 144.54 0.11 Allowed 'General case' 0 N--CA 1.476 0.85 1 O-C-N 132.504 5.473 . . . . 0.0 106.018 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.56 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -144.5 90.07 2.06 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -179.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -57.69 100.75 0.06 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 128.493 3.621 . . . . 0.0 106.779 179.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.403 ' O ' ' CB ' ' A' ' 12' ' ' GLU . 32.2 ttm -32.61 -59.89 0.31 Allowed 'General case' 0 N--CA 1.479 0.99 0 O-C-N 129.099 4.0 . . . . 0.0 109.611 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.403 ' CB ' ' O ' ' A' ' 11' ' ' MET . 1.9 tt0 98.58 -44.54 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.012 0 O-C-N 125.946 2.029 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.25 15.7 m -174.62 149.41 1.25 Allowed 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 110.015 -3.266 . . . . 0.0 113.711 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -125.38 139.62 53.51 Favored 'General case' 0 C--O 1.213 -0.867 2 O-C-N 129.816 4.447 . . . . 0.0 110.495 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -71.08 -95.53 0.01 OUTLIER 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 109.375 -3.557 . . . . 0.0 111.31 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 5.1 p30 -83.94 147.18 27.62 Favored 'General case' 0 C--O 1.204 -1.297 0 O-C-N 119.225 -2.172 . . . . 0.0 109.004 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -116.8 -68.39 0.92 Allowed 'General case' 0 C--O 1.204 -1.316 0 O-C-N 127.041 2.713 . . . . 0.0 111.263 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 -46.73 87.01 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 117.747 2.499 . . . . 0.0 117.747 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.495 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.18 -25.36 25.11 Favored Glycine 0 CA--C 1.491 -1.415 0 O-C-N 128.786 3.804 . . . . 0.0 113.308 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.506 ' CD1' ' C ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -75.14 -43.18 54.05 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 104.734 -2.321 . . . . 0.0 104.734 179.399 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.407 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -72.12 -21.54 61.46 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 116.487 -2.085 . . . . 0.0 112.302 -179.728 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.495 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 1.3 ttmt -76.87 -40.92 45.86 Favored 'General case' 0 C--O 1.207 -1.135 0 O-C-N 129.023 3.952 . . . . 0.0 113.084 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.405 ' CB ' ' HB2' ' A' ' 122' ' ' CYS . . . -56.3 -44.38 79.83 Favored 'General case' 0 C--O 1.214 -0.815 0 O-C-N 128.905 3.878 . . . . 0.0 115.222 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.064 HD11 ' HB2' ' A' ' 79' ' ' ASP . 0.1 OUTLIER -88.96 1.6 55.21 Favored 'General case' 0 N--CA 1.491 1.576 2 O-C-N 130.76 5.038 . . . . 0.0 109.177 -178.661 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 50.22 82.92 0.05 OUTLIER 'General case' 0 CA--C 1.48 -1.726 0 CA-C-O 127.83 3.681 . . . . 0.0 114.447 178.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.413 HG21 HD13 ' A' ' 26' ' ' ILE . 2.2 tt -110.8 -33.56 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.632 0 CA-C-N 110.946 -2.843 . . . . 0.0 111.873 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 179.82 127.59 0.08 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.539 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -79.18 12.88 2.08 Favored 'General case' 0 CA--C 1.5 -0.946 0 C-N-CA 116.162 -2.215 . . . . 0.0 116.485 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -172.61 75.05 0.04 OUTLIER 'General case' 0 C--O 1.208 -1.102 0 CA-C-O 123.09 1.424 . . . . 0.0 110.712 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.66 -31.67 6.1 Favored 'General case' 0 C--N 1.353 0.724 2 CA-C-N 106.348 -4.933 . . . . 0.0 115.872 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.418 ' CG ' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -57.04 -164.57 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.963 1 O-C-N 129.654 4.346 . . . . 0.0 112.514 -179.775 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' A' ' 31' ' ' ARG . 14.5 tttm 67.76 39.61 2.63 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 125.658 1.849 . . . . 0.0 108.58 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.502 HG22 ' N ' ' A' ' 34' ' ' ALA . 0.4 OUTLIER -166.0 -49.78 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.93 2 O-C-N 130.095 4.622 . . . . 0.0 111.534 179.934 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.502 ' N ' HG22 ' A' ' 33' ' ' ILE . . . -93.14 18.55 9.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.657 -1.902 . . . . 0.0 113.912 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.6 t -40.31 -36.35 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.278 0 CA-C-O 124.231 1.967 . . . . 0.0 110.372 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.684 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -154.69 153.86 31.99 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 109.831 -3.349 . . . . 0.0 107.687 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.701 HD13 ' CZ ' ' A' ' 58' ' ' PHE . 2.1 pt? 148.79 -18.21 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 2 O-C-N 135.608 8.068 . . . . 0.0 110.811 178.755 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.695 ' HA ' ' HB3' ' A' ' 56' ' ' SER 0.265 0.5 OUTLIER -77.13 51.32 0.81 Allowed 'General case' 0 CA--C 1.48 -1.728 0 C-N-CA 130.547 3.539 . . . . 0.0 119.063 -176.837 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.431 ' HG2' ' N ' ' A' ' 40' ' ' THR . 38.9 tt0 -122.42 144.25 49.16 Favored 'General case' 0 CA--C 1.493 -1.224 0 O-C-N 119.106 -2.246 . . . . 0.0 116.69 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.566 HG22 ' O ' ' A' ' 40' ' ' THR . 99.6 m 97.85 64.5 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.327 0 C-N-CA 130.352 3.461 . . . . 0.0 111.072 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.499 ' C ' ' HD3' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -76.46 150.07 36.73 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 108.406 -3.997 . . . . 0.0 101.93 179.752 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.551 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.3 mt -143.0 158.5 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 125.65 1.844 . . . . 0.0 109.246 179.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.551 ' N ' HG22 ' A' ' 42' ' ' ILE 0.292 18.2 tt -132.95 148.17 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 1 O-C-N 129.399 4.187 . . . . 0.0 111.428 -179.685 . . . . . . . . 4 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 44' ' ' VAL . 77.7 t -154.95 85.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.658 0 CA-C-N 111.93 -2.395 . . . . 0.0 110.066 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.74 84.72 6.3 Favored 'General case' 0 CA--C 1.485 -1.519 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.07 -13.7 59.92 Favored 'General case' 0 C--N 1.364 1.198 0 O-C-N 126.933 2.646 . . . . 0.0 117.985 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 146.33 -103.3 0.27 Allowed Glycine 0 C--O 1.212 -1.273 0 N-CA-C 111.432 -0.667 . . . . 0.0 111.432 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.07 40.24 1.36 Allowed 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 124.58 0.812 . . . . 0.0 110.776 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -176.29 86.39 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 O-C-N 127.048 2.717 . . . . 0.0 109.318 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.515 ' CD1' ' C ' ' A' ' 50' ' ' PHE . 1.8 t80 -99.19 135.12 41.06 Favored 'General case' 0 CA--C 1.486 -1.499 1 O-C-N 131.187 5.304 . . . . 0.0 112.105 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -144.48 90.53 2.1 Favored 'General case' 0 CA--C 1.481 -1.71 0 O-C-N 128.63 3.706 . . . . 0.0 117.421 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.584 ' HB ' HD23 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -70.75 120.06 15.8 Favored 'General case' 0 CA--C 1.501 -0.917 0 O-C-N 128.276 3.485 . . . . 0.0 106.907 179.728 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.53 ' HD2' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.83 146.17 49.4 Favored 'General case' 0 CA--C 1.49 -1.344 0 C-N-CA 117.407 -1.717 . . . . 0.0 107.967 -178.605 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.468 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 5.7 t -105.95 175.18 5.58 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.147 1.529 . . . . 0.0 113.22 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -148.96 37.53 0.79 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.695 ' HB3' ' HA ' ' A' ' 38' ' ' THR . 1.1 p -62.54 142.15 58.11 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 128.513 2.725 . . . . 0.0 108.314 179.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 37' ' ' LEU 0.254 0.1 OUTLIER -39.45 -50.56 2.13 Favored 'General case' 0 N--CA 1.489 1.518 1 O-C-N 130.608 4.942 . . . . 0.0 106.669 -179.952 . . . . . . . . 5 4 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.701 ' CZ ' HD13 ' A' ' 37' ' ' LEU . 12.2 p90 -166.57 76.38 0.19 Allowed 'General case' 0 C--N 1.366 1.318 0 O-C-N 126.967 2.667 . . . . 0.0 115.203 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.62 51.29 0.0 OUTLIER 'General case' 0 C--N 1.363 1.186 1 CA-C-N 107.298 -4.501 . . . . 0.0 111.235 179.788 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.468 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 15.6 m-80 -86.59 107.17 18.03 Favored 'General case' 0 C--O 1.219 -0.543 2 CA-C-N 107.799 -4.273 . . . . 0.0 112.777 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -124.94 98.3 5.63 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 127.943 3.277 . . . . 0.0 106.816 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.63 152.68 41.56 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.495 2.997 . . . . 0.0 115.552 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.584 HD23 ' HB ' ' A' ' 52' ' ' THR . 11.9 tp -117.8 47.17 1.6 Allowed 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 112.95 -1.932 . . . . 0.0 111.456 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -87.1 94.37 9.62 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 124.479 2.085 . . . . 0.0 112.544 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -140.05 -153.01 0.44 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 126.103 1.761 . . . . 0.0 106.528 179.447 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.417 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -151.03 -178.63 6.72 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-O 116.873 -1.537 . . . . 0.0 108.017 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.417 ' N ' ' OG1' ' A' ' 66' ' ' THR . 63.4 t -80.64 119.24 29.81 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.642 1 O-C-N 133.74 6.9 . . . . 0.0 112.597 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.52 9.48 55.42 Favored Glycine 0 N--CA 1.484 1.885 0 CA-C-N 109.451 -3.522 . . . . 0.0 117.447 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.608 HG13 ' N ' ' A' ' 71' ' ' PHE 0.285 14.0 p -59.78 -17.79 13.91 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 O-C-N 124.902 1.001 . . . . 0.0 111.312 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.445 ' HG2' HD12 ' A' ' 86' ' ' LEU . 0.0 OUTLIER 61.61 63.17 1.2 Allowed 'General case' 0 CA--C 1.543 0.681 0 O-C-N 128.546 3.654 . . . . 0.0 107.433 -179.013 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.608 ' N ' HG13 ' A' ' 69' ' ' VAL . 12.0 t80 -64.85 141.46 58.77 Favored 'General case' 0 CA--C 1.494 -1.211 2 CA-C-N 106.33 -4.941 . . . . 0.0 118.954 -178.164 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -100.32 104.15 15.59 Favored 'General case' 0 C--O 1.21 -1.026 0 O-C-N 119.347 -2.096 . . . . 0.0 110.225 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -72.11 74.32 0.93 Allowed 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 125.336 2.493 . . . . 0.0 109.642 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -80.24 116.59 20.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 109.509 -3.496 . . . . 0.0 112.008 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.469 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.2 OUTLIER -157.66 -179.47 8.19 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 114.013 -1.449 . . . . 0.0 113.04 -179.62 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.469 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -150.54 -52.2 0.14 Allowed 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 127.185 3.374 . . . . 0.0 110.43 179.51 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -44.65 -32.88 3.1 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 108.793 -3.821 . . . . 0.0 108.261 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.0 tp -124.05 79.89 1.77 Allowed 'General case' 0 CA--C 1.529 0.165 0 O-C-N 129.22 3.541 . . . . 0.0 115.536 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 1.064 ' HB2' HD11 ' A' ' 24' ' ' LEU . 17.7 t70 85.82 -63.81 0.05 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.807 3.192 . . . . 0.0 110.333 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.83 119.58 2.46 Favored Glycine 0 C--O 1.213 -1.177 0 CA-C-N 109.02 -3.718 . . . . 0.0 115.868 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.02 -123.55 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 O-C-N 126.818 2.128 . . . . 0.0 113.413 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.0 p30 168.8 63.44 0.0 OUTLIER 'General case' 0 C--O 1.197 -1.698 0 CA-C-N 119.923 1.238 . . . . 0.0 112.417 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.782 HG12 ' O ' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -90.84 158.93 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.027 0 CA-C-O 116.418 -1.753 . . . . 0.0 112.717 179.948 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 99' ' ' LYS . 7.8 mmpt? -68.28 169.0 11.29 Favored 'General case' 0 C--N 1.326 -0.44 1 O-C-N 129.392 4.183 . . . . 0.0 107.053 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 85' ' ' THR . 1.2 m -171.32 77.3 0.06 Allowed 'General case' 0 C--O 1.194 -1.823 1 O-C-N 131.11 5.256 . . . . 0.0 111.107 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.445 HD12 ' HG2' ' A' ' 70' ' ' GLU . 2.1 tt -68.38 141.52 55.7 Favored 'General case' 0 N--CA 1.431 -1.398 1 CA-C-N 105.975 -5.102 . . . . 0.0 109.886 179.647 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.1 t -129.91 144.43 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.069 1.347 . . . . 0.0 108.446 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.674 HG23 ' HB ' ' A' ' 95' ' ' VAL . 2.9 t -163.49 177.26 9.0 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 126.378 2.99 . . . . 0.0 110.482 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.658 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 65.3 m95 -102.12 133.99 46.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 128.484 2.714 . . . . 0.0 110.236 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.435 ' HG2' HG21 ' A' ' 95' ' ' VAL . 1.0 OUTLIER -88.1 -37.82 15.91 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-O 131.651 5.501 . . . . 0.0 111.605 179.871 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.08 65.32 0.32 Allowed Glycine 0 N--CA 1.481 1.655 2 CA-C-N 106.429 -4.896 . . . . 0.0 102.226 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.44 ' ND2' ' HB ' ' A' ' 93' ' ' THR . 1.0 OUTLIER 149.26 -36.2 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 132.888 5.699 . . . . 0.0 111.007 -179.87 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.44 ' HB ' ' ND2' ' A' ' 92' ' ' ASN . 0.7 OUTLIER -136.46 174.55 10.5 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 119.19 3.033 . . . . 0.0 119.19 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.87 82.6 2.27 Favored 'General case' 0 CA--C 1.485 -1.548 0 C-N-CA 129.596 3.159 . . . . 0.0 115.766 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.674 ' HB ' HG23 ' A' ' 88' ' ' THR 0.339 97.9 t -77.19 131.53 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-N 108.888 -3.778 . . . . 0.0 113.188 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.546 ' CB ' ' CZ2' ' A' ' 107' ' ' TRP . 0.5 OUTLIER -141.39 134.17 28.77 Favored 'General case' 0 C--O 1.201 -1.449 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -131.63 123.2 51.7 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.107 0 CA-C-N 109.58 -3.463 . . . . 0.0 116.035 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.582 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 1.4 tt0 -85.37 98.67 10.69 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 126.747 3.165 . . . . 0.0 110.382 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.782 ' O ' HG12 ' A' ' 83' ' ' VAL . 7.4 mttm -81.65 158.79 24.17 Favored 'General case' 0 C--O 1.205 -1.251 1 CA-C-N 108.11 -4.132 . . . . 0.0 106.846 -179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.4 138.93 5.85 Favored Glycine 0 C--O 1.211 -1.306 0 O-C-N 126.947 2.654 . . . . 0.0 107.212 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.471 ' HG2' ' N ' ' A' ' 102' ' ' LYS . 71.2 tt0 63.24 163.26 0.11 Allowed 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 109.48 -3.36 . . . . 0.0 108.718 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.471 ' N ' ' HG2' ' A' ' 101' ' ' GLU . 0.1 OUTLIER -39.96 -58.48 1.4 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 112.114 -2.312 . . . . 0.0 111.548 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.17 146.22 0.93 Allowed 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 111.128 -2.76 . . . . 0.0 113.192 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -127.17 64.55 1.32 Allowed 'General case' 0 N--CA 1.483 1.22 2 O-C-N 130.141 4.65 . . . . 0.0 103.576 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.582 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 3.6 mmm180 -67.33 69.73 0.1 Allowed 'General case' 0 N--CA 1.478 0.972 0 O-C-N 128.127 3.392 . . . . 0.0 113.853 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -114.08 95.92 0.76 Allowed Glycine 0 C--O 1.205 -1.67 0 CA-C-O 113.689 -3.84 . . . . 0.0 111.769 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.546 ' CZ2' ' CB ' ' A' ' 96' ' ' CYS . 9.3 p90 -88.71 1.8 54.48 Favored 'General case' 0 C--O 1.195 -1.791 2 O-C-N 134.226 6.486 . . . . 0.0 115.656 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.47 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 7.0 ptpt -24.5 141.63 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.359 2 O-C-N 130.482 4.864 . . . . 0.0 113.819 -179.338 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.592 HE21 ' N ' ' A' ' 109' ' ' GLN 0.287 0.3 OUTLIER -102.96 169.98 8.25 Favored 'General case' 0 C--N 1.362 1.147 0 CA-C-N 112.539 -2.119 . . . . 0.0 109.793 -179.786 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.489 ' C ' HG23 ' A' ' 111' ' ' VAL . 19.0 m95 -127.11 -57.93 1.3 Allowed 'General case' 0 C--O 1.208 -1.11 1 O-C-N 129.587 4.304 . . . . 0.0 116.968 179.47 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.489 HG23 ' C ' ' A' ' 110' ' ' TRP . 21.2 t 93.05 68.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-O 127.635 3.588 . . . . 0.0 108.654 -175.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.21 120.27 40.19 Favored 'General case' 0 CA--C 1.478 -1.818 1 CA-C-N 108.069 -4.15 . . . . 0.0 118.302 -176.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 14.79 83.73 0.01 OUTLIER Glycine 0 C--O 1.215 -1.073 0 C-N-CA 127.289 2.376 . . . . 0.0 116.183 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 49.38 81.11 0.06 Allowed 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 115.81 -2.043 . . . . 0.0 116.239 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.467 ' HB2' ' HB3' ' A' ' 131' ' ' PHE . 0.4 OUTLIER 148.13 -167.77 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.132 1 O-C-N 133.79 6.931 . . . . 0.0 110.46 -179.855 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.472 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -145.99 71.26 1.26 Allowed 'General case' 0 CA--C 1.493 -1.245 0 O-C-N 128.938 3.899 . . . . 0.0 115.589 -179.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -44.67 126.23 5.42 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 126.727 2.517 . . . . 0.0 116.255 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.511 ' CD2' ' HG3' ' A' ' 109' ' ' GLN . 28.4 mt -110.24 117.7 34.37 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 111.396 -2.638 . . . . 0.0 106.578 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.37 105.22 13.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 115.728 -2.082 . . . . 0.0 106.198 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.13 118.96 34.83 Favored 'General case' 0 N--CA 1.489 1.487 1 O-C-N 131.328 5.392 . . . . 0.0 114.023 -179.739 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.2 m -96.72 145.81 25.46 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 110.643 -2.981 . . . . 0.0 103.758 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.505 ' HB3' ' HD3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -133.62 39.68 3.18 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 125.382 2.515 . . . . 0.0 111.295 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 114.06 -80.97 0.29 Allowed Glycine 0 C--O 1.218 -0.851 0 CA-C-N 113.428 -1.715 . . . . 0.0 109.96 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.24 -18.77 13.52 Favored 'General case' 0 CA--C 1.494 -1.202 0 C-N-CA 125.547 1.539 . . . . 0.0 111.876 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -103.55 159.93 15.17 Favored 'General case' 0 C--O 1.198 -1.643 0 O-C-N 125.855 1.972 . . . . 0.0 107.611 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.45 ' O ' HG23 ' A' ' 126' ' ' VAL . 11.0 m -134.01 131.53 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 CA-C-N 109.215 -3.629 . . . . 0.0 112.542 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.7 m -117.86 119.64 35.49 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 116.297 -1.811 . . . . 0.0 110.006 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.24 102.95 12.64 Favored 'General case' 0 N--CA 1.484 1.269 1 O-C-N 129.258 4.099 . . . . 0.0 110.885 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -68.4 167.17 15.19 Favored 'General case' 0 CA--C 1.491 -1.309 0 C-N-CA 114.121 -3.032 . . . . 0.0 116.049 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.3 t -141.8 81.07 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.605 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.467 ' HB3' ' HB2' ' A' ' 115' ' ' LYS . 16.2 m-85 -66.92 175.58 2.42 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 109.968 -3.287 . . . . 0.0 117.976 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.258 4.3 tptt -159.93 99.7 1.39 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 109.036 -3.711 . . . . 0.0 107.872 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.529 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 28.1 ttpt -57.56 110.03 0.8 Allowed 'General case' 0 C--O 1.218 -0.585 0 CA-C-O 115.539 -2.172 . . . . 0.0 109.904 178.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.492 -1.262 0 N-CA-C 118.756 2.873 . . . . 0.0 118.756 -178.65 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.539 ' HE2' ' CE3' ' A' ' 89' ' ' TRP . 1.4 mtmt . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 29.2 t0 44.9 71.37 0.27 Allowed 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 124.501 2.096 . . . . 0.0 107.759 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -97.57 -75.88 0.53 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.205 -179.498 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.424 ' OD1' ' N ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 47.26 135.05 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.629 1 O-C-N 131.897 5.748 . . . . 0.0 114.473 -176.677 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.3 -133.87 1.63 Allowed Glycine 0 C--O 1.206 -1.603 0 CA-C-N 109.874 -3.33 . . . . 0.0 114.431 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.9 t -174.47 62.36 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.321 1 O-C-N 131.476 4.868 . . . . 0.0 108.129 -179.023 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.621 ' CZ2' HD13 ' A' ' 116' ' ' LEU 0.253 0.0 OUTLIER -51.82 106.77 0.16 Allowed 'General case' 0 CA--C 1.507 -0.675 1 O-C-N 130.677 4.986 . . . . 0.0 115.595 -179.495 . . . . . . . . 5 4 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -48.8 -25.81 2.05 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 116.966 -1.493 . . . . 0.0 114.162 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.5 ttp 83.65 -74.39 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.9 1 O-C-N 129.609 4.318 . . . . 0.0 105.744 -179.855 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 102.1 -48.08 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.527 0 O-C-N 128.028 3.33 . . . . 0.0 111.773 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.6 137.13 28.12 Favored 'General case' 0 C--N 1.361 1.087 0 CA-C-N 110.143 -3.208 . . . . 0.0 110.006 -179.803 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -121.01 100.23 6.95 Favored 'General case' 0 C--O 1.197 -1.686 0 N-CA-C 117.942 2.571 . . . . 0.0 117.942 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.518 ' HB3' ' C ' ' A' ' 128' ' ' ARG . 15.9 pt-20 5.37 -133.5 0.0 OUTLIER 'General case' 0 CA--C 1.473 -1.987 2 O-C-N 136.34 8.525 . . . . 0.0 117.005 178.402 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 0.3 OUTLIER -112.64 137.25 51.18 Favored 'General case' 0 C--O 1.203 -1.354 1 O-C-N 114.651 -5.031 . . . . 0.0 106.755 -179.519 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.515 ' CE2' HG22 ' A' ' 35' ' ' VAL . 1.9 p90 -118.19 -30.15 5.37 Favored 'General case' 0 CA--C 1.487 -1.469 0 O-C-N 127.565 3.041 . . . . 0.0 114.908 -178.563 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 22' ' ' LYS . 12.3 tt0 -74.78 -53.84 8.44 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 115.778 -2.058 . . . . 0.0 110.551 179.757 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.52 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -59.3 -24.35 58.9 Favored Glycine 0 N--CA 1.474 1.217 1 O-C-N 132.869 6.356 . . . . 0.0 111.479 178.741 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -70.77 -46.74 62.38 Favored 'General case' 0 C--O 1.195 -1.767 0 CA-C-O 125.752 2.692 . . . . 0.0 106.047 179.676 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.9 mmt -73.35 -23.71 60.25 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.495 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.52 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -78.99 -28.06 43.41 Favored 'General case' 0 C--O 1.206 -1.231 0 O-C-N 127.901 3.251 . . . . 0.0 110.124 -179.862 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -63.9 -37.62 88.06 Favored 'General case' 0 C--O 1.208 -1.097 1 O-C-N 129.517 4.26 . . . . 0.0 111.734 -179.778 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.862 HD12 ' HB2' ' A' ' 79' ' ' ASP 0.361 1.5 mm? -81.45 -56.23 4.17 Favored 'General case' 0 C--O 1.208 -1.128 2 CA-C-N 105.517 -5.31 . . . . 0.0 108.501 179.98 . . . . . . . . 4 3 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.291 19.3 t0 83.71 79.01 0.02 OUTLIER 'General case' 0 CA--C 1.484 -1.577 3 O-C-N 133.48 6.738 . . . . 0.0 107.258 -179.523 . . . . . . . . 3 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.645 HD12 ' O ' ' A' ' 78' ' ' LEU . 14.0 tt -102.29 41.13 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 128.397 3.951 . . . . 0.0 110.052 179.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.04 164.35 0.28 Allowed 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 109.701 -3.409 . . . . 0.0 111.641 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -87.45 84.69 7.13 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 118.812 0.733 . . . . 0.0 112.422 179.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 169.53 156.61 0.05 Allowed 'General case' 0 C--N 1.364 1.231 0 O-C-N 126.382 2.301 . . . . 0.0 106.07 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.274 0.4 OUTLIER 101.06 -19.22 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.847 1 O-C-N 130.876 5.11 . . . . 0.0 113.935 179.669 . . . . . . . . 4 3 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.6 162.16 15.99 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 130.562 3.545 . . . . 0.0 108.865 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 84.36 3.14 0.79 Allowed 'General case' 0 C--N 1.31 -1.139 0 O-C-N 128.431 3.582 . . . . 0.0 111.827 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 mp -128.87 -33.82 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.137 1 O-C-N 130.191 4.682 . . . . 0.0 111.404 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.48 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -99.52 16.05 24.54 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.914 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.515 HG22 ' CE2' ' A' ' 17' ' ' PHE . 12.1 t -26.78 -52.23 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.2 -1.547 0 O-C-N 127.167 2.792 . . . . 0.0 111.0 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.99 117.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 2 O-C-N 131.132 5.27 . . . . 0.0 109.144 179.674 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.92 HD12 ' N ' ' A' ' 38' ' ' THR . 2.5 pp -87.3 -45.01 10.99 Favored 'General case' 0 N--CA 1.433 -1.288 1 O-C-N 129.406 4.191 . . . . 0.0 110.664 -179.923 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.92 ' N ' HD12 ' A' ' 37' ' ' LEU . 1.3 m 145.64 117.31 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.206 1 O-C-N 134.569 7.418 . . . . 0.0 116.915 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.588 ' HG2' ' N ' ' A' ' 56' ' ' SER . 5.4 tp60 -158.12 -98.94 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 115.677 -2.409 . . . . 0.0 116.456 179.148 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.53 ' N ' ' HG3' ' A' ' 39' ' ' GLN . 1.9 m 157.72 151.55 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.597 1 O-C-N 132.633 6.208 . . . . 0.0 111.768 -175.359 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.554 ' HE3' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -110.27 131.93 54.62 Favored 'General case' 0 N--CA 1.492 1.649 1 O-C-N 129.791 4.432 . . . . 0.0 101.656 177.979 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.516 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.2 mp -107.8 164.43 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 126.333 2.271 . . . . 0.0 111.19 179.511 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.516 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -141.94 143.59 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.407 0 CA-C-N 112.386 -2.188 . . . . 0.0 106.855 179.789 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 45' ' ' GLN . 4.9 t -117.15 -66.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.223 0 C-N-CA 115.735 -2.386 . . . . 0.0 109.844 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.442 ' N ' HG12 ' A' ' 44' ' ' VAL . 1.0 OUTLIER 57.84 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 117.156 2.28 . . . . 0.0 117.156 -179.88 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -121.43 29.11 7.39 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 127.209 2.818 . . . . 0.0 116.685 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 117.57 -74.52 0.28 Allowed Glycine 0 C--O 1.213 -1.17 0 CA-C-O 118.698 -1.056 . . . . 0.0 111.914 -179.799 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.683 ' O ' HG12 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -111.23 -37.62 5.25 Favored 'General case' 0 N--CA 1.438 -1.037 0 O-C-N 126.463 1.92 . . . . 0.0 112.753 -179.828 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -83.75 85.43 7.29 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.519 1.928 . . . . 0.0 111.915 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.863 ' CD2' HD22 ' A' ' 94' ' ' LEU . 76.7 t80 -86.96 79.89 8.61 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 127.293 2.871 . . . . 0.0 112.315 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -95.96 77.13 3.15 Favored 'General case' 0 CA--C 1.481 -1.7 1 O-C-N 129.678 4.361 . . . . 0.0 118.807 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.534 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -65.37 168.92 6.45 Favored 'General case' 0 C--N 1.367 1.332 0 O-C-N 128.221 3.451 . . . . 0.0 107.319 179.812 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.521 ' N ' ' CG2' ' A' ' 52' ' ' THR 0.279 13.1 ttpt -160.3 164.99 32.14 Favored 'General case' 0 N--CA 1.488 1.473 1 O-C-N 129.125 4.016 . . . . 0.0 111.369 -175.856 . . . . . . . . 4 3 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.426 HG22 ' O ' ' A' ' 59' ' ' ARG . 1.4 m -140.45 103.31 4.53 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 110.386 -3.097 . . . . 0.0 107.233 178.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -78.01 -20.17 53.01 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 111.374 -2.648 . . . . 0.0 116.187 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.588 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 2.6 t -31.17 117.96 0.19 Allowed 'General case' 0 N--CA 1.469 0.505 1 O-C-N 132.649 6.218 . . . . 0.0 106.156 -179.838 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.651 HG22 ' CD2' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -52.85 -27.16 17.13 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 129.085 3.991 . . . . 0.0 108.396 -179.775 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.86 ' CD1' HD23 ' A' ' 37' ' ' LEU . 0.4 OUTLIER -61.49 -80.88 0.02 OUTLIER 'General case' 0 C--N 1.355 0.813 0 O-C-N 126.298 2.249 . . . . 0.0 111.297 179.907 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' O ' HG22 ' A' ' 54' ' ' THR . 0.0 OUTLIER -124.48 110.01 13.96 Favored 'General case' 0 C--N 1.368 1.373 0 O-C-N 126.842 2.589 . . . . 0.0 112.534 -179.849 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.18 83.82 1.98 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 128.421 3.576 . . . . 0.0 108.599 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.23 -27.95 29.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.812 3.195 . . . . 0.0 111.427 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 155.35 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 127.665 3.103 . . . . 0.0 115.257 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.989 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 8.6 tp -121.16 45.28 2.31 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.371 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -81.44 99.51 8.77 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 126.28 2.238 . . . . 0.0 110.736 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.542 ' CZ ' HG11 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -149.34 173.76 13.17 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 112.831 -1.986 . . . . 0.0 107.367 179.657 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.532 ' N ' ' CG ' ' A' ' 65' ' ' PHE . 2.1 m -132.13 135.07 46.14 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-O 117.099 -1.429 . . . . 0.0 107.683 179.65 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 48' ' ' ASP . 2.1 p -49.22 146.65 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.674 0 O-C-N 126.947 2.655 . . . . 0.0 114.705 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 65.79 16.01 63.07 Favored Glycine 0 N--CA 1.485 1.904 0 O-C-N 128.688 3.742 . . . . 0.0 115.952 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.305 1.2 t -86.06 -23.44 6.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.71 -179.642 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 72.97 72.1 0.13 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 128.559 3.662 . . . . 0.0 108.204 -178.832 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.551 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -58.28 94.8 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.723 1 CA-C-N 107.107 -4.588 . . . . 0.0 116.014 -179.662 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.25 96.22 2.76 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.894 -179.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.26 107.93 15.32 Favored 'General case' 0 CA--C 1.498 -1.028 0 CA-C-O 122.535 1.16 . . . . 0.0 111.827 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -75.11 -24.07 58.01 Favored 'General case' 0 C--O 1.215 -0.741 0 C-N-CA 117.539 -1.664 . . . . 0.0 110.985 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.5 m 47.75 62.9 2.24 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 112.56 -2.109 . . . . 0.0 114.501 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.58 -34.54 10.54 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 128.014 3.769 . . . . 0.0 114.318 -179.961 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.81 -20.84 76.3 Favored Glycine 0 C--O 1.209 -1.416 0 CA-C-N 109.903 -3.317 . . . . 0.0 113.175 -179.76 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.645 ' O ' HD12 ' A' ' 26' ' ' ILE . 5.2 tp -112.81 -11.02 13.53 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 128.103 2.884 . . . . 0.0 115.33 -179.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.862 ' HB2' HD12 ' A' ' 24' ' ' LEU . 2.7 t70 -173.78 -73.82 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.856 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.613 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.61 76.35 0.26 Allowed Glycine 0 N--CA 1.472 1.047 0 C-N-CA 128.17 2.795 . . . . 0.0 110.681 -179.596 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -116.1 -127.86 0.29 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 109.768 -3.216 . . . . 0.0 109.977 -179.648 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 165.55 61.14 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.24 1.382 . . . . 0.0 110.887 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.464 HG12 ' H ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -93.27 179.41 0.52 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-N 111.909 -2.405 . . . . 0.0 114.628 -179.812 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.464 ' H ' HG12 ' A' ' 83' ' ' VAL . 0.6 OUTLIER -126.2 151.71 47.01 Favored 'General case' 0 C--N 1.314 -0.949 1 O-C-N 133.682 6.864 . . . . 0.0 107.521 179.525 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.698 HG21 ' CZ3' ' A' ' 107' ' ' TRP . 24.2 m -149.01 74.16 1.24 Allowed 'General case' 0 C--O 1.203 -1.353 1 O-C-N 129.171 4.044 . . . . 0.0 113.603 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 132.64 54.43 Favored 'General case' 0 N--CA 1.428 -1.529 2 CA-C-N 106.524 -4.853 . . . . 0.0 109.691 -179.614 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.542 HG11 ' CZ ' ' A' ' 65' ' ' PHE . 2.0 t -122.77 155.35 28.17 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.139 0 CA-C-O 123.705 1.717 . . . . 0.0 110.606 -179.734 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.471 HG23 ' HB ' ' A' ' 95' ' ' VAL . 1.7 t -162.68 157.86 22.35 Favored 'General case' 0 CA--C 1.493 -1.247 0 CA-C-N 109.188 -3.642 . . . . 0.0 111.742 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.673 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.266 26.4 m95 -83.38 128.09 34.21 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-O 114.743 -2.551 . . . . 0.0 105.295 179.863 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.663 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.2 OUTLIER -81.59 -5.74 58.33 Favored 'General case' 0 CA--C 1.474 -1.955 1 CA-C-O 130.227 4.822 . . . . 0.0 114.223 -179.644 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 105.86 -3.63 38.88 Favored Glycine 0 C--O 1.197 -2.184 1 N-CA-C 103.098 -4.001 . . . . 0.0 103.098 -179.758 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 179.17 78.68 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.46 0 O-C-N 127.026 2.251 . . . . 0.0 107.568 179.831 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.561 HG22 ' HB2' ' A' ' 90' ' ' GLU . 4.3 t 124.46 163.86 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.361 0 C-N-CA 129.612 3.165 . . . . 0.0 116.944 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.863 HD22 ' CD2' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -103.32 78.15 1.59 Allowed 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 127.641 3.088 . . . . 0.0 116.913 179.989 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.663 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.4 98.7 t -71.55 128.83 35.07 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.254 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.455 ' SG ' HG13 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -125.7 134.61 51.75 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 120.764 1.62 . . . . 0.0 106.668 -179.943 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.9 t -117.64 119.15 60.78 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.475 0 CA-C-O 127.783 3.658 . . . . 0.0 115.413 -179.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.503 ' HG3' ' N ' ' A' ' 106' ' ' GLY 0.301 16.7 mm100 -78.43 98.67 6.11 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 111.49 -2.595 . . . . 0.0 115.736 179.929 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.6 ttmm -85.95 66.98 9.86 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 115.045 -2.662 . . . . 0.0 109.826 179.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -108.82 -156.4 17.81 Favored Glycine 0 C--O 1.203 -1.806 0 CA-C-O 126.051 3.028 . . . . 0.0 113.71 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.1 tm-20 -159.0 140.24 13.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 108.266 -3.967 . . . . 0.0 107.752 179.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 95.0 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 128.352 2.661 . . . . 0.0 111.737 -179.469 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -157.42 170.31 22.74 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 125.156 2.408 . . . . 0.0 113.401 179.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -120.02 95.48 4.78 Favored 'General case' 0 CA--C 1.515 -0.389 1 CA-C-N 106.277 -4.965 . . . . 0.0 104.469 179.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.492 ' CA ' ' HG3' ' A' ' 98' ' ' GLN . 5.7 mmm-85 -72.66 -8.48 55.5 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 128.276 3.485 . . . . 0.0 113.969 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.538 ' O ' HG22 ' A' ' 121' ' ' THR . . . -10.7 95.79 0.01 OUTLIER Glycine 0 N--CA 1.431 -1.687 1 O-C-N 133.467 6.729 . . . . 0.0 114.591 179.436 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.989 ' CZ2' HD21 ' A' ' 63' ' ' LEU 0.278 0.0 OUTLIER -116.03 116.15 27.39 Favored 'General case' 0 C--O 1.194 -1.825 0 O-C-N 128.308 3.005 . . . . 0.0 109.235 179.317 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -149.72 170.28 19.09 Favored 'General case' 0 C--O 1.211 -0.957 1 O-C-N 130.353 4.783 . . . . 0.0 112.238 -179.198 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.498 ' NE2' HD23 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -132.82 171.82 13.4 Favored 'General case' 0 C--N 1.366 1.285 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.771 179.974 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -176.27 93.83 0.05 Allowed 'General case' 0 C--N 1.311 -1.077 1 O-C-N 131.332 5.395 . . . . 0.0 117.24 179.32 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 49.0 t -39.07 107.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 C-N-CA 126.969 2.108 . . . . 0.0 113.029 179.473 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.23 88.88 3.01 Favored 'General case' 0 CA--C 1.488 -1.433 0 CA-C-N 109.981 -3.281 . . . . 0.0 114.208 -179.966 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.48 -112.97 3.75 Favored Glycine 0 C--O 1.2 -2.023 0 N-CA-C 117.524 1.769 . . . . 0.0 117.524 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -122.57 39.85 3.82 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 125.241 1.417 . . . . 0.0 113.74 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.49 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -178.44 162.53 1.48 Allowed 'General case' 0 C--N 1.313 -1.015 1 O-C-N 130.091 4.619 . . . . 0.0 109.407 -179.767 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.621 HD13 ' CZ2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -92.96 173.21 7.86 Favored 'General case' 0 CA--C 1.482 -1.669 0 O-C-N 128.656 3.722 . . . . 0.0 115.607 -179.617 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -142.42 80.72 1.71 Allowed 'General case' 0 C--N 1.366 1.292 1 CA-C-N 107.74 -4.3 . . . . 0.0 114.27 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.88 87.56 4.72 Favored 'General case' 0 CA--C 1.516 -0.346 1 CA-C-N 107.648 -4.342 . . . . 0.0 108.342 -179.851 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -94.7 124.96 39.04 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 127.955 3.284 . . . . 0.0 106.689 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.673 HD12 ' N ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -136.72 145.55 44.8 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 125.001 1.438 . . . . 0.0 108.875 -179.749 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.673 ' N ' HD12 ' A' ' 120' ' ' LEU . 1.5 t -127.55 174.27 9.19 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 125.227 1.579 . . . . 0.0 108.703 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 36.5 t -169.01 84.57 0.15 Allowed 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 125.052 1.47 . . . . 0.0 112.345 -179.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.49 -83.37 1.23 Allowed Glycine 0 N--CA 1.442 -0.934 0 O-C-N 127.993 3.308 . . . . 0.0 112.809 179.885 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -113.04 -20.04 11.66 Favored 'General case' 0 CA--C 1.497 -1.064 0 O-C-N 126.736 2.08 . . . . 0.0 112.082 179.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 54.8 mm-40 -91.73 163.65 14.0 Favored 'General case' 0 C--O 1.201 -1.488 0 O-C-N 126.995 2.684 . . . . 0.0 110.435 179.721 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.523 ' O ' HG13 ' A' ' 126' ' ' VAL . 4.6 p -142.8 94.86 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.794 0 CA-C-N 110.006 -3.27 . . . . 0.0 112.077 179.923 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 32.0 m -82.67 135.06 35.13 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-O 117.201 -1.38 . . . . 0.0 112.064 -179.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . 0.518 ' C ' ' HB3' ' A' ' 15' ' ' GLU . 1.5 ttp180 -117.93 113.49 21.79 Favored 'General case' 0 CA--C 1.486 -1.492 0 O-C-N 128.276 3.485 . . . . 0.0 115.902 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -88.25 157.52 18.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 115.977 -2.289 . . . . 0.0 112.037 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.5 t -140.13 131.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 N-CA-C 103.01 -2.959 . . . . 0.0 103.01 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.577 ' CD2' ' CB ' ' A' ' 9' ' ' TRP 0.25 4.3 m-30 -119.73 -178.3 3.6 Favored 'General case' 0 CA--C 1.502 -0.89 1 O-C-N 129.247 4.092 . . . . 0.0 113.418 -179.981 . . . . . . . . 4 3 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.43 ' HE3' ' HB2' ' A' ' 132' ' ' LYS 0.274 0.0 OUTLIER -167.21 41.56 0.05 OUTLIER 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 114.558 -2.639 . . . . 0.0 104.479 179.516 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.597 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 44.59 -151.87 0.04 OUTLIER 'General case' 0 CA--C 1.49 -1.33 1 O-C-N 131.071 5.232 . . . . 0.0 112.881 -179.387 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.513 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.853 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.108 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 56.63 77.53 0.25 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.97 98.61 3.2 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 116.17 -2.212 . . . . 0.0 109.426 179.895 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -65.77 153.66 41.2 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 130.242 3.417 . . . . 0.0 110.606 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 169.02 -148.46 12.27 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-O 114.41 -3.439 . . . . 0.0 109.796 -179.904 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.415 HG23 HG21 ' A' ' 40' ' ' THR . 0.4 OUTLIER -158.8 136.8 10.49 Favored 'General case' 0 C--N 1.315 -0.927 1 O-C-N 130.773 4.455 . . . . 0.0 103.695 179.919 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.515 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.8 OUTLIER -120.99 124.84 45.84 Favored 'General case' 0 CA--C 1.495 -1.158 1 O-C-N 131.88 5.738 . . . . 0.0 117.854 -179.765 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 132' ' ' LYS . 9.3 mt-10 -83.0 109.76 17.38 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 116.546 -2.062 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.278 8.4 ttm -67.69 81.62 0.18 Allowed 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 125.131 1.52 . . . . 0.0 108.266 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -37.42 -48.67 0.96 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.989 2.915 . . . . 0.0 110.187 179.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.276 4.0 m -165.8 153.84 10.89 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 108.663 -3.88 . . . . 0.0 110.532 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -105.62 137.93 42.65 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-N 110.31 -3.132 . . . . 0.0 114.293 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.41 -62.48 1.6 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 128.446 3.591 . . . . 0.0 111.562 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.433 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -135.71 138.69 43.0 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 125.623 1.569 . . . . 0.0 108.735 179.803 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 37.0 p90 -123.52 -41.88 2.25 Favored 'General case' 0 C--O 1.207 -1.148 0 CA-C-O 124.502 2.096 . . . . 0.0 112.002 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.574 ' N ' ' CD1' ' A' ' 17' ' ' PHE . 1.8 tm-20 -75.55 -34.06 60.7 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-O 115.065 -2.398 . . . . 0.0 112.216 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.551 ' HA2' ' CG ' ' A' ' 22' ' ' LYS . . . -63.96 -29.65 75.45 Favored Glycine 0 N--CA 1.48 1.578 1 O-C-N 133.469 6.73 . . . . 0.0 111.968 -179.941 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.447 ' CD1' HD21 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -80.05 -43.25 22.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-O 125.935 2.779 . . . . 0.0 109.945 179.716 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.568 ' C ' HG22 ' A' ' 26' ' ' ILE . 19.5 mtt -55.66 -42.95 75.8 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 113.812 -1.54 . . . . 0.0 113.685 -179.579 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.551 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.36 -20.38 59.02 Favored 'General case' 0 C--O 1.213 -0.827 1 O-C-N 129.828 4.455 . . . . 0.0 114.768 179.131 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -65.44 -42.46 92.4 Favored 'General case' 0 C--O 1.212 -0.897 1 O-C-N 132.304 6.003 . . . . 0.0 113.314 -179.979 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.744 HD12 ' O ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -89.12 -10.62 46.62 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 108.897 -3.774 . . . . 0.0 106.656 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 66.52 72.71 0.37 Allowed 'General case' 0 N--CA 1.436 -1.14 0 C-N-CA 129.805 3.242 . . . . 0.0 112.973 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.568 HG22 ' C ' ' A' ' 21' ' ' MET . 8.2 tp -107.48 13.62 8.32 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-O 128.475 3.988 . . . . 0.0 109.456 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -50.25 100.38 0.02 OUTLIER 'General case' 0 C--N 1.357 0.915 0 CA-C-N 109.696 -3.411 . . . . 0.0 111.148 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -144.12 24.67 1.62 Allowed 'General case' 0 CA--C 1.501 -0.907 0 O-C-N 126.604 2.44 . . . . 0.0 112.263 179.71 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.38 49.88 8.31 Favored 'General case' 0 C--O 1.201 -1.481 0 O-C-N 126.966 2.666 . . . . 0.0 110.018 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.57 -26.77 13.72 Favored 'General case' 0 N--CA 1.48 1.032 2 CA-C-N 105.782 -5.19 . . . . 0.0 110.307 -179.855 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -166.99 0.46 Allowed 'General case' 0 C--N 1.315 -0.918 1 O-C-N 129.83 4.456 . . . . 0.0 109.695 -179.763 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 90.06 -28.06 0.04 OUTLIER 'General case' 0 C--O 1.202 -1.431 1 O-C-N 130.084 4.615 . . . . 0.0 113.676 179.815 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -131.37 8.1 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 O-C-N 127.629 3.081 . . . . 0.0 110.317 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.72 37.08 2.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.102 179.657 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 66.9 t -50.04 -48.75 22.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 126.257 2.223 . . . . 0.0 109.57 179.665 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.561 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 6.8 tpp85 -141.89 144.09 33.64 Favored 'General case' 0 C--O 1.211 -0.938 2 O-C-N 129.908 4.505 . . . . 0.0 108.29 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.637 ' O ' ' N ' ' A' ' 39' ' ' GLN . 1.2 mp -89.02 96.08 10.58 Favored 'General case' 0 C--O 1.209 -1.046 2 O-C-N 132.892 6.37 . . . . 0.0 103.736 177.06 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.689 HG21 ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER 5.23 -51.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 1 O-C-N 137.34 9.15 . . . . 0.0 109.865 -177.879 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.637 ' N ' ' O ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.72 -166.42 2.52 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 118.96 2.948 . . . . 0.0 118.96 179.658 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.579 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 17.6 m -42.26 149.08 0.17 Allowed 'General case' 0 N--CA 1.426 -1.659 1 C-N-CA 132.782 4.433 . . . . 0.0 115.359 179.293 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.499 ' C ' ' HD3' ' A' ' 41' ' ' LYS 0.289 0.1 OUTLIER -109.28 149.86 28.81 Favored 'General case' 0 N--CA 1.49 1.529 2 O-C-N 131.27 5.356 . . . . 0.0 101.421 178.185 . . . . . . . . 5 4 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.527 ' HB ' ' O ' ' A' ' 53' ' ' LYS . 2.3 mp -127.02 163.14 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 125.102 1.501 . . . . 0.0 111.534 179.342 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.496 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -132.77 143.16 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 CA-C-N 111.181 -2.736 . . . . 0.0 109.568 179.615 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.265 86.9 t -151.77 118.12 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 116.612 -2.035 . . . . 0.0 111.286 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.504 ' HG2' ' CD1' ' A' ' 50' ' ' PHE . 36.9 mt-30 -118.62 111.56 18.71 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -100.32 26.53 6.49 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 128.856 3.847 . . . . 0.0 111.37 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 109.51 -121.59 6.15 Favored Glycine 0 C--O 1.213 -1.156 0 O-C-N 120.844 -1.16 . . . . 0.0 115.345 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -59.69 -27.25 66.27 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 117.469 -1.692 . . . . 0.0 113.883 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -100.79 109.99 22.03 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 128.855 3.847 . . . . 0.0 110.593 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.541 ' CD1' ' C ' ' A' ' 50' ' ' PHE . 0.5 OUTLIER -113.61 111.95 22.7 Favored 'General case' 0 C--N 1.311 -1.088 1 O-C-N 129.119 4.012 . . . . 0.0 110.78 179.9 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -123.48 102.28 7.79 Favored 'General case' 0 C--O 1.196 -1.754 1 O-C-N 129.473 4.233 . . . . 0.0 117.8 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.518 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.3 160.71 28.64 Favored 'General case' 0 N--CA 1.473 0.676 1 O-C-N 130.256 4.722 . . . . 0.0 106.176 179.172 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.527 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -166.16 146.56 6.38 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 179.738 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.488 ' HA ' HD12 ' A' ' 42' ' ' ILE . 9.8 t -111.64 162.91 14.68 Favored 'General case' 0 C--N 1.31 -1.131 0 O-C-N 126.707 2.504 . . . . 0.0 113.406 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.515 ' HB2' HD11 ' A' ' 42' ' ' ILE . 1.7 t-20 -106.8 -12.42 15.51 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 115.622 -2.132 . . . . 0.0 112.287 -179.764 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.484 ' HB2' HD23 ' A' ' 37' ' ' LEU . 98.8 p -23.61 120.36 0.04 OUTLIER 'General case' 0 CA--C 1.509 -0.63 1 O-C-N 131.634 5.584 . . . . 0.0 107.687 178.409 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.689 ' HB ' HG21 ' A' ' 38' ' ' THR . 0.6 OUTLIER -51.31 -31.3 21.09 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 128.031 3.332 . . . . 0.0 107.472 179.816 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.5 ' CG ' ' HG ' ' A' ' 37' ' ' LEU . 13.6 m-85 -57.09 -73.45 0.07 Allowed 'General case' 0 C--N 1.351 0.658 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 179.931 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.406 ' NH1' HD21 ' A' ' 37' ' ' LEU . 0.6 OUTLIER -155.78 129.93 8.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 113.415 -1.721 . . . . 0.0 111.084 -179.655 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -105.53 54.75 0.7 Allowed 'General case' 0 C--O 1.211 -0.942 0 O-C-N 127.82 3.2 . . . . 0.0 111.992 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -75.02 73.93 2.2 Favored 'General case' 0 N--CA 1.47 0.556 1 O-C-N 129.766 4.416 . . . . 0.0 106.85 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.435 ' HA ' ' HA ' ' A' ' 53' ' ' LYS . 5.0 p30 -45.54 114.22 0.72 Allowed 'General case' 0 C--O 1.202 -1.412 0 O-C-N 128.379 3.549 . . . . 0.0 116.05 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.568 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 4.0 tp -65.86 79.69 0.08 Allowed 'General case' 0 C--O 1.214 -0.791 1 O-C-N 129.65 4.344 . . . . 0.0 110.579 179.32 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.413 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 5.7 m-20 -111.01 96.95 6.46 Favored 'General case' 0 CA--C 1.486 -1.483 0 C-N-CA 115.917 -2.313 . . . . 0.0 113.568 -178.348 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.568 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -130.12 -176.05 3.82 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 125.875 2.75 . . . . 0.0 106.5 178.665 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.645 HG22 HG23 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -137.33 156.01 48.74 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.421 ' HA ' ' CG1' ' A' ' 87' ' ' VAL . 20.5 t -64.5 149.26 11.24 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.203 0 O-C-N 128.923 3.889 . . . . 0.0 115.515 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 32.53 31.93 0.01 OUTLIER Glycine 0 N--CA 1.468 0.803 1 O-C-N 130.445 4.841 . . . . 0.0 117.359 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.645 HG23 HG22 ' A' ' 66' ' ' THR . 0.9 OUTLIER -91.14 -16.38 8.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.609 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 68.03 90.91 0.09 Allowed 'General case' 0 C--N 1.355 0.816 1 O-C-N 129.121 4.013 . . . . 0.0 109.787 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.522 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.1 OUTLIER -80.46 82.22 6.54 Favored 'General case' 0 CA--C 1.494 -1.194 0 O-C-N 127.13 2.769 . . . . 0.0 114.882 179.834 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.04 88.58 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 113.618 -1.628 . . . . 0.0 111.33 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.467 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 60.8 161.76 0.06 Allowed 'General case' 0 C--O 1.209 -1.055 0 C-N-CA 126.638 1.975 . . . . 0.0 112.821 179.994 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 149.8 73.58 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 128.387 3.554 . . . . 0.0 113.983 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.295 0.8 OUTLIER -132.3 97.27 4.07 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 116.072 -1.918 . . . . 0.0 109.504 179.931 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -151.01 124.62 9.03 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 128.684 3.74 . . . . 0.0 111.776 179.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.44 -41.09 1.89 Allowed Glycine 0 C--O 1.216 -1.027 0 CA-C-N 109.717 -3.401 . . . . 0.0 112.889 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.744 ' O ' HD12 ' A' ' 24' ' ' LEU . 6.1 tp -106.01 -9.45 17.05 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 129.619 3.776 . . . . 0.0 114.629 -179.851 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.527 ' OD2' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -149.18 -62.74 0.23 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.824 -179.85 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.75 52.18 3.59 Favored Glycine 0 C--O 1.214 -1.132 0 CA-C-O 126.442 3.246 . . . . 0.0 112.611 -179.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.98 -156.86 0.71 Allowed 'General case' 0 C--N 1.354 0.792 0 CA-C-N 110.616 -2.792 . . . . 0.0 113.847 -179.773 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.467 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -151.92 109.58 3.63 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.805 1.288 . . . . 0.0 107.88 178.265 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.859 HG11 ' HB3' ' A' ' 98' ' ' GLN . 72.6 t -140.48 127.78 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.524 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -176.811 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -59.79 88.28 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 112.467 -2.152 . . . . 0.0 109.608 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.522 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 52.5 m -85.88 67.22 9.95 Favored 'General case' 0 C--O 1.196 -1.711 0 O-C-N 128.504 3.628 . . . . 0.0 116.214 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.476 HD21 ' OG1' ' A' ' 88' ' ' THR . 1.2 tt -58.59 146.97 34.01 Favored 'General case' 0 C--O 1.211 -0.925 1 CA-C-N 107.713 -4.312 . . . . 0.0 115.73 -179.744 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.464 ' N ' ' HG ' ' A' ' 86' ' ' LEU . 59.7 t -130.54 132.4 64.55 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.29 0 C-N-CA 127.499 2.32 . . . . 0.0 107.268 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.672 HG22 ' H ' ' A' ' 89' ' ' TRP 0.358 27.8 m -142.57 -156.62 0.7 Allowed 'General case' 0 CA--C 1.48 -1.729 0 CA-C-N 112.698 -2.046 . . . . 0.0 105.698 -179.554 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.705 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.279 10.9 m95 -154.18 143.51 21.38 Favored 'General case' 0 CA--C 1.51 -0.595 0 O-C-N 118.349 -2.72 . . . . 0.0 105.492 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -111.21 -146.38 0.41 Allowed 'General case' 0 CA--C 1.483 -1.605 0 O-C-N 126.583 2.427 . . . . 0.0 111.268 179.39 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -74.28 -30.93 59.92 Favored Glycine 0 N--CA 1.487 2.072 1 N-CA-C 101.144 -4.782 . . . . 0.0 101.144 179.741 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.29 69.3 0.18 Allowed 'General case' 0 C--O 1.197 -1.695 1 O-C-N 133.2 5.883 . . . . 0.0 111.625 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.645 ' O ' ' N ' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.94 133.09 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 119.395 3.109 . . . . 0.0 119.395 178.049 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.954 HD21 ' HG2' ' A' ' 109' ' ' GLN . 0.5 OUTLIER -61.06 10.84 0.02 OUTLIER 'General case' 0 CA--C 1.478 -1.807 0 N-CA-C 120.246 3.424 . . . . 0.0 120.246 -178.293 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.0 t 3.92 114.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.482 -1.656 0 N-CA-C 119.318 3.081 . . . . 0.0 119.318 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.432 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 7.0 p -132.94 140.39 47.81 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 124.847 2.26 . . . . 0.0 108.313 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.421 ' O ' ' N ' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -135.32 80.75 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 CA-C-N 110.013 -3.267 . . . . 0.0 116.533 179.794 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.859 ' HB3' HG11 ' A' ' 83' ' ' VAL . 10.8 mt-30 -50.21 93.8 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 123.937 1.827 . . . . 0.0 108.358 -179.942 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.574 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -88.98 106.7 18.6 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 109.258 -3.61 . . . . 0.0 111.395 -179.767 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.434 ' CA ' HG22 ' A' ' 83' ' ' VAL . . . -105.57 -83.98 1.7 Allowed Glycine 0 C--O 1.197 -2.188 1 CA-C-O 127.9 4.056 . . . . 0.0 110.141 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -176.4 -54.2 0.01 OUTLIER 'General case' 0 C--N 1.355 0.819 1 CA-C-N 107.051 -4.575 . . . . 0.0 112.765 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -87.25 -52.62 5.29 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 125.971 2.796 . . . . 0.0 115.666 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -102.28 158.76 15.96 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 110.362 -3.108 . . . . 0.0 116.424 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -117.2 85.08 2.26 Favored 'General case' 0 N--CA 1.49 1.565 1 CA-C-N 107.309 -4.496 . . . . 0.0 102.158 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.488 ' CZ ' ' HB3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -79.13 7.4 7.57 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 126.366 2.291 . . . . 0.0 115.921 -179.188 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 120' ' ' LEU . . . -49.75 131.62 27.27 Favored Glycine 0 C--O 1.204 -1.756 1 O-C-N 129.372 4.17 . . . . 0.0 110.582 179.25 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.551 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE . 6.5 p90 -117.17 8.78 13.34 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 129.723 3.837 . . . . 0.0 119.387 -179.593 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -28.47 142.81 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 1 CA-C-N 108.26 -4.064 . . . . 0.0 112.757 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.954 ' HG2' HD21 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -123.16 148.65 45.52 Favored 'General case' 0 C--N 1.362 1.127 0 CA-C-O 113.709 -3.043 . . . . 0.0 108.954 179.876 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -145.64 84.6 1.68 Allowed 'General case' 0 C--N 1.303 -1.44 1 O-C-N 132.097 5.873 . . . . 0.0 115.066 179.59 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.468 HG12 ' O ' ' A' ' 111' ' ' VAL . 18.5 t -22.75 104.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.491 -1.311 0 C-N-CA 126.671 1.988 . . . . 0.0 115.802 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -134.85 153.77 51.91 Favored 'General case' 0 CA--C 1.481 -1.678 0 CA-C-N 111.137 -2.756 . . . . 0.0 118.183 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 50.29 -93.14 0.01 OUTLIER Glycine 0 C--O 1.198 -2.1 0 CA-C-O 123.599 1.666 . . . . 0.0 113.813 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -147.63 31.86 0.88 Allowed 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.18 -169.23 2.86 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 128.164 3.415 . . . . 0.0 111.189 -179.611 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' A' ' 116' ' ' LEU . 37.1 tp -128.62 88.06 2.68 Favored 'General case' 0 C--O 1.201 -1.493 0 CA-C-O 127.226 3.393 . . . . 0.0 111.435 179.795 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -44.86 97.11 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.731 1 CA-C-N 107.823 -4.262 . . . . 0.0 117.383 -179.177 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.408 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -78.87 120.63 23.76 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 113.545 -3.121 . . . . 0.0 105.403 178.26 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -134.13 85.63 2.21 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 126.923 2.639 . . . . 0.0 106.682 -178.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 106' ' ' GLY . 0.1 OUTLIER -98.48 148.04 24.14 Favored 'General case' 0 CA--C 1.483 -1.61 1 O-C-N 129.757 4.41 . . . . 0.0 108.857 -179.956 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -110.09 160.54 16.37 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 111.429 -2.623 . . . . 0.0 105.135 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.603 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -159.96 47.24 0.26 Allowed 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 125.899 2.761 . . . . 0.0 112.275 179.845 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.13 -98.33 1.96 Allowed Glycine 0 N--CA 1.438 -1.195 0 CA-C-N 111.739 -2.482 . . . . 0.0 110.709 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -83.61 -29.61 27.6 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 109.305 -3.448 . . . . 0.0 111.026 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -103.15 160.45 14.64 Favored 'General case' 0 C--O 1.207 -1.174 0 O-C-N 127.531 3.02 . . . . 0.0 109.75 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.57 101.14 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.5 -0.97 1 CA-C-N 108.303 -4.044 . . . . 0.0 112.327 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.2 m -79.67 149.7 31.16 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 113.307 -1.769 . . . . 0.0 109.726 179.789 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -140.58 76.14 1.54 Allowed 'General case' 0 N--CA 1.476 0.866 0 O-C-N 127.74 3.15 . . . . 0.0 110.491 179.953 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.86 176.1 0.58 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 117.747 -1.581 . . . . 0.0 114.501 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.259 83.9 t -149.64 87.55 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.563 0 CA-C-O 125.037 2.351 . . . . 0.0 105.624 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 3.4 m-85 -70.57 -178.67 1.86 Allowed 'General case' 0 CA--C 1.486 -1.496 0 CA-C-N 109.015 -3.72 . . . . 0.0 117.625 -179.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 10' ' ' GLU . 0.8 OUTLIER -163.96 117.01 1.43 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 111.461 -2.609 . . . . 0.0 108.067 -179.907 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.648 ' C ' ' HD3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -56.14 49.85 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 119.918 3.303 . . . . 0.0 119.918 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.424 ' CB ' ' O ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.788 0 CA-C-O 113.062 -3.351 . . . . 0.0 118.352 -178.697 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm . . . . . 0 N--CA 1.441 -0.879 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -96.82 84.45 3.6 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 116.577 -1.678 . . . . 0.0 107.284 -179.853 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.438 ' HG3' HG11 ' A' ' 111' ' ' VAL . 1.3 tm0? -117.79 145.85 44.24 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 103.85 -2.648 . . . . 0.0 103.85 -179.893 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -154.54 149.35 26.61 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 129.43 3.092 . . . . 0.0 110.933 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.64 -173.56 44.09 Favored Glycine 0 C--O 1.21 -1.349 0 CA-C-O 116.15 -2.472 . . . . 0.0 110.722 179.788 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.687 HG22 ' HG2' ' A' ' 134' ' ' LYS . 5.6 t -139.29 22.2 2.57 Favored 'General case' 0 C--O 1.208 -1.114 0 O-C-N 129.859 3.917 . . . . 0.0 109.83 179.858 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.628 ' HB2' ' CD1' ' A' ' 131' ' ' PHE 0.291 0.0 OUTLIER -23.66 124.45 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.443 1 O-C-N 133.768 6.917 . . . . 0.0 112.081 179.552 . . . . . . . . 5 4 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -74.09 -3.21 28.11 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -179.172 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.516 ' HG3' HG21 ' A' ' 130' ' ' VAL 0.313 1.0 OUTLIER 49.59 35.97 9.56 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 114.074 -2.87 . . . . 0.0 103.269 179.707 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.484 ' HB2' ' HB2' ' A' ' 132' ' ' LYS . 4.8 tt0 -26.77 -46.92 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.256 2 O-C-N 132.542 6.152 . . . . 0.0 113.919 -178.876 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.689 ' O ' HG12 ' A' ' 130' ' ' VAL . 3.2 t -121.72 -152.22 0.5 Allowed 'General case' 0 C--O 1.245 0.817 0 C-N-CA 117.894 -1.522 . . . . 0.0 112.312 -178.522 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.802 ' HB2' HG12 ' A' ' 130' ' ' VAL . 2.4 t-20 157.34 136.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 O-C-N 125.371 1.669 . . . . 0.0 111.797 179.437 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.573 ' HB2' ' HB3' ' A' ' 128' ' ' ARG . 8.5 mm-40 -91.71 -70.16 0.7 Allowed 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 127.795 3.184 . . . . 0.0 108.16 179.505 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -96.15 157.74 15.76 Favored 'General case' 0 C--O 1.202 -1.413 0 O-C-N 120.812 -1.18 . . . . 0.0 112.872 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -149.01 -48.39 0.15 Allowed 'General case' 0 C--O 1.22 -0.49 0 O-C-N 125.257 1.598 . . . . 0.0 111.284 -179.942 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.474 ' CG ' ' HB2' ' A' ' 31' ' ' ARG . 1.3 mt-10 -67.58 -45.69 74.83 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 111.924 -2.398 . . . . 0.0 115.848 179.782 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.23 -22.92 65.76 Favored Glycine 0 N--CA 1.483 1.77 0 O-C-N 129.1 4.0 . . . . 0.0 111.345 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.524 ' CD1' HD21 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -78.78 -43.67 24.96 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-O 124.962 2.315 . . . . 0.0 107.666 179.992 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 17.8 mtt -66.42 -33.08 74.9 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.69 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -73.4 -25.54 60.59 Favored 'General case' 0 C--O 1.214 -0.773 0 O-C-N 128.053 3.346 . . . . 0.0 114.436 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.34 -52.49 32.77 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.968 3.918 . . . . 0.0 111.029 179.923 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.524 HD21 ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -86.18 -6.39 59.0 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 110.056 -3.247 . . . . 0.0 108.633 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 39.64 73.91 0.11 Allowed 'General case' 0 CA--C 1.484 -1.566 0 O-C-N 127.653 3.095 . . . . 0.0 108.115 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.643 ' CD1' HD12 ' A' ' 78' ' ' LEU . 10.8 tt -65.68 -26.34 38.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.029 1 CA-C-N 108.191 -4.095 . . . . 0.0 109.069 -179.964 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.447 ' OD1' HG23 ' A' ' 26' ' ' ILE . 21.9 p-10 145.97 134.58 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 111.277 -2.692 . . . . 0.0 109.208 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.442 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.3 OUTLIER -94.45 87.61 5.22 Favored 'General case' 0 N--CA 1.483 1.182 1 O-C-N 129.913 4.508 . . . . 0.0 108.477 179.358 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 28' ' ' PHE . . . 150.31 65.84 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 1 O-C-N 129.493 4.246 . . . . 0.0 104.229 -179.363 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.557 HG22 ' O ' ' A' ' 30' ' ' THR . 2.8 m 142.28 66.58 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.247 2 O-C-N 132.815 6.322 . . . . 0.0 109.009 -179.894 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HB2' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -138.08 -56.24 0.66 Allowed 'General case' 0 N--CA 1.447 -0.61 2 O-C-N 130.254 4.721 . . . . 0.0 108.987 -179.711 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.567 ' C ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -88.44 1.27 55.11 Favored 'General case' 0 C--O 1.205 -1.255 0 O-C-N 127.156 2.785 . . . . 0.0 113.715 179.886 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.657 ' N ' HD12 ' A' ' 33' ' ' ILE . 1.7 mp -108.23 -47.63 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 2 O-C-N 129.394 4.184 . . . . 0.0 114.681 -179.621 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.476 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -54.73 -44.42 73.53 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 122.491 1.139 . . . . 0.0 113.214 179.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.421 HG12 ' N ' ' A' ' 36' ' ' ARG . 78.4 t 25.81 -74.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.204 -1.342 0 CA-C-N 110.388 -3.096 . . . . 0.0 115.123 -179.806 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 34' ' ' ALA . 2.8 tmm_? -176.3 100.56 0.06 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.683 -1.599 . . . . 0.0 111.012 179.856 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.646 HD23 ' CE2' ' A' ' 58' ' ' PHE . 0.8 OUTLIER -94.84 -0.6 53.94 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 129.05 3.969 . . . . 0.0 110.59 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.524 ' N ' HD12 ' A' ' 37' ' ' LEU . 16.6 m 133.84 88.33 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.752 1 O-C-N 132.964 6.415 . . . . 0.0 111.503 -179.662 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.468 ' HG3' ' HG2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -88.25 -179.05 6.06 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 116.288 -2.165 . . . . 0.0 115.581 -179.584 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.6 m -178.6 137.39 0.16 Allowed 'General case' 0 N--CA 1.431 -1.384 1 O-C-N 129.913 4.508 . . . . 0.0 112.498 179.583 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.586 ' HD2' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -122.54 157.13 32.73 Favored 'General case' 0 N--CA 1.489 1.494 1 O-C-N 129.321 4.138 . . . . 0.0 102.523 179.694 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.51 ' N ' ' O ' ' A' ' 53' ' ' LYS . 6.7 mt -149.82 104.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.433 0 O-C-N 127.547 3.03 . . . . 0.0 112.287 -178.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.403 ' CD1' ' CE1' ' A' ' 50' ' ' PHE 0.258 0.1 OUTLIER -83.39 135.4 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 2 CA-C-N 106.444 -4.889 . . . . 0.0 110.525 -179.855 . . . . . . . . 5 4 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -143.95 96.58 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 CA-C-N 111.77 -2.468 . . . . 0.0 116.419 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.479 ' HG2' ' HB2' ' A' ' 50' ' ' PHE . 36.5 mt-30 -94.84 126.73 40.35 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.154 179.211 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -132.83 31.85 3.88 Favored 'General case' 0 CA--C 1.49 -1.328 1 O-C-N 130.373 4.795 . . . . 0.0 111.99 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.85 120.36 0.66 Allowed Glycine 0 C--O 1.204 -1.764 0 O-C-N 126.061 2.101 . . . . 0.0 112.685 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 70.43 -69.69 0.17 Allowed 'General case' 0 C--O 1.212 -0.869 0 CA-C-O 116.683 -1.627 . . . . 0.0 112.015 179.854 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.2 m-20 -95.91 114.14 25.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 128.074 3.359 . . . . 0.0 111.493 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.622 ' CD2' HD13 ' A' ' 94' ' ' LEU . 3.0 t80 -115.39 139.98 49.53 Favored 'General case' 0 CA--C 1.489 -1.385 1 O-C-N 129.52 4.262 . . . . 0.0 114.968 -179.806 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.522 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 67.5 mttt -144.86 102.19 3.75 Favored 'General case' 0 CA--C 1.489 -1.378 0 N-CA-C 118.952 2.945 . . . . 0.0 118.952 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.775 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.29 160.96 28.35 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 128.652 3.72 . . . . 0.0 105.67 178.449 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 42' ' ' ILE 0.25 0.0 OUTLIER -158.03 127.4 5.82 Favored 'General case' 0 CA--C 1.482 -1.669 1 O-C-N 130.449 4.843 . . . . 0.0 112.08 -175.681 . . . . . . . . 5 4 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.408 HG22 ' N ' ' A' ' 61' ' ' TYR 0.283 0.4 OUTLIER -94.88 147.65 23.14 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 124.277 1.989 . . . . 0.0 112.853 179.708 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -132.36 59.33 1.72 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 110.282 -3.145 . . . . 0.0 116.958 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 m -93.85 -176.39 4.02 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 130.695 3.598 . . . . 0.0 106.214 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.501 ' HB ' HD21 ' A' ' 37' ' ' LEU . 92.2 m -113.27 -50.39 2.87 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 128.902 3.876 . . . . 0.0 107.659 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.646 ' CE2' HD23 ' A' ' 37' ' ' LEU . 9.0 m-85 -50.06 -57.36 7.79 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 128.579 3.675 . . . . 0.0 110.368 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -154.34 105.82 2.71 Favored 'General case' 0 C--O 1.213 -0.836 1 O-C-N 130.812 5.07 . . . . 0.0 114.112 -179.729 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -86.63 80.84 8.45 Favored 'General case' 0 C--O 1.205 -1.276 1 O-C-N 130.563 4.915 . . . . 0.0 112.066 -179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.408 ' N ' HG22 ' A' ' 54' ' ' THR . 5.5 t80 -68.06 166.86 15.11 Favored 'General case' 0 C--O 1.219 -0.521 0 O-C-N 128.79 3.806 . . . . 0.0 107.174 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -140.2 89.37 2.29 Favored 'General case' 0 C--O 1.207 -1.145 1 O-C-N 129.819 4.45 . . . . 0.0 113.014 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.775 ' HB2' HG22 ' A' ' 52' ' ' THR . 4.6 tp -72.85 64.35 0.67 Allowed 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.62 -1.627 . . . . 0.0 112.4 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.516 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 2.9 t0 -95.5 104.9 16.82 Favored 'General case' 0 C--O 1.21 -0.983 0 CA-C-N 112.636 -2.075 . . . . 0.0 105.551 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.506 ' HB3' HG21 ' A' ' 87' ' ' VAL . 9.6 m-85 -123.03 -178.48 3.97 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.354 2.262 . . . . 0.0 110.716 179.824 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.458 ' CG2' HG23 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -150.68 133.3 15.73 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 179.34 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.56 HG21 ' HE1' ' A' ' 89' ' ' TRP . 54.8 t -52.75 137.77 12.36 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 O-C-N 126.994 2.684 . . . . 0.0 114.973 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 33.12 45.23 0.26 Allowed Glycine 0 N--CA 1.468 0.831 1 O-C-N 130.969 5.168 . . . . 0.0 117.363 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.458 HG23 ' CG2' ' A' ' 66' ' ' THR 0.319 0.4 OUTLIER -88.72 -14.04 9.58 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.62 179.928 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 65.41 71.33 0.44 Allowed 'General case' 0 C--N 1.364 1.235 1 O-C-N 129.568 4.293 . . . . 0.0 109.547 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -65.46 72.22 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.86 2 O-C-N 130.835 5.085 . . . . 0.0 112.763 -179.805 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.43 101.72 0.05 OUTLIER 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 113.127 -1.851 . . . . 0.0 115.427 179.784 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.488 ' HG3' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 63.07 -164.26 0.26 Allowed 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 123.694 1.712 . . . . 0.0 113.224 179.328 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 75.28 88.23 0.09 Allowed 'General case' 0 C--O 1.203 -1.378 0 CA-C-N 109.086 -3.688 . . . . 0.0 113.411 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.26 72.8 p -116.67 -8.38 11.45 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 111.132 -2.758 . . . . 0.0 116.1 -179.74 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.36 151.67 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.925 1 O-C-N 129.214 4.071 . . . . 0.0 116.411 -179.684 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.19 -55.04 4.93 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 110.165 -3.198 . . . . 0.0 113.565 179.712 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.643 HD12 ' CD1' ' A' ' 26' ' ' ILE . 12.9 tp -80.93 -47.88 13.09 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.017 2.834 . . . . 0.0 113.158 179.911 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -112.56 -58.97 2.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 125.772 2.701 . . . . 0.0 112.142 179.847 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.59 49.6 5.69 Favored Glycine 0 C--O 1.207 -1.593 0 CA-C-N 111.748 -2.478 . . . . 0.0 111.968 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.44 ' CG ' ' N ' ' A' ' 82' ' ' ASN . 2.0 ttm-85 -121.04 -104.58 0.39 Allowed 'General case' 0 C--N 1.366 1.315 0 CA-C-N 109.968 -3.116 . . . . 0.0 114.644 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.488 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 6.5 m-20 156.02 103.31 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.836 0 O-C-N 125.729 1.893 . . . . 0.0 108.341 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.579 HG13 ' HA3' ' A' ' 100' ' ' GLY . 1.5 t -153.72 145.31 14.47 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.372 0 O-C-N 126.852 2.595 . . . . 0.0 117.267 -179.332 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -56.17 161.24 2.53 Favored 'General case' 0 C--O 1.235 0.335 1 O-C-N 129.455 4.222 . . . . 0.0 106.87 178.791 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.2 m -161.28 95.23 1.02 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-O 126.389 2.995 . . . . 0.0 110.77 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tp -101.7 111.76 24.12 Favored 'General case' 0 N--CA 1.429 -1.483 1 CA-C-N 108.106 -4.134 . . . . 0.0 116.993 -179.176 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.506 HG21 ' HB3' ' A' ' 65' ' ' PHE . 81.0 t -82.5 144.48 10.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 179.272 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.423 ' CG2' ' N ' ' A' ' 89' ' ' TRP 0.315 1.1 m -162.17 168.75 21.97 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-O 126.734 3.159 . . . . 0.0 110.732 -179.774 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.729 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 56.4 m95 -98.17 139.4 34.02 Favored 'General case' 0 C--N 1.361 1.078 0 CA-C-O 114.755 -2.545 . . . . 0.0 106.658 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.667 ' HB2' HG22 ' A' ' 93' ' ' THR . 0.0 OUTLIER -85.53 -49.49 8.01 Favored 'General case' 0 CA--C 1.483 -1.609 1 CA-C-O 132.231 5.777 . . . . 0.0 112.41 179.797 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -170.56 -56.4 0.04 OUTLIER Glycine 0 C--O 1.213 -1.189 1 CA-C-N 108.119 -4.128 . . . . 0.0 103.285 -179.763 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -141.38 49.37 1.63 Allowed 'General case' 0 N--CA 1.444 -0.731 1 O-C-N 131.949 5.147 . . . . 0.0 109.694 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.667 HG22 ' HB2' ' A' ' 90' ' ' GLU . 1.1 t -176.45 155.99 1.48 Allowed 'General case' 0 C--O 1.203 -1.385 0 N-CA-C 118.063 2.616 . . . . 0.0 118.063 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.622 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -85.6 98.83 10.87 Favored 'General case' 0 CA--C 1.487 -1.47 0 O-C-N 127.907 3.254 . . . . 0.0 115.168 -179.798 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.497 HG13 ' HE2' ' A' ' 108' ' ' LYS . 49.9 t -99.68 120.96 49.78 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.377 0 CA-C-N 110.897 -2.865 . . . . 0.0 114.017 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.588 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 12.1 m -132.5 134.26 44.8 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 103.373 -2.825 . . . . 0.0 103.373 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -120.1 116.3 49.96 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 108.715 -3.857 . . . . 0.0 119.268 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.99 109.26 19.69 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-N 112.459 -2.155 . . . . 0.0 107.436 179.556 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.12 116.18 27.98 Favored 'General case' 0 C--O 1.195 -1.773 0 O-C-N 128.05 3.344 . . . . 0.0 113.619 -179.017 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.579 ' HA3' HG13 ' A' ' 83' ' ' VAL . . . 172.41 176.5 41.19 Favored Glycine 0 C--O 1.199 -2.062 0 CA-C-N 113.172 -1.831 . . . . 0.0 112.402 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.404 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 4.5 tt0 3.45 -61.15 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.275 2 O-C-N 130.996 4.586 . . . . 0.0 114.537 179.645 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER -149.51 -37.21 0.16 Allowed 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 179.474 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -52.19 124.39 12.98 Favored 'General case' 0 N--CA 1.441 -0.918 0 O-C-N 126.544 2.403 . . . . 0.0 116.349 -179.771 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -112.02 67.97 0.66 Allowed 'General case' 0 N--CA 1.484 1.268 2 O-C-N 130.039 4.587 . . . . 0.0 102.148 179.781 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.461 ' HD2' ' HA ' ' A' ' 105' ' ' ARG . 23.5 mmm-85 -94.84 36.73 1.17 Allowed 'General case' 0 C--O 1.203 -1.364 1 O-C-N 129.321 4.138 . . . . 0.0 110.167 179.772 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -77.58 67.82 2.81 Favored Glycine 0 N--CA 1.445 -0.759 0 O-C-N 128.297 3.498 . . . . 0.0 111.445 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.588 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -80.98 141.65 34.22 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 129.699 3.823 . . . . 0.0 110.553 179.397 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.497 ' HE2' HG13 ' A' ' 95' ' ' VAL . 3.0 ptpt -164.61 165.78 20.76 Favored 'General case' 0 N--CA 1.443 -0.786 1 O-C-N 129.265 4.103 . . . . 0.0 114.159 -178.728 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -116.28 175.27 5.63 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 109.729 -3.396 . . . . 0.0 106.415 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.471 ' C ' HG23 ' A' ' 111' ' ' VAL . 15.0 m95 -125.78 -56.24 1.48 Allowed 'General case' 0 C--N 1.306 -1.311 1 O-C-N 130.659 4.974 . . . . 0.0 116.242 179.713 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.506 ' HA ' ' HB3' ' A' ' 116' ' ' LEU . 4.9 t 78.31 44.27 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-O 127.453 3.501 . . . . 0.0 108.485 -176.06 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.603 ' HG3' ' CZ ' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -103.07 129.88 50.03 Favored 'General case' 0 CA--C 1.477 -1.841 1 CA-C-N 107.081 -4.6 . . . . 0.0 110.823 -178.388 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . 0.423 ' O ' ' NZ ' ' A' ' 115' ' ' LYS . . . 48.14 67.42 1.61 Allowed Glycine 0 C--O 1.194 -2.352 0 C-N-CA 125.026 1.298 . . . . 0.0 115.711 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 72.67 -43.4 0.56 Allowed 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 129.027 2.931 . . . . 0.0 118.679 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.513 ' HG3' ' CD1' ' A' ' 117' ' ' TYR . 4.6 ptpp? -100.78 -174.91 2.74 Favored 'General case' 0 C--N 1.312 -1.062 0 O-C-N 128.831 3.832 . . . . 0.0 108.064 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.638 HD12 ' CG ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -138.09 62.24 1.57 Allowed 'General case' 0 C--O 1.194 -1.838 0 O-C-N 126.914 2.634 . . . . 0.0 108.672 178.928 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.776 ' HB3' ' HB3' ' A' ' 129' ' ' GLN . 0.0 OUTLIER -32.27 131.81 0.14 Allowed 'General case' 0 C--N 1.365 1.258 1 O-C-N 130.521 4.888 . . . . 0.0 116.005 -177.093 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.631 ' HB2' ' CE2' ' A' ' 131' ' ' PHE . 0.7 OUTLIER -87.83 65.84 8.53 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 128.661 3.726 . . . . 0.0 111.628 -178.87 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -77.8 122.5 25.5 Favored 'General case' 0 CA--C 1.485 -1.541 0 O-C-N 127.692 3.12 . . . . 0.0 108.014 -179.629 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 121' ' ' THR . 0.9 OUTLIER -146.15 -179.79 6.97 Favored 'General case' 0 CA--C 1.486 -1.512 0 C-N-CA 117.213 -1.795 . . . . 0.0 114.092 -179.791 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.479 ' O ' HD12 ' A' ' 120' ' ' LEU . 44.8 m -128.36 160.89 30.8 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . 0.263 0.3 OUTLIER -173.6 107.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.953 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 12.12 76.9 0.01 OUTLIER Glycine 0 C--O 1.218 -0.849 1 O-C-N 129.896 4.498 . . . . 0.0 114.725 179.593 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 38.9 m-20 101.15 -53.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.391 0 O-C-N 129.048 3.44 . . . . 0.0 111.032 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -77.35 171.06 15.45 Favored 'General case' 0 C--O 1.2 -1.543 1 O-C-N 130.611 4.944 . . . . 0.0 110.323 -179.8 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.1 m -145.17 102.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 1 CA-C-N 107.28 -4.509 . . . . 0.0 111.31 179.454 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.45 175.18 1.43 Allowed 'General case' 0 CA--C 1.494 -1.208 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 -179.625 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . 0.573 ' HB3' ' HB2' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -142.04 64.63 1.38 Allowed 'General case' 0 C--N 1.346 0.446 0 C-N-CA 114.165 -3.014 . . . . 0.0 116.679 179.647 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.776 ' HB3' ' HB3' ' A' ' 117' ' ' TYR . 8.9 mt-30 57.24 -169.09 0.11 Allowed 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 120.815 3.635 . . . . 0.0 120.815 175.616 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 14' ' ' ASN 0.256 1.5 m -173.5 -46.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 O-C-N 126.568 2.418 . . . . 0.0 113.448 -178.775 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.638 ' CG ' HD12 ' A' ' 116' ' ' LEU . 43.7 m-85 -29.94 158.94 0.0 OUTLIER 'General case' 0 CA--C 1.477 -1.853 0 N-CA-C 120.929 3.677 . . . . 0.0 120.929 -174.913 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 12' ' ' GLU 0.338 0.0 OUTLIER -169.46 108.67 0.42 Allowed 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 108.729 -3.85 . . . . 0.0 104.964 -178.86 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.497 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 31.6 ttpt -64.93 73.01 0.04 OUTLIER 'General case' 0 CA--C 1.478 -1.79 0 C-N-CA 117.717 -1.593 . . . . 0.0 113.7 -179.331 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.687 ' HG2' HG22 ' A' ' 8' ' ' THR . 14.9 mttt . . . . . 0 CA--C 1.496 -1.119 0 O-C-N 119.981 -1.699 . . . . 0.0 114.782 179.812 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.493 -1.22 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.68 -173.73 0.8 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.87 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -122.39 -144.2 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 104.368 -2.456 . . . . 0.0 104.368 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.47 131.72 12.8 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 128.317 2.647 . . . . 0.0 110.713 179.713 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 178.16 -119.43 0.67 Allowed Glycine 0 C--O 1.22 -0.758 0 C-N-CA 115.832 -3.08 . . . . 0.0 115.864 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.446 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -179.75 151.07 0.42 Allowed 'General case' 0 C--O 1.211 -0.926 1 O-C-N 133.457 6.034 . . . . 0.0 105.441 -178.85 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.553 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -145.12 114.14 6.94 Favored 'General case' 0 CA--C 1.495 -1.153 1 O-C-N 129.298 4.124 . . . . 0.0 116.117 -179.446 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.413 ' HA ' ' HA ' ' A' ' 40' ' ' THR . 0.8 OUTLIER -82.61 95.08 7.67 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 114.846 -2.742 . . . . 0.0 106.94 179.643 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.509 ' HB3' ' HG2' ' A' ' 39' ' ' GLN . 32.5 ttm -28.28 -46.54 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 O-C-N 128.351 3.532 . . . . 0.0 107.148 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 93.35 -63.34 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.728 1 O-C-N 129.301 4.125 . . . . 0.0 111.729 179.291 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.98 -178.53 4.93 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 108.901 -3.772 . . . . 0.0 111.416 -179.568 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.475 ' ND2' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -165.5 154.94 12.43 Favored 'General case' 0 C--O 1.2 -1.51 0 O-C-N 126.289 2.243 . . . . 0.0 115.799 179.975 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.501 ' HG3' ' N ' ' A' ' 16' ' ' ASN . 3.1 tt0 -125.7 145.48 50.16 Favored 'General case' 0 N--CA 1.476 0.854 2 O-C-N 132.825 6.328 . . . . 0.0 110.738 -179.986 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.501 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 53.3 t30 36.82 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.138 0 CA-C-O 124.252 1.977 . . . . 0.0 115.744 -179.713 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -112.43 -39.5 4.37 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 111.636 -2.529 . . . . 0.0 109.562 -179.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -75.17 -35.02 61.62 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.956 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.02 -27.15 58.81 Favored Glycine 0 C--N 1.351 1.379 0 O-C-N 128.909 3.881 . . . . 0.0 107.028 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.497 ' CE1' HD11 ' A' ' 120' ' ' LEU . 2.1 t80 -72.31 -29.6 64.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 123.483 1.611 . . . . 0.0 108.576 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.432 ' HG2' HG21 ' A' ' 26' ' ' ILE . 9.8 mtt -77.76 -25.31 49.06 Favored 'General case' 0 CA--C 1.494 -1.208 0 C-N-CA 116.594 -2.042 . . . . 0.0 111.004 179.901 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -75.5 -27.01 58.6 Favored 'General case' 0 C--O 1.204 -1.304 0 O-C-N 127.799 3.187 . . . . 0.0 115.02 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.905 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -71.48 -44.93 63.82 Favored 'General case' 0 C--O 1.215 -0.718 1 O-C-N 134.461 7.351 . . . . 0.0 112.807 -179.859 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.859 HD11 ' HB ' ' A' ' 26' ' ' ILE . 2.6 pp -90.46 -6.05 55.33 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 110.24 -3.164 . . . . 0.0 108.202 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.6 t0 32.12 91.28 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 127.606 3.574 . . . . 0.0 113.01 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.859 ' HB ' HD11 ' A' ' 24' ' ' LEU . 9.9 tt -106.03 41.11 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.959 1 CA-C-N 107.472 -4.422 . . . . 0.0 111.17 179.69 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 80.47 134.54 0.06 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 109.887 -3.324 . . . . 0.0 113.323 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.454 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 43.0 m-85 -67.59 137.03 55.36 Favored 'General case' 0 CA--C 1.505 -0.751 0 O-C-N 125.626 1.829 . . . . 0.0 111.795 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 73.99 74.29 0.12 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 125.811 2.72 . . . . 0.0 109.155 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.429 HG22 ' O ' ' A' ' 30' ' ' THR . 34.1 m -140.76 40.73 1.84 Allowed 'General case' 0 N--CA 1.478 0.974 1 CA-C-N 106.85 -4.704 . . . . 0.0 110.794 179.939 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.79 -170.21 3.47 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 111.231 -2.713 . . . . 0.0 109.329 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.495 ' C ' ' CG1' ' A' ' 33' ' ' ILE . 4.6 tttp 76.38 30.69 0.65 Allowed 'General case' 0 C--N 1.314 -0.96 1 O-C-N 129.498 4.249 . . . . 0.0 112.425 -179.62 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.495 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -162.11 -55.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 2 O-C-N 129.834 4.459 . . . . 0.0 111.539 -179.959 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -87.62 50.3 1.97 Allowed 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 124.887 2.28 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.0 t -71.76 -44.21 68.78 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.578 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.186 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.907 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 160.04 132.51 0.0 OUTLIER 'General case' 0 N--CA 1.433 -1.299 1 O-C-N 130.684 4.99 . . . . 0.0 111.664 179.706 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.928 HD12 ' CG2' ' A' ' 57' ' ' THR . 0.1 OUTLIER -150.11 117.35 6.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 108.738 -3.847 . . . . 0.0 106.351 -179.981 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.426 ' HB ' ' HB ' ' A' ' 57' ' ' THR . 7.8 m 47.32 46.57 16.93 Favored 'General case' 0 CA--C 1.506 -0.742 1 O-C-N 131.096 5.247 . . . . 0.0 112.755 179.872 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.509 ' HG2' ' HB3' ' A' ' 11' ' ' MET . 0.4 OUTLIER -56.84 123.23 14.32 Favored 'General case' 0 CA--C 1.494 -1.174 0 O-C-N 125.135 1.522 . . . . 0.0 113.555 179.873 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.502 HG22 ' O ' ' A' ' 40' ' ' THR . 45.3 m -147.95 67.85 1.1 Allowed 'General case' 0 C--N 1.313 -0.994 1 O-C-N 130.114 4.634 . . . . 0.0 117.457 -179.114 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.648 ' HA ' ' CB ' ' A' ' 55' ' ' ASN . 0.1 OUTLIER -66.47 144.82 56.26 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 115.29 -2.29 . . . . 0.0 104.921 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.661 HD13 ' HB ' ' A' ' 54' ' ' THR . 2.6 mt -125.83 166.17 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 1 O-C-N 131.806 5.692 . . . . 0.0 113.263 -177.343 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.532 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.274 0.5 OUTLIER -149.85 143.37 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-N 110.829 -2.896 . . . . 0.0 112.484 179.405 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.501 HG12 ' N ' ' A' ' 45' ' ' GLN . 41.1 t -111.68 -71.1 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.322 0 CA-C-N 111.799 -2.455 . . . . 0.0 114.445 -179.786 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.501 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.4 OUTLIER 60.8 116.5 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 124.099 1.905 . . . . 0.0 113.206 -179.899 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -137.98 -4.12 1.76 Allowed 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 110.365 -3.107 . . . . 0.0 116.326 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.72 114.24 3.39 Favored Glycine 0 CA--C 1.493 -1.343 0 CA-C-N 121.16 1.8 . . . . 0.0 112.2 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 52.46 30.6 8.54 Favored 'General case' 0 C--O 1.212 -0.876 0 O-C-N 125.39 1.288 . . . . 0.0 111.693 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.5 t30 177.79 90.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.504 2.322 . . . . 0.0 109.218 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.689 ' CD2' HD13 ' A' ' 94' ' ' LEU . 32.9 t80 -103.3 95.4 6.07 Favored 'General case' 0 CA--C 1.482 -1.657 1 O-C-N 130.25 4.719 . . . . 0.0 116.648 -179.551 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -106.9 173.29 6.39 Favored 'General case' 0 C--O 1.197 -1.66 0 C-N-CA 114.899 -2.72 . . . . 0.0 111.438 178.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -138.28 136.79 36.82 Favored 'General case' 0 N--CA 1.472 0.647 2 O-C-N 132.542 6.151 . . . . 0.0 104.921 177.592 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.603 ' O ' ' CE ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -156.42 115.38 3.43 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 127.722 3.139 . . . . 0.0 113.887 -176.704 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.705 ' HA ' ' HB3' ' A' ' 60' ' ' ASN . 3.0 m 96.93 147.08 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 130.033 3.333 . . . . 0.0 105.276 177.393 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.648 ' CB ' ' HA ' ' A' ' 41' ' ' LYS . 5.9 p30 -171.76 47.2 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.378 1 O-C-N 129.667 4.354 . . . . 0.0 116.513 -176.832 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 m 148.5 168.46 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 O-C-N 128.867 3.855 . . . . 0.0 107.884 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.928 ' CG2' HD12 ' A' ' 37' ' ' LEU . 5.1 t -83.1 -36.97 24.42 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 111.853 -2.431 . . . . 0.0 106.204 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.912 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -61.15 -29.83 70.02 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 125.682 1.864 . . . . 0.0 110.622 -179.937 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.1 OUTLIER -178.2 162.4 1.56 Allowed 'General case' 0 CA--C 1.504 -0.818 1 O-C-N 131.375 5.422 . . . . 0.0 116.392 -179.938 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.705 ' HB3' ' HA ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -138.47 86.58 2.17 Favored 'General case' 0 CA--C 1.503 -0.853 2 O-C-N 130.778 5.049 . . . . 0.0 114.078 -177.546 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -81.53 93.03 6.6 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 127.186 2.804 . . . . 0.0 110.186 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -43.42 148.25 0.33 Allowed 'General case' 0 C--O 1.206 -1.206 1 O-C-N 129.877 4.486 . . . . 0.0 111.406 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.557 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 4.7 tp -128.9 62.25 1.5 Allowed 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.321 4.138 . . . . 0.0 110.791 179.903 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -79.97 94.24 5.86 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 127.748 3.155 . . . . 0.0 110.363 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.634 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 6.9 m-85 -129.59 137.75 50.89 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 127.103 3.335 . . . . 0.0 109.854 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.635 ' O ' HG23 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -125.4 108.8 12.03 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 109.039 -3.71 . . . . 0.0 103.027 179.594 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.909 HG21 ' CD1' ' A' ' 89' ' ' TRP . 12.5 t -41.77 129.79 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.419 1 O-C-N 130.854 5.096 . . . . 0.0 114.716 -179.771 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.18 12.81 69.9 Favored Glycine 0 N--CA 1.48 1.583 1 O-C-N 129.277 4.111 . . . . 0.0 116.287 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 66' ' ' THR 0.275 1.7 t -73.82 -34.01 39.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.864 -179.792 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 72' ' ' ASP . 27.2 tt0 65.43 73.81 0.39 Allowed 'General case' 0 C--N 1.366 1.306 0 C-N-CA 112.489 -3.685 . . . . 0.0 108.442 -179.374 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.678 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.2 OUTLIER -63.16 77.92 0.02 OUTLIER 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 126.905 3.24 . . . . 0.0 112.569 -179.488 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 70' ' ' GLU . 77.8 m-20 -61.72 78.21 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -179.82 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.531 ' HG2' ' CA ' ' A' ' 83' ' ' VAL . 21.4 mt-10 56.35 108.98 0.01 OUTLIER 'General case' 0 CA--C 1.49 -1.352 1 CA-C-O 129.061 4.267 . . . . 0.0 114.642 179.679 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.62 97.84 0.05 Allowed 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 109.772 -3.376 . . . . 0.0 115.641 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.92 130.8 5.75 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 111.391 -2.641 . . . . 0.0 111.336 -179.932 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.93 148.79 20.95 Favored 'General case' 0 CA--C 1.508 -0.656 0 O-C-N 128.448 3.592 . . . . 0.0 111.899 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.54 -3.99 72.41 Favored Glycine 0 C--O 1.21 -1.369 0 CA-C-N 109.405 -3.543 . . . . 0.0 113.067 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.498 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 0.9 OUTLIER -146.93 19.87 1.27 Allowed 'General case' 0 C--N 1.347 0.494 0 O-C-N 127.868 2.746 . . . . 0.0 116.982 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.7 t0 174.66 -59.5 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.53 0.519 . . . . 0.0 110.96 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.51 72.95 0.97 Allowed Glycine 0 CA--C 1.503 -0.668 0 CA-C-O 126.545 3.303 . . . . 0.0 111.989 -179.797 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.54 -177.63 3.87 Favored 'General case' 0 C--N 1.363 1.194 1 CA-C-N 107.965 -4.118 . . . . 0.0 111.239 179.954 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.444 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.11 82.68 1.2 Allowed 'General case' 0 C--O 1.202 -1.407 0 O-C-N 127.533 3.021 . . . . 0.0 108.145 179.643 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 99' ' ' LYS . 2.3 t -134.19 143.79 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 CA-C-N 111.194 -2.73 . . . . 0.0 117.926 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -50.89 155.3 1.22 Allowed 'General case' 0 N--CA 1.465 0.291 1 O-C-N 130.139 4.649 . . . . 0.0 106.999 179.299 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.678 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.1 m -158.47 78.46 0.79 Allowed 'General case' 0 C--O 1.194 -1.848 0 CA-C-O 127.764 3.65 . . . . 0.0 111.823 -179.452 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 7.5 tt -68.9 139.13 55.12 Favored 'General case' 0 N--CA 1.431 -1.381 1 CA-C-N 107.412 -4.449 . . . . 0.0 111.864 -179.953 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.427 HG13 ' HA ' ' A' ' 67' ' ' VAL . 14.8 p -132.73 132.45 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 C-N-CA 126.085 1.754 . . . . 0.0 110.759 179.883 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.728 ' HA ' HG13 ' A' ' 67' ' ' VAL . 1.4 t -155.21 175.13 14.24 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 126.886 3.231 . . . . 0.0 110.92 179.847 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' TRP . . . . . 0.909 ' CD1' HG21 ' A' ' 67' ' ' VAL . 42.0 m95 -96.22 144.25 26.6 Favored 'General case' 0 CA--C 1.506 -0.732 0 C-N-CA 127.569 2.347 . . . . 0.0 107.874 180.0 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.549 ' HB2' HG23 ' A' ' 95' ' ' VAL . 6.6 tp10 -91.98 -45.46 8.32 Favored 'General case' 0 C--O 1.21 -1.016 1 CA-C-O 131.706 5.527 . . . . 0.0 111.324 179.878 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -178.95 -49.21 0.08 OUTLIER Glycine 0 C--N 1.359 1.85 1 CA-C-N 105.586 -5.279 . . . . 0.0 105.405 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.64 30.42 1.7 Allowed 'General case' 0 C--O 1.212 -0.9 1 O-C-N 131.678 4.987 . . . . 0.0 111.225 179.912 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.433 HG22 ' CB ' ' A' ' 90' ' ' GLU . 2.6 t -161.54 154.05 20.16 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -179.964 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.689 HD13 ' CD2' ' A' ' 50' ' ' PHE . 2.0 tp -89.61 88.14 7.3 Favored 'General case' 0 CA--C 1.486 -1.496 0 O-C-N 129.048 3.968 . . . . 0.0 118.101 179.742 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.549 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.359 40.9 t -86.29 114.97 26.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.251 0 CA-C-N 110.403 -3.09 . . . . 0.0 112.556 179.681 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -138.55 137.4 37.0 Favored 'General case' 0 C--O 1.2 -1.532 0 CA-C-O 122.227 1.013 . . . . 0.0 108.362 -179.491 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.6 t -122.92 137.28 56.92 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 179.76 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.554 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -94.06 94.21 8.28 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 125.369 2.509 . . . . 0.0 107.921 179.399 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.546 ' O ' HG12 ' A' ' 83' ' ' VAL . 71.4 tttt -91.19 128.73 37.12 Favored 'General case' 0 C--O 1.201 -1.467 1 CA-C-N 107.501 -4.409 . . . . 0.0 113.236 -179.9 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 102' ' ' LYS . . . 157.4 171.26 23.2 Favored Glycine 0 C--O 1.203 -1.836 0 CA-C-N 112.964 -1.925 . . . . 0.0 108.538 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 14.09 -70.23 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.959 2 O-C-N 130.254 4.149 . . . . 0.0 114.414 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.496 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -153.1 -43.01 0.1 Allowed 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 127.37 2.268 . . . . 0.0 115.028 179.636 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.496 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 2.8 mp0 -35.91 105.96 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.221 3.045 . . . . 0.0 119.221 -179.527 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.49 ' O ' ' HB ' ' A' ' 121' ' ' THR . 5.9 m120 -94.52 71.57 3.68 Favored 'General case' 0 N--CA 1.492 1.671 3 CA-C-N 106.96 -4.655 . . . . 0.0 99.436 177.415 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 105' ' ' ARG . 14.5 tpt85 -107.17 12.64 28.16 Favored 'General case' 0 C--N 1.31 -1.136 1 O-C-N 134.314 7.259 . . . . 0.0 111.623 -176.908 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.554 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -75.52 141.71 28.02 Favored Glycine 0 C--O 1.203 -1.783 2 O-C-N 130.98 5.175 . . . . 0.0 111.42 179.949 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 107' ' ' TRP . . . . . 0.634 ' CH2' ' CE2' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -123.93 145.47 49.12 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 129.832 3.901 . . . . 0.0 111.112 179.532 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.404 ' HD2' ' CZ3' ' A' ' 110' ' ' TRP . 6.4 ptpp? -156.11 172.58 18.18 Favored 'General case' 0 C--O 1.202 -1.411 0 O-C-N 128.283 3.489 . . . . 0.0 111.975 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.53 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -133.54 175.47 9.39 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 110.279 -3.146 . . . . 0.0 109.565 -179.627 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 110' ' ' TRP . . . . . 0.498 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -172.27 84.29 0.07 Allowed 'General case' 0 CA--C 1.502 -0.891 1 O-C-N 130.05 4.594 . . . . 0.0 115.208 179.73 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.5 t -37.32 90.8 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.83 0 CA-C-O 124.654 2.168 . . . . 0.0 111.859 179.399 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -91.87 47.49 1.35 Allowed 'General case' 0 CA--C 1.486 -1.492 0 CA-C-N 110.079 -3.237 . . . . 0.0 116.662 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.23 -103.36 1.22 Allowed Glycine 0 C--O 1.212 -1.239 0 O-C-N 121.034 -1.041 . . . . 0.0 115.483 179.752 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -100.08 -8.09 24.16 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.21 177.84 7.5 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 128.898 3.874 . . . . 0.0 108.345 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.614 ' O ' HD23 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -138.12 117.99 13.28 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 126.734 2.521 . . . . 0.0 113.146 179.723 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.498 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.3 m-85 -71.06 151.36 44.62 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 111.514 -2.584 . . . . 0.0 114.432 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.491 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -121.18 52.53 1.2 Allowed 'General case' 0 CA--C 1.5 -0.946 2 O-C-N 131.729 5.643 . . . . 0.0 108.733 -179.991 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.91 146.29 32.62 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 127.876 2.47 . . . . 0.0 108.43 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.701 HD12 ' O ' ' A' ' 121' ' ' THR . 0.1 OUTLIER -156.5 162.14 39.97 Favored 'General case' 0 CA--C 1.486 -1.517 0 O-C-N 126.263 2.227 . . . . 0.0 111.231 -179.755 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.701 ' O ' HD12 ' A' ' 120' ' ' LEU . 1.2 m -118.15 162.98 17.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 127.52 3.012 . . . . 0.0 105.134 -179.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.475 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.6 OUTLIER -166.32 47.72 0.07 Allowed 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 126.245 2.926 . . . . 0.0 110.918 179.52 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.19 61.48 2.64 Favored Glycine 0 C--O 1.238 0.38 0 CA-C-N 110.269 -3.15 . . . . 0.0 110.952 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 66.36 41.83 3.19 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 128.112 2.89 . . . . 0.0 111.774 179.69 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.905 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 5.4 mm-40 -131.58 31.53 4.28 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.569 3.043 . . . . 0.0 104.586 179.828 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.587 HG13 ' NH1' ' A' ' 128' ' ' ARG . 9.7 p -22.44 75.32 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 O-C-N 127.739 3.149 . . . . 0.0 114.764 179.819 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 13.1 t -68.31 139.77 55.92 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 119.51 -1.994 . . . . 0.0 111.19 -179.847 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 128' ' ' ARG . . . . . 0.587 ' NH1' HG13 ' A' ' 126' ' ' VAL . 0.3 OUTLIER -119.28 147.5 44.21 Favored 'General case' 0 N--CA 1.47 0.542 1 O-C-N 129.266 4.104 . . . . 0.0 110.667 179.657 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -132.48 178.87 6.5 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 128.267 3.479 . . . . 0.0 110.92 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.27 141.52 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 103.282 -2.858 . . . . 0.0 103.282 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.491 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 42.6 m-85 -127.18 171.04 11.78 Favored 'General case' 0 CA--C 1.486 -1.511 0 O-C-N 128.399 3.562 . . . . 0.0 114.861 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . 0.42 ' HD2' ' N ' ' A' ' 133' ' ' LYS 0.322 0.1 OUTLIER -157.27 117.97 3.56 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 112.723 -3.513 . . . . 0.0 103.296 179.997 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.553 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 10.9 pttt -52.94 130.61 34.05 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 130.292 4.745 . . . . 0.0 110.268 179.373 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.413 ' HG2' ' C ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.799 0 O-C-N 126.212 2.195 . . . . 0.0 115.902 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.103 0 CA-C-O 123.323 1.535 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -150.74 151.01 31.76 Favored 'General case' 0 C--O 1.211 -0.972 0 O-C-N 120.995 -1.066 . . . . 0.0 109.978 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 65.27 0.01 OUTLIER 'General case' 0 C--N 1.358 0.937 0 O-C-N 127.768 3.167 . . . . 0.0 117.851 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -157.75 76.66 0.81 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -108.43 12.25 26.37 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 116.031 -1.938 . . . . 0.0 107.607 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -9.52 119.09 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.954 1 O-C-N 132.835 6.334 . . . . 0.0 115.382 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.494 ' O ' HG23 ' A' ' 8' ' ' THR . . . -170.26 -135.12 1.85 Allowed Glycine 0 C--O 1.21 -1.386 0 CA-C-O 116.693 -2.17 . . . . 0.0 110.259 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.494 HG23 ' O ' ' A' ' 7' ' ' GLY . 1.3 p -155.56 163.75 39.56 Favored 'General case' 0 C--O 1.208 -1.093 1 O-C-N 132.168 5.275 . . . . 0.0 107.201 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.514 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.254 0.0 OUTLIER -156.92 101.59 1.95 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 128.063 3.352 . . . . 0.0 111.391 179.965 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -56.48 -18.25 10.85 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.422 ' HG3' ' CE2' ' A' ' 131' ' ' PHE . 27.7 ttm 68.28 84.98 0.15 Allowed 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 103.364 -2.828 . . . . 0.0 103.364 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.01 -29.67 0.62 Allowed 'General case' 0 C--N 1.312 -1.029 0 O-C-N 128.802 3.814 . . . . 0.0 111.698 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.265 1.5 m -176.15 162.9 2.55 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-N 113.718 -1.583 . . . . 0.0 112.052 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.434 ' H ' ' ND2' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -128.96 121.25 27.61 Favored 'General case' 0 CA--C 1.501 -0.94 0 CA-C-N 111.194 -2.73 . . . . 0.0 114.354 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -70.74 -63.45 1.09 Allowed 'General case' 0 CA--C 1.491 -1.325 1 O-C-N 129.654 4.346 . . . . 0.0 109.288 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -115.13 135.21 54.44 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -128.44 -56.42 1.23 Allowed 'General case' 0 CA--C 1.495 -1.173 0 CA-C-O 124.183 1.944 . . . . 0.0 110.936 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.578 ' HB2' ' CB ' ' A' ' 31' ' ' ARG . 5.3 tp10 -76.71 -37.02 56.81 Favored 'General case' 0 CA--C 1.499 -0.992 0 O-C-N 120.391 -1.443 . . . . 0.0 113.204 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.522 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.15 -25.01 46.03 Favored Glycine 0 CA--C 1.5 -0.882 0 O-C-N 128.537 3.648 . . . . 0.0 112.609 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -75.0 -37.79 61.76 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 119.136 1.468 . . . . 0.0 107.934 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 mtm -77.23 -20.95 54.54 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 112.368 -2.196 . . . . 0.0 107.628 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.522 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 3.0 ttmt -75.09 -38.42 61.23 Favored 'General case' 0 C--O 1.199 -1.572 0 C-N-CA 128.845 2.858 . . . . 0.0 114.595 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.0 -36.39 83.41 Favored 'General case' 0 C--O 1.203 -1.379 1 O-C-N 130.971 5.169 . . . . 0.0 114.163 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.69 HD11 ' HB ' ' A' ' 26' ' ' ILE . 3.7 pp -94.58 -2.48 51.41 Favored 'General case' 0 C--O 1.215 -0.763 1 O-C-N 129.364 4.165 . . . . 0.0 107.969 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.7 t0 45.7 79.53 0.05 Allowed 'General case' 0 CA--C 1.483 -1.631 0 CA-C-O 128.159 3.838 . . . . 0.0 111.093 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.69 ' HB ' HD11 ' A' ' 24' ' ' LEU . 15.6 tt -84.0 -50.15 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.685 0 CA-C-N 109.452 -3.522 . . . . 0.0 108.274 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.452 ' N ' HG23 ' A' ' 26' ' ' ILE . 3.8 t0 -175.94 26.23 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 115.016 -2.421 . . . . 0.0 112.678 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 31.79 37.47 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.303 0 O-C-N 126.308 2.255 . . . . 0.0 117.039 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.0 172.82 17.48 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 112.363 -2.199 . . . . 0.0 106.729 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.287 0.6 OUTLIER 97.71 -7.01 0.06 Allowed 'General case' 0 N--CA 1.484 1.235 1 O-C-N 131.126 5.266 . . . . 0.0 112.667 -179.749 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.578 ' CB ' ' HB2' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -75.51 -16.82 60.25 Favored 'General case' 0 C--O 1.238 0.451 1 O-C-N 131.594 5.559 . . . . 0.0 107.524 179.475 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.8 -11.85 17.31 Favored 'General case' 0 C--O 1.213 -0.854 0 O-C-N 127.534 3.021 . . . . 0.0 111.476 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.3 mp -116.1 -53.36 4.55 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.194 1 O-C-N 130.349 4.781 . . . . 0.0 114.121 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.432 ' HB1' ' CE2' ' A' ' 58' ' ' PHE . . . -67.78 -10.38 52.26 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.9 t -15.82 -48.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.557 0 N-CA-C 116.866 2.173 . . . . 0.0 116.866 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.664 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.1 OUTLIER 162.2 115.38 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.604 2 O-C-N 129.814 4.446 . . . . 0.0 115.311 179.762 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.664 HD23 ' C ' ' A' ' 36' ' ' ARG . 0.1 OUTLIER -142.42 68.79 1.31 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 110.825 -2.898 . . . . 0.0 106.906 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.4 m 93.49 -17.96 0.11 Allowed 'General case' 0 C--O 1.24 0.557 0 O-C-N 128.357 3.535 . . . . 0.0 117.42 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -12.7 89.16 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.007 0 O-C-N 127.678 3.111 . . . . 0.0 117.695 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -111.21 102.16 10.61 Favored 'General case' 0 N--CA 1.434 -1.273 1 O-C-N 132.169 5.918 . . . . 0.0 111.815 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.476 ' CD ' ' CD1' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -75.18 141.98 43.55 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 128.196 3.435 . . . . 0.0 107.425 179.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.534 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.7 mt -140.01 160.17 26.39 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 CA-C-O 123.291 1.519 . . . . 0.0 111.779 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.534 ' N ' HG22 ' A' ' 42' ' ' ILE 0.316 9.1 tt -132.3 142.99 41.28 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.476 0 CA-C-N 110.989 -2.823 . . . . 0.0 107.652 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.676 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.1 t -115.98 -68.16 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 CA-C-N 113.888 -1.506 . . . . 0.0 114.661 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.676 ' N ' HG12 ' A' ' 44' ' ' VAL . 2.1 mt-30 69.12 133.19 0.03 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 O-C-N 124.832 1.332 . . . . 0.0 113.317 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -132.58 -24.51 1.99 Allowed 'General case' 0 C--N 1.359 0.98 1 O-C-N 130.213 4.696 . . . . 0.0 117.124 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.11 -69.85 0.4 Allowed Glycine 0 C--O 1.218 -0.905 0 CA-C-O 122.958 1.31 . . . . 0.0 111.243 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -102.61 -8.25 21.11 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-N 111.227 -2.487 . . . . 0.0 112.037 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -118.48 177.77 4.7 Favored 'General case' 0 C--N 1.354 0.793 0 CA-C-O 114.45 -2.69 . . . . 0.0 111.316 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.744 ' CD2' HD22 ' A' ' 94' ' ' LEU . 5.9 t80 -172.22 113.68 0.31 Allowed 'General case' 0 C--N 1.313 -1.01 1 O-C-N 132.062 5.851 . . . . 0.0 115.828 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.448 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -133.72 79.92 1.85 Allowed 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 118.594 2.813 . . . . 0.0 118.594 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 43' ' ' ILE . 0.7 OUTLIER -60.41 149.71 33.16 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 112.458 -2.155 . . . . 0.0 107.153 179.712 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -146.06 162.6 37.53 Favored 'General case' 0 CA--C 1.49 -1.365 0 O-C-N 127.259 2.849 . . . . 0.0 111.516 -179.538 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.02 123.03 49.36 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 127.602 3.064 . . . . 0.0 107.647 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.441 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -91.68 29.35 1.55 Allowed 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.511 ' HB3' ' CD1' ' A' ' 58' ' ' PHE . 0.6 OUTLIER -53.08 157.74 1.7 Allowed 'General case' 0 C--O 1.209 -1.051 0 O-C-N 128.853 3.845 . . . . 0.0 105.792 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.411 ' HB ' HD12 ' A' ' 37' ' ' LEU . 46.2 m -84.54 -7.6 59.21 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 109.212 -3.631 . . . . 0.0 109.163 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.584 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -101.75 -39.12 7.57 Favored 'General case' 0 C--N 1.366 1.296 0 CA-C-O 125.095 2.379 . . . . 0.0 110.466 179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.79 149.56 27.55 Favored 'General case' 0 C--N 1.361 1.083 1 CA-C-N 107.794 -4.276 . . . . 0.0 117.93 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 79.71 1.62 Allowed 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 109.185 -3.643 . . . . 0.0 109.295 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -170.95 71.49 0.05 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 108.932 -3.758 . . . . 0.0 107.477 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.443 ' HB3' ' HA ' ' A' ' 53' ' ' LYS . 2.8 t0 -106.57 -127.13 0.25 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.6 2.438 . . . . 0.0 115.648 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.741 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -56.07 101.52 0.06 Allowed 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.368 -179.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -132.2 88.91 2.6 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 127.086 2.741 . . . . 0.0 112.369 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.576 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -166.52 179.62 5.41 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 124.088 1.899 . . . . 0.0 112.785 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.59 152.23 30.6 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 105.056 -2.202 . . . . 0.0 105.056 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.808 HG21 ' CD1' ' A' ' 89' ' ' TRP . 0.3 OUTLIER -71.76 144.01 13.68 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.866 0 O-C-N 128.915 3.884 . . . . 0.0 115.202 -179.744 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 63.71 7.54 22.24 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 128.607 3.692 . . . . 0.0 116.936 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 1.1 t -72.84 -26.46 23.49 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.575 0 O-C-N 125.312 1.242 . . . . 0.0 109.136 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.0 tt0 65.68 89.86 0.09 Allowed 'General case' 0 C--O 1.212 -0.896 2 O-C-N 131.028 5.205 . . . . 0.0 109.383 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 3.4 t80 -74.89 67.35 1.65 Allowed 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 127.265 2.853 . . . . 0.0 112.258 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -50.01 79.12 0.0 OUTLIER 'General case' 0 CA--C 1.484 -1.591 0 CA-C-N 113.593 -1.64 . . . . 0.0 113.625 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.47 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 11.1 mt-10 52.89 -165.76 0.07 Allowed 'General case' 0 C--O 1.212 -0.89 0 C-N-CA 125.311 1.444 . . . . 0.0 111.848 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.5 t60 72.49 78.8 0.15 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 125.449 2.547 . . . . 0.0 115.843 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.41 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -122.82 170.28 10.25 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 111.925 -2.398 . . . . 0.0 112.945 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.41 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.15 138.22 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.735 0 O-C-N 128.34 3.525 . . . . 0.0 113.68 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 125.94 -17.41 6.76 Favored Glycine 0 C--O 1.213 -1.181 0 CA-C-N 112.165 -2.288 . . . . 0.0 110.067 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.482 ' O ' HD12 ' A' ' 26' ' ' ILE . 3.7 tp -122.75 -67.85 0.92 Allowed 'General case' 0 N--CA 1.469 0.503 2 CA-C-N 106.734 -4.733 . . . . 0.0 112.869 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.486 ' HA ' HD13 ' A' ' 24' ' ' LEU . 2.3 t70 -104.51 -72.62 0.7 Allowed 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.2 76.2 1.18 Allowed Glycine 0 C--O 1.217 -0.96 0 CA-C-O 124.676 2.265 . . . . 0.0 111.439 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.452 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 11.6 tpp180 -150.22 -117.77 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.228 1 CA-C-N 107.195 -4.503 . . . . 0.0 113.112 179.682 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.47 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.5 OUTLIER -172.57 97.37 0.14 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.828 1.194 . . . . 0.0 112.256 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 87.8 t -135.77 126.91 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.361 0 N-CA-C 117.959 2.577 . . . . 0.0 117.959 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.456 ' CB ' ' HB3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -51.8 122.25 7.93 Favored 'General case' 0 C--O 1.218 -0.601 0 O-C-N 128.782 3.801 . . . . 0.0 106.837 179.351 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.561 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 21.5 m -133.33 83.27 2.04 Favored 'General case' 0 C--O 1.196 -1.735 0 O-C-N 128.417 3.573 . . . . 0.0 112.952 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.451 ' HG ' ' N ' ' A' ' 87' ' ' VAL . 1.1 tp -82.73 138.66 33.98 Favored 'General case' 0 N--CA 1.438 -1.047 1 CA-C-N 107.033 -4.621 . . . . 0.0 111.595 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.545 HG12 HG23 ' A' ' 67' ' ' VAL . 97.3 t -123.31 140.22 47.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 124.888 1.275 . . . . 0.0 110.602 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 8.9 m -154.68 152.08 29.52 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 112.647 -2.069 . . . . 0.0 110.625 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.808 ' CD1' HG21 ' A' ' 67' ' ' VAL . 38.8 m95 -89.9 139.23 30.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 129.082 2.953 . . . . 0.0 106.847 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.452 ' CB ' HG22 ' A' ' 93' ' ' THR . 0.4 OUTLIER -91.29 -16.18 27.94 Favored 'General case' 0 CA--C 1.478 -1.811 1 CA-C-O 130.146 4.784 . . . . 0.0 114.925 179.893 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.68 -30.88 3.5 Favored Glycine 0 C--N 1.362 1.98 1 CA-C-N 107.542 -4.39 . . . . 0.0 103.411 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -156.16 91.0 1.23 Allowed 'General case' 0 N--CA 1.428 -1.569 1 O-C-N 132.906 5.709 . . . . 0.0 106.296 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.452 HG22 ' CB ' ' A' ' 90' ' ' GLU . 1.2 t 116.59 160.47 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 128.852 2.861 . . . . 0.0 118.029 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.744 HD22 ' CD2' ' A' ' 50' ' ' PHE . 6.1 tp -102.81 99.07 8.99 Favored 'General case' 0 CA--C 1.49 -1.339 0 CA-C-O 125.216 2.436 . . . . 0.0 117.326 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.462 HG13 ' NZ ' ' A' ' 108' ' ' LYS 0.357 66.9 t -92.66 121.55 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 114.83 -2.509 . . . . 0.0 112.547 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -136.39 140.9 43.56 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 124.189 1.947 . . . . 0.0 109.387 -179.445 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.4 t -107.83 102.94 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.967 0 CA-C-N 109.267 -3.606 . . . . 0.0 118.08 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.489 ' HG3' ' C ' ' A' ' 105' ' ' ARG . 5.0 mm100 -83.09 86.34 7.03 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.128 -1.608 . . . . 0.0 107.959 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.456 ' HB3' ' CB ' ' A' ' 84' ' ' LYS . 0.6 OUTLIER -76.16 100.25 4.95 Favored 'General case' 0 C--O 1.2 -1.526 0 CA-C-N 109.498 -3.501 . . . . 0.0 107.769 -179.321 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -98.68 177.47 30.59 Favored Glycine 0 C--O 1.214 -1.1 0 O-C-N 127.597 3.061 . . . . 0.0 112.271 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -107.96 -39.91 5.39 Favored 'General case' 0 CA--C 1.494 -1.2 1 CA-C-N 106.675 -4.762 . . . . 0.0 111.989 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.43 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -117.06 -41.85 2.98 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 125.067 2.365 . . . . 0.0 115.433 179.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' A' ' 105' ' ' ARG . 2.0 pp20? -113.78 167.24 10.79 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 126.582 3.087 . . . . 0.0 112.561 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -126.65 90.11 3.11 Favored 'General case' 0 N--CA 1.489 1.514 1 CA-C-N 107.346 -4.479 . . . . 0.0 102.415 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.489 ' C ' ' HG3' ' A' ' 98' ' ' GLN . 5.8 mmm180 -79.74 -7.76 58.82 Favored 'General case' 0 C--N 1.317 -0.806 1 O-C-N 129.448 4.218 . . . . 0.0 113.011 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.493 ' O ' HG22 ' A' ' 121' ' ' THR . . . -22.51 98.59 0.01 OUTLIER Glycine 0 N--CA 1.442 -0.936 1 O-C-N 133.71 6.881 . . . . 0.0 112.333 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.741 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.333 0.0 OUTLIER -116.79 125.27 51.35 Favored 'General case' 0 C--O 1.219 -0.536 1 O-C-N 132.415 5.42 . . . . 0.0 111.34 -179.197 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.479 ' HB2' ' CZ3' ' A' ' 110' ' ' TRP . 0.1 OUTLIER -151.19 153.61 35.28 Favored 'General case' 0 CA--C 1.507 -0.707 0 O-C-N 128.552 3.657 . . . . 0.0 116.318 -178.518 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.789 ' HG2' HD22 ' A' ' 118' ' ' LEU . 0.7 OUTLIER -116.53 167.51 10.99 Favored 'General case' 0 C--N 1.36 1.055 0 CA-C-N 109.725 -3.398 . . . . 0.0 110.248 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.479 ' CZ3' ' HB2' ' A' ' 108' ' ' LYS . 0.5 OUTLIER -177.36 99.34 0.05 OUTLIER 'General case' 0 C--O 1.211 -0.929 0 O-C-N 128.309 3.505 . . . . 0.0 114.87 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.0 t -47.23 97.59 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.825 0 CA-C-O 124.948 2.308 . . . . 0.0 112.988 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.475 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 9.2 mm-40 -94.21 50.91 1.42 Allowed 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 109.09 -3.687 . . . . 0.0 112.604 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.19 -130.14 9.14 Favored Glycine 0 C--O 1.201 -1.934 0 O-C-N 119.465 -2.022 . . . . 0.0 113.057 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -90.77 16.26 9.6 Favored 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 127.405 2.282 . . . . 0.0 117.093 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -142.97 -176.52 4.94 Favored 'General case' 0 C--O 1.223 -0.303 0 O-C-N 128.529 3.643 . . . . 0.0 108.305 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.452 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -140.75 108.17 5.56 Favored 'General case' 0 CA--C 1.485 -1.54 1 O-C-N 130.283 4.739 . . . . 0.0 117.598 -179.904 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.755 ' O ' HD23 ' A' ' 118' ' ' LEU . 17.4 m-30 -72.36 142.72 48.76 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 111.23 -2.714 . . . . 0.0 116.809 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.789 HD22 ' HG2' ' A' ' 109' ' ' GLN . 3.1 mt -130.48 86.37 2.38 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 109.141 -3.663 . . . . 0.0 107.542 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -96.98 92.41 6.07 Favored 'General case' 0 CA--C 1.495 -1.164 0 C-N-CA 128.278 2.631 . . . . 0.0 111.829 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.456 ' CD2' ' HB3' ' A' ' 127' ' ' CYS . 0.3 OUTLIER -110.64 -177.07 3.13 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 128.119 3.387 . . . . 0.0 108.645 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 106' ' ' GLY . 9.2 t -150.44 178.32 9.16 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.978 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.5 p -173.09 60.23 0.02 OUTLIER 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 126.066 2.841 . . . . 0.0 113.078 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 93.97 -74.77 1.09 Allowed Glycine 0 CA--C 1.521 0.439 0 CA-C-N 111.166 -2.743 . . . . 0.0 112.79 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.91 -50.47 3.05 Favored 'General case' 0 CA--C 1.493 -1.214 0 O-C-N 126.19 1.759 . . . . 0.0 110.966 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.28 174.94 1.06 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 128.466 3.604 . . . . 0.0 109.815 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 126' ' ' VAL . 3.6 p -153.81 88.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 CA-C-N 109.425 -3.534 . . . . 0.0 111.007 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.456 ' HB3' ' CD2' ' A' ' 120' ' ' LEU . 52.0 t -73.35 118.53 16.41 Favored 'General case' 0 CA--C 1.49 -1.349 0 CA-C-N 112.161 -2.29 . . . . 0.0 112.203 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 27.3 ttp180 -106.1 135.5 47.45 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 114.524 -2.655 . . . . 0.0 110.46 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -126.34 154.31 43.69 Favored 'General case' 0 CA--C 1.488 -1.422 1 O-C-N 129.671 4.357 . . . . 0.0 116.159 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.22 136.21 53.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.523 ' CD1' ' N ' ' A' ' 131' ' ' PHE . 52.4 m-85 -126.47 -179.43 4.76 Favored 'General case' 0 CA--C 1.477 -1.853 0 CA-C-N 111.709 -2.496 . . . . 0.0 113.916 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.483 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.318 0.0 OUTLIER -157.69 45.86 0.36 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 112.369 -3.681 . . . . 0.0 108.825 -179.759 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.509 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 35.6 ttpt 15.18 102.2 0.0 OUTLIER 'General case' 0 CA--C 1.501 -0.933 1 O-C-N 130.186 4.679 . . . . 0.0 118.294 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.8 ttmt . . . . . 0 CA--C 1.494 -1.189 0 CA-C-O 114.383 -2.722 . . . . 0.0 112.02 -179.581 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 mmt . . . . . 0 N--CA 1.505 2.317 0 CA-C-O 123.572 1.653 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.37 -56.12 3.05 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-N 114.105 -1.407 . . . . 0.0 110.251 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.455 ' HG2' ' CH2' ' A' ' 89' ' ' TRP . 0.6 OUTLIER -105.21 -50.36 3.25 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 128.157 3.411 . . . . 0.0 118.583 -179.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.28 105.27 0.07 Allowed 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 125.898 1.679 . . . . 0.0 109.602 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -116.43 -143.57 0.38 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 112.743 -3.503 . . . . 0.0 102.073 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.9 m120 125.42 122.45 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 1 O-C-N 131.026 5.204 . . . . 0.0 115.337 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.02 -169.96 33.16 Favored Glycine 0 C--O 1.204 -1.722 0 CA-C-N 112.108 -2.315 . . . . 0.0 111.885 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.526 HG23 HG23 ' A' ' 40' ' ' THR . 0.3 OUTLIER -119.01 152.11 37.0 Favored 'General case' 0 C--O 1.202 -1.412 1 O-C-N 132.15 5.265 . . . . 0.0 104.216 179.735 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.563 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -149.11 108.05 3.88 Favored 'General case' 0 CA--C 1.486 -1.506 1 O-C-N 132.426 6.079 . . . . 0.0 112.517 -179.976 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -76.52 100.73 5.37 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 116.213 -2.195 . . . . 0.0 108.156 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.452 ' HB3' ' CD ' ' A' ' 39' ' ' GLN . 4.9 ttm -32.53 -42.42 0.07 Allowed 'General case' 0 N--CA 1.474 0.759 0 O-C-N 127.409 2.943 . . . . 0.0 108.78 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 85.25 -55.84 0.09 Allowed 'General case' 0 CA--C 1.51 -0.569 1 O-C-N 131.461 5.475 . . . . 0.0 112.224 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -157.44 -175.67 5.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 124.815 2.245 . . . . 0.0 111.419 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.527 ' N ' ' ND2' ' A' ' 14' ' ' ASN . 1.5 p30 -155.26 168.0 28.51 Favored 'General case' 0 CA--C 1.483 -1.617 0 CA-C-N 111.513 -2.585 . . . . 0.0 114.109 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -89.9 -80.61 0.31 Allowed 'General case' 0 CA--C 1.503 -0.859 0 O-C-N 128.781 3.801 . . . . 0.0 110.01 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -114.14 126.84 55.53 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 123.216 1.484 . . . . 0.0 112.31 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.64 ' CZ ' HG22 ' A' ' 35' ' ' VAL . 5.7 p90 -109.74 -44.81 3.76 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-O 124.095 1.902 . . . . 0.0 107.883 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.438 ' HG3' ' CB ' ' A' ' 31' ' ' ARG . 5.2 tt0 -66.8 -37.22 84.12 Favored 'General case' 0 C--O 1.215 -0.721 0 O-C-N 120.685 -1.259 . . . . 0.0 113.732 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.18 -33.01 81.67 Favored Glycine 0 N--CA 1.475 1.24 1 O-C-N 129.36 4.163 . . . . 0.0 109.73 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.525 ' CE1' HD21 ' A' ' 24' ' ' LEU . 0.9 OUTLIER -73.69 -44.18 57.29 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-O 124.878 2.275 . . . . 0.0 107.447 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.673 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.3 OUTLIER -61.28 -23.47 65.7 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 124.389 2.042 . . . . 0.0 113.282 -179.692 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -76.58 -27.3 55.77 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 108.441 -3.982 . . . . 0.0 112.684 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.26 -42.24 79.92 Favored 'General case' 0 N--CA 1.477 0.915 1 O-C-N 129.883 4.489 . . . . 0.0 111.679 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.721 HD22 ' NE ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -84.73 -16.33 42.04 Favored 'General case' 0 N--CA 1.483 1.184 1 O-C-N 130.194 4.684 . . . . 0.0 103.966 -179.698 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.4 t0 55.33 84.0 0.08 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 128.561 3.663 . . . . 0.0 110.587 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.673 HG22 ' O ' ' A' ' 21' ' ' MET . 20.2 tt -124.39 53.59 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 1 CA-C-N 107.988 -4.187 . . . . 0.0 107.237 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.55 -171.74 0.85 Allowed 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 113.239 -1.8 . . . . 0.0 113.584 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.444 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.5 m-85 65.75 46.92 2.22 Favored 'General case' 0 CA--C 1.501 -0.924 0 O-C-N 126.288 2.242 . . . . 0.0 116.518 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 88.86 163.04 0.06 Allowed 'General case' 0 C--O 1.2 -1.506 0 O-C-N 127.387 2.929 . . . . 0.0 107.858 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 t 122.38 -31.64 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.016 2 O-C-N 133.214 6.571 . . . . 0.0 109.142 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.438 ' CB ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -105.56 163.96 12.26 Favored 'General case' 0 C--O 1.243 0.725 1 O-C-N 132.357 6.036 . . . . 0.0 108.103 179.34 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 mttt 82.68 10.02 0.65 Allowed 'General case' 0 C--O 1.2 -1.53 0 O-C-N 127.63 3.081 . . . . 0.0 109.922 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.8 mp -145.36 -57.81 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.58 2 O-C-N 132.009 5.818 . . . . 0.0 107.357 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.486 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -82.92 62.15 6.33 Favored 'General case' 0 C--O 1.203 -1.377 0 CA-C-N 112.235 -2.257 . . . . 0.0 113.797 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.64 HG22 ' CZ ' ' A' ' 17' ' ' PHE . 3.2 t -83.81 -45.48 18.38 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.322 0 CA-C-N 111.032 -2.804 . . . . 0.0 109.589 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.447 ' CD ' ' HB2' ' A' ' 39' ' ' GLN . 1.0 OUTLIER 168.0 113.16 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.664 2 O-C-N 131.416 5.448 . . . . 0.0 109.475 179.793 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.689 HD12 ' N ' ' A' ' 38' ' ' THR . 0.4 OUTLIER -90.11 -9.08 49.7 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 127.496 2.997 . . . . 0.0 111.449 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.689 ' N ' HD12 ' A' ' 37' ' ' LEU . 0.8 OUTLIER 164.31 -65.19 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.135 0 O-C-N 128.158 3.411 . . . . 0.0 112.289 179.886 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.647 ' N ' HG22 ' A' ' 38' ' ' THR . 14.0 tm0? 66.58 146.5 0.04 OUTLIER 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.526 HG23 HG23 ' A' ' 8' ' ' THR . 20.1 m -162.01 104.77 1.17 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 130.837 3.655 . . . . 0.0 112.004 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.482 ' HZ3' ' HG ' ' A' ' 116' ' ' LEU . 0.8 OUTLIER -86.98 146.37 26.16 Favored 'General case' 0 N--CA 1.488 1.425 1 O-C-N 129.662 4.351 . . . . 0.0 109.054 -179.433 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.566 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.0 mt -134.84 154.91 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-N 114.506 -1.225 . . . . 0.0 110.574 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.568 HG13 ' CE1' ' A' ' 50' ' ' PHE . 13.7 tt -130.27 124.75 58.41 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 O-C-N 128.37 3.544 . . . . 0.0 107.463 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.2 t -98.36 -32.54 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.173 0 CA-C-N 113.303 -1.771 . . . . 0.0 111.501 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 8.16 91.03 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.02 0 O-C-N 127.38 2.925 . . . . 0.0 118.111 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.82 -35.05 15.03 Favored 'General case' 0 CA--C 1.477 -1.84 2 CA-C-N 106.678 -4.783 . . . . 0.0 114.857 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.17 -111.81 0.5 Allowed Glycine 0 C--O 1.204 -1.774 0 O-C-N 120.457 -1.402 . . . . 0.0 112.493 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -52.51 -28.11 19.2 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 125.964 1.626 . . . . 0.0 111.854 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -117.46 138.75 51.65 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 128.487 2.715 . . . . 0.0 109.279 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.621 ' CE2' HD22 ' A' ' 94' ' ' LEU . 1.7 t80 -149.73 113.54 5.07 Favored 'General case' 0 CA--C 1.483 -1.631 0 O-C-N 127.501 3.001 . . . . 0.0 113.014 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.4 mttm -119.19 82.81 1.93 Allowed 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.416 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -58.8 133.16 55.73 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 128.491 3.62 . . . . 0.0 106.719 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 62' ' ' ASP . 0.5 OUTLIER -144.43 154.3 42.81 Favored 'General case' 0 CA--C 1.488 -1.427 0 C-N-CA 115.087 -2.645 . . . . 0.0 111.453 -179.509 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 59' ' ' ARG . 0.9 OUTLIER -102.77 155.38 18.36 Favored 'General case' 0 CA--C 1.493 -1.213 0 O-C-N 127.57 3.044 . . . . 0.0 111.658 -179.573 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -138.09 49.27 1.95 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.985 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -88.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 1 O-C-N 130.971 5.169 . . . . 0.0 107.93 179.796 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 155.88 -33.6 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.18 1 O-C-N 131.577 5.548 . . . . 0.0 104.313 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.486 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 8.6 m-85 -69.03 -49.37 58.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 125.955 2.035 . . . . 0.0 108.098 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.459 ' O ' HG22 ' A' ' 54' ' ' THR . 0.2 OUTLIER -155.23 120.18 4.85 Favored 'General case' 0 C--N 1.364 1.227 2 CA-C-N 106.869 -4.696 . . . . 0.0 112.845 179.378 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.1 m-20 -104.85 21.94 16.08 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 111.232 -2.713 . . . . 0.0 111.724 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -117.29 98.52 6.48 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 128.586 3.679 . . . . 0.0 109.622 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.465 ' HB2' ' HA ' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -108.95 -79.7 0.58 Allowed 'General case' 0 C--O 1.205 -1.25 1 O-C-N 129.298 4.124 . . . . 0.0 113.361 -179.994 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.586 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 1.1 tp -125.54 119.53 28.4 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -144.75 88.85 1.93 Allowed 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.568 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -150.12 -163.61 1.82 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-O 123.451 1.595 . . . . 0.0 110.23 179.589 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -145.59 152.24 39.38 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.415 HG21 ' CD1' ' A' ' 89' ' ' TRP . 3.1 t -61.55 130.94 26.35 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.586 0 C-N-CA 116.724 -1.991 . . . . 0.0 113.544 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.14 -0.73 89.33 Favored Glycine 0 N--CA 1.486 1.998 0 CA-C-N 110.763 -2.926 . . . . 0.0 116.461 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.579 HG12 ' N ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -49.85 -39.13 14.74 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 125.208 1.181 . . . . 0.0 109.66 -179.654 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.435 ' N ' HG12 ' A' ' 69' ' ' VAL . 4.3 tt0 57.17 65.14 1.44 Allowed 'General case' 0 C--O 1.211 -0.946 1 O-C-N 130.67 4.981 . . . . 0.0 108.546 -179.262 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.691 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.1 t80 -49.16 92.65 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.68 2 O-C-N 133.421 6.701 . . . . 0.0 110.866 -179.384 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.428 ' C ' ' HG3' ' A' ' 73' ' ' GLU . 39.6 t0 -57.29 63.84 0.0 OUTLIER 'General case' 0 CA--C 1.499 -0.997 0 O-C-N 126.403 2.314 . . . . 0.0 113.93 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.482 ' HB3' ' CB ' ' A' ' 82' ' ' ASN 0.258 5.3 mt-10 56.36 -170.59 0.08 Allowed 'General case' 0 CA--C 1.484 -1.574 0 CA-C-O 125.373 2.511 . . . . 0.0 110.05 179.743 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.75 93.11 0.07 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 109.225 -3.625 . . . . 0.0 109.004 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.43 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 2.0 p -96.07 -55.86 2.83 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 111.301 -2.681 . . . . 0.0 116.91 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.43 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 48.1 165.31 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.933 1 O-C-N 129.348 4.155 . . . . 0.0 115.562 -179.515 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.18 -51.39 3.42 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 112.36 -2.2 . . . . 0.0 112.497 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.647 ' O ' HD12 ' A' ' 26' ' ' ILE 0.267 2.5 tp -119.8 -0.79 10.63 Favored 'General case' 0 C--O 1.243 0.755 0 O-C-N 127.975 2.809 . . . . 0.0 117.417 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -154.99 -74.08 0.11 Allowed 'General case' 0 CA--C 1.503 -0.853 0 C-N-CA 116.545 -2.062 . . . . 0.0 113.199 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.93 72.88 1.28 Allowed Glycine 0 C--O 1.212 -1.219 0 CA-C-O 122.578 1.099 . . . . 0.0 111.825 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.423 ' CG ' ' H ' ' A' ' 82' ' ' ASN . 0.8 OUTLIER -136.89 -148.45 0.28 Allowed 'General case' 0 C--N 1.351 0.651 0 CA-C-N 110.185 -3.007 . . . . 0.0 109.107 -179.769 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.482 ' CB ' ' HB3' ' A' ' 73' ' ' GLU . 40.6 m-20 -161.69 100.15 1.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 125.637 1.835 . . . . 0.0 109.516 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 40.4 t -129.13 146.81 33.67 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.42 0 O-C-N 127.265 2.853 . . . . 0.0 118.534 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -79.87 88.23 5.29 Favored 'General case' 0 C--O 1.218 -0.595 1 O-C-N 130.423 4.827 . . . . 0.0 108.254 179.436 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.691 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 8.0 m -99.22 85.83 3.29 Favored 'General case' 0 C--O 1.193 -1.882 1 O-C-N 130.258 4.724 . . . . 0.0 114.034 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.644 HD23 ' N ' ' A' ' 87' ' ' VAL . 7.9 tt -89.63 155.71 19.06 Favored 'General case' 0 N--CA 1.442 -0.854 1 CA-C-N 107.509 -4.405 . . . . 0.0 110.238 179.822 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.644 ' N ' HD23 ' A' ' 86' ' ' LEU . 2.4 p -140.14 132.49 33.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 127.087 2.155 . . . . 0.0 109.692 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.473 ' HB ' HD21 ' A' ' 86' ' ' LEU . 6.8 t -155.8 -178.69 7.48 Favored 'General case' 0 CA--C 1.485 -1.55 0 CA-C-O 125.419 2.533 . . . . 0.0 111.584 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.732 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 58.5 m95 -99.25 145.6 27.1 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 118.577 -2.577 . . . . 0.0 108.647 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.648 ' HB2' HG23 ' A' ' 95' ' ' VAL . 7.2 tp10 -93.09 -44.45 8.37 Favored 'General case' 0 C--O 1.201 -1.455 1 CA-C-O 131.529 5.443 . . . . 0.0 112.15 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 174.93 -46.64 0.13 Allowed Glycine 0 N--CA 1.478 1.491 1 CA-C-N 106.634 -4.803 . . . . 0.0 104.464 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -141.48 36.53 1.67 Allowed 'General case' 0 C--O 1.202 -1.438 1 O-C-N 130.305 4.18 . . . . 0.0 110.881 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 90' ' ' GLU . 3.6 t -176.09 158.72 2.02 Favored 'General case' 0 C--O 1.203 -1.354 0 N-CA-C 118.048 2.61 . . . . 0.0 118.048 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.621 HD22 ' CE2' ' A' ' 50' ' ' PHE . 6.4 tp -90.01 94.55 9.84 Favored 'General case' 0 CA--C 1.492 -1.258 0 O-C-N 128.613 3.695 . . . . 0.0 117.244 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.648 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.366 38.2 t -91.91 126.72 44.47 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-N 108.816 -3.811 . . . . 0.0 111.923 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 4.4 m -131.64 123.74 28.47 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 127.077 2.736 . . . . 0.0 103.795 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.1 t -96.31 119.73 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 110.854 -2.884 . . . . 0.0 112.657 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.544 ' HG3' ' CB ' ' A' ' 105' ' ' ARG 0.307 0.1 OUTLIER -94.68 104.24 16.16 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 110.895 -2.866 . . . . 0.0 107.886 179.647 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.9 106.92 12.52 Favored 'General case' 0 C--O 1.206 -1.227 0 O-C-N 127.27 2.856 . . . . 0.0 110.681 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -120.47 -169.12 13.86 Favored Glycine 0 C--O 1.209 -1.415 0 CA-C-O 124.033 1.907 . . . . 0.0 109.57 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -72.69 -13.39 61.34 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 108.376 -3.912 . . . . 0.0 112.459 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -160.63 -43.24 0.05 OUTLIER 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 117.407 2.373 . . . . 0.0 117.407 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.505 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 28.4 mt-10 -56.04 144.78 27.69 Favored 'General case' 0 C--O 1.208 -1.121 0 O-C-N 126.716 2.51 . . . . 0.0 117.668 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.466 ' O ' HG23 ' A' ' 121' ' ' THR . 94.2 m-20 -127.11 60.56 1.38 Allowed 'General case' 0 N--CA 1.491 1.593 1 CA-C-N 107.597 -4.365 . . . . 0.0 102.0 179.651 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.721 ' NE ' HD22 ' A' ' 24' ' ' LEU . 0.7 OUTLIER -69.32 -15.54 63.36 Favored 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.118 5.261 . . . . 0.0 113.792 -179.667 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.518 ' N ' ' HG2' ' A' ' 98' ' ' GLN . . . -21.11 96.08 0.01 OUTLIER Glycine 0 C--O 1.21 -1.346 2 O-C-N 134.041 7.088 . . . . 0.0 115.351 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.586 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.315 0.0 OUTLIER -114.38 129.77 56.66 Favored 'General case' 0 C--O 1.196 -1.727 1 O-C-N 132.259 5.329 . . . . 0.0 110.389 179.762 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.9 ptpt -158.03 168.02 28.27 Favored 'General case' 0 C--N 1.354 0.774 1 O-C-N 130.681 4.988 . . . . 0.0 117.91 -178.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.484 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 2.3 mp0 -125.26 172.68 9.36 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 115.2 -2.333 . . . . 0.0 110.799 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.464 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER 175.41 71.12 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.977 1 O-C-N 130.222 4.702 . . . . 0.0 117.948 -179.586 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 44.9 t -18.45 116.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.484 -1.583 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -127.18 68.99 1.28 Allowed 'General case' 0 CA--C 1.483 -1.619 0 N-CA-C 117.34 2.348 . . . . 0.0 117.34 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.81 100.61 0.06 OUTLIER Glycine 0 C--O 1.207 -1.537 0 CA-C-O 118.129 -1.373 . . . . 0.0 115.647 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 39.58 41.77 0.81 Allowed 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 10.3 pttm 177.2 170.06 0.56 Allowed 'General case' 0 CA--C 1.501 -0.913 0 O-C-N 128.978 3.924 . . . . 0.0 107.769 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.561 HD23 ' CZ2' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -148.85 121.1 8.37 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 115.362 -2.535 . . . . 0.0 113.038 179.661 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.464 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 8.9 m-85 -67.15 154.84 40.26 Favored 'General case' 0 C--N 1.362 1.138 0 CA-C-N 111.374 -2.648 . . . . 0.0 112.895 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.464 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -130.21 39.88 3.6 Favored 'General case' 0 N--CA 1.476 0.833 2 O-C-N 131.418 5.449 . . . . 0.0 106.501 179.632 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 120' ' ' LEU . 0.1 OUTLIER -51.9 122.17 7.89 Favored 'General case' 0 CA--C 1.508 -0.651 0 O-C-N 128.853 3.846 . . . . 0.0 110.889 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.573 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -141.15 168.37 19.94 Favored 'General case' 0 CA--C 1.486 -1.51 1 O-C-N 130.33 4.769 . . . . 0.0 109.579 -179.811 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' ' 126' ' ' VAL . 2.1 t -135.16 175.73 9.32 Favored 'General case' 0 C--O 1.198 -1.621 0 O-C-N 127.112 2.758 . . . . 0.0 105.224 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.6 p 174.2 84.87 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.52 0 O-C-N 124.925 1.391 . . . . 0.0 111.115 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 71.91 39.64 58.89 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-O 123.749 1.749 . . . . 0.0 111.223 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.14 37.05 6.83 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 109.53 -3.335 . . . . 0.0 112.482 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -96.3 -13.3 23.43 Favored 'General case' 0 C--O 1.199 -1.586 0 O-C-N 127.125 2.765 . . . . 0.0 107.851 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.538 ' HA ' ' HA ' ' A' ' 121' ' ' THR . 35.6 m 27.57 60.55 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.507 -0.7 0 C-N-CA 127.505 2.322 . . . . 0.0 115.144 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.0 t -55.02 112.09 0.98 Allowed 'General case' 0 CA--C 1.501 -0.937 0 C-N-CA 125.344 1.458 . . . . 0.0 111.793 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 53.4 ttm-85 -105.76 100.88 10.43 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.949 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -85.01 173.78 10.26 Favored 'General case' 0 CA--C 1.489 -1.389 0 CA-C-N 112.962 -1.926 . . . . 0.0 113.545 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.449 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 2.2 m -135.88 157.12 38.34 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.464 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 63.6 m-85 -140.96 175.83 9.3 Favored 'General case' 0 CA--C 1.493 -1.215 0 O-C-N 128.196 3.435 . . . . 0.0 115.718 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.293 0.0 OUTLIER -163.96 119.81 1.62 Allowed 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 110.731 -2.941 . . . . 0.0 103.606 179.834 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.563 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 9.2 tttt -53.09 126.17 19.79 Favored 'General case' 0 C--O 1.198 -1.614 0 O-C-N 127.176 2.798 . . . . 0.0 110.72 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.496 -1.124 0 O-C-N 125.712 1.882 . . . . 0.0 115.972 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.9 -151.16 0.34 Allowed 'General case' 0 C--O 1.206 -1.233 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.5 84.06 0.41 Allowed 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -101.31 81.31 2.19 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -101.11 -83.45 0.45 Allowed 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 113.725 -3.036 . . . . 0.0 108.127 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.9 113.02 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.733 1 O-C-N 129.191 4.057 . . . . 0.0 114.451 -179.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.56 -130.72 1.84 Allowed Glycine 0 C--O 1.207 -1.569 0 O-C-N 126.52 2.388 . . . . 0.0 112.472 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.494 HG23 HG23 ' A' ' 40' ' ' THR . 1.2 m -174.57 144.01 0.84 Allowed 'General case' 0 C--N 1.314 -0.954 1 O-C-N 130.661 4.389 . . . . 0.0 106.398 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.592 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.2 134.8 22.15 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 111.967 -2.379 . . . . 0.0 114.621 -179.539 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -69.54 -14.81 63.05 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.599 ' HE2' ' HB2' ' A' ' 41' ' ' LYS . 5.2 ttp 55.2 57.74 5.26 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -17.88 -49.6 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.883 0 O-C-N 128.514 3.634 . . . . 0.0 111.903 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.3 165.39 28.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 110.273 -3.148 . . . . 0.0 111.406 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -152.24 129.91 11.56 Favored 'General case' 0 CA--C 1.482 -1.651 0 CA-C-N 110.42 -3.082 . . . . 0.0 111.466 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' A' ' 17' ' ' PHE . 7.0 mm-40 -88.46 -174.59 4.65 Favored 'General case' 0 CA--C 1.496 -1.125 1 O-C-N 129.471 4.232 . . . . 0.0 112.119 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 33.24 -81.76 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.55 0 C-N-CA 125.855 1.662 . . . . 0.0 113.763 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.424 ' N ' ' O ' ' A' ' 15' ' ' GLU . 1.4 t80 73.81 -59.39 0.56 Allowed 'General case' 0 C--O 1.203 -1.364 0 O-C-N 126.203 2.189 . . . . 0.0 113.165 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.418 ' OE1' ' N ' ' A' ' 19' ' ' GLY . 0.5 OUTLIER -76.4 -48.86 18.35 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.536 -1.665 . . . . 0.0 115.241 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.471 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -56.47 -19.92 28.36 Favored Glycine 0 CA--C 1.494 -1.222 0 CA-C-O 116.934 -2.037 . . . . 0.0 112.893 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -36.89 38.96 Favored 'General case' 0 C--O 1.21 -0.983 0 O-C-N 128.13 2.9 . . . . 0.0 106.387 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.595 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -75.45 -25.57 57.56 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 111.048 -2.796 . . . . 0.0 107.554 179.53 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.471 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -79.92 -28.76 39.74 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 129.065 2.946 . . . . 0.0 114.238 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.53 -28.67 66.21 Favored 'General case' 0 N--CA 1.477 0.912 2 O-C-N 130.818 5.074 . . . . 0.0 113.344 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.963 HD11 ' HB ' ' A' ' 26' ' ' ILE . 4.1 pp -103.04 -4.39 24.66 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 127.946 3.279 . . . . 0.0 108.999 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 54.25 82.59 0.09 Allowed 'General case' 0 CA--C 1.484 -1.571 0 C-N-CA 131.027 3.731 . . . . 0.0 114.519 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.963 ' HB ' HD11 ' A' ' 24' ' ' LEU . 16.2 tt -111.65 42.76 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-N 111.501 -2.591 . . . . 0.0 106.883 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.531 ' O ' ' CG ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -47.21 151.53 0.69 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 114.247 -2.787 . . . . 0.0 108.957 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.531 ' CG ' ' O ' ' A' ' 27' ' ' ASP . 4.8 m-30 147.12 -27.68 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.783 1 O-C-N 131.276 5.36 . . . . 0.0 111.28 179.169 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 90.52 73.32 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.542 0 O-C-N 127.049 2.718 . . . . 0.0 108.125 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -26.43 27.76 Favored 'General case' 0 C--O 1.212 -0.899 1 CA-C-N 105.708 -5.224 . . . . 0.0 111.816 179.761 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.412 ' HG2' ' CB ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -89.93 -171.24 3.08 Favored 'General case' 0 C--N 1.319 -0.739 1 O-C-N 129.283 4.114 . . . . 0.0 110.874 -179.925 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 96.64 -37.64 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.415 1 O-C-N 130.905 5.128 . . . . 0.0 112.848 -179.663 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.9 OUTLIER -145.06 34.16 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 128.514 3.634 . . . . 0.0 108.675 -179.753 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -129.57 20.9 5.59 Favored 'General case' 0 C--O 1.206 -1.185 1 CA-C-O 128.63 4.062 . . . . 0.0 111.373 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.27 -40.75 57.57 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-N 108.542 -3.936 . . . . 0.0 110.038 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.442 ' HD2' ' CB ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -177.47 99.0 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.858 0 CA-C-N 110.562 -3.017 . . . . 0.0 115.717 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.746 HD21 ' N ' ' A' ' 58' ' ' PHE . 1.4 pp -100.08 -1.26 37.3 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 105.41 -2.071 . . . . 0.0 105.41 178.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.577 ' N ' HD12 ' A' ' 37' ' ' LEU . 2.9 m 142.72 128.38 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.161 1 O-C-N 131.098 5.249 . . . . 0.0 110.393 -178.71 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.585 ' HG2' ' HE3' ' A' ' 11' ' ' MET . 0.6 OUTLIER -130.81 140.95 50.31 Favored 'General case' 0 CA--C 1.494 -1.178 0 O-C-N 126.3 2.25 . . . . 0.0 113.321 -179.359 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.494 HG23 HG23 ' A' ' 8' ' ' THR . 38.9 m -156.03 104.13 2.26 Favored 'General case' 0 C--O 1.21 -1.02 0 O-C-N 128.62 3.7 . . . . 0.0 114.371 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.621 ' HE3' HD11 ' A' ' 118' ' ' LEU . 0.0 OUTLIER -96.68 118.96 34.27 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.54 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.8 mp -105.92 155.79 6.83 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 1 O-C-N 129.289 4.118 . . . . 0.0 111.1 179.587 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.54 ' N ' HG22 ' A' ' 42' ' ' ILE 0.307 2.4 tt -132.05 141.18 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.41 0 O-C-N 127.555 3.035 . . . . 0.0 106.486 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 42.7 t -141.08 85.12 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 113.594 -1.639 . . . . 0.0 112.752 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.53 131.51 37.6 Favored 'General case' 0 CA--C 1.494 -1.182 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.439 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -140.78 -6.87 1.11 Allowed 'General case' 0 CA--C 1.483 -1.626 0 O-C-N 127.777 3.173 . . . . 0.0 118.06 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 115.21 102.88 2.42 Favored Glycine 0 N--CA 1.474 1.209 0 CA-C-N 120.752 1.615 . . . . 0.0 111.177 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 56.42 26.46 10.81 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 126.314 1.832 . . . . 0.0 112.102 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -173.5 85.57 0.05 Allowed 'General case' 0 C--O 1.22 -0.475 0 O-C-N 128.235 3.459 . . . . 0.0 112.704 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.683 ' CE1' HD22 ' A' ' 94' ' ' LEU . 35.9 t80 -108.36 119.18 38.75 Favored 'General case' 0 CA--C 1.502 -0.899 0 O-C-N 127.623 3.077 . . . . 0.0 113.99 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -128.15 100.72 5.97 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.536 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -78.21 124.1 27.68 Favored 'General case' 0 C--O 1.217 -0.638 0 O-C-N 129.019 3.95 . . . . 0.0 106.203 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.462 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -132.35 138.22 47.68 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 126.519 2.387 . . . . 0.0 111.232 -179.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.7 t -100.1 143.74 29.95 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 125.936 2.023 . . . . 0.0 110.11 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -118.16 37.54 3.97 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 112.148 -2.296 . . . . 0.0 115.626 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.464 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 63.3 m -96.51 106.79 19.1 Favored 'General case' 0 N--CA 1.476 0.864 1 O-C-N 131.643 5.589 . . . . 0.0 106.318 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.5 m -43.69 -48.42 7.88 Favored 'General case' 0 CA--C 1.501 -0.919 0 O-C-N 127.942 3.277 . . . . 0.0 110.761 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.746 ' N ' HD21 ' A' ' 37' ' ' LEU . 0.2 OUTLIER -50.89 -37.2 42.21 Favored 'General case' 0 C--N 1.365 1.245 0 O-C-N 126.421 2.325 . . . . 0.0 111.692 -179.714 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -169.31 124.84 0.87 Allowed 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 129.926 4.516 . . . . 0.0 117.941 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -115.56 79.07 1.24 Allowed 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 111.231 -2.713 . . . . 0.0 108.86 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -62.01 -47.31 85.34 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 126.934 2.646 . . . . 0.0 106.69 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 52.83 123.2 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 130.098 4.624 . . . . 0.0 117.154 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.915 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -86.06 95.04 9.4 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 127.173 2.796 . . . . 0.0 109.256 178.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -131.39 92.38 3.17 Favored 'General case' 0 C--O 1.208 -1.105 0 C-N-CA 116.409 -2.116 . . . . 0.0 109.597 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.433 ' CE2' ' HB ' ' A' ' 87' ' ' VAL . 0.1 OUTLIER -143.37 -141.78 0.13 Allowed 'General case' 0 CA--C 1.484 -1.582 0 CA-C-N 112.566 -2.106 . . . . 0.0 111.114 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.608 HG22 HG23 ' A' ' 69' ' ' VAL 0.26 0.8 OUTLIER -158.83 159.79 35.48 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 179.819 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.571 ' HA ' HG22 ' A' ' 87' ' ' VAL . 15.4 t -77.42 144.73 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.717 0 O-C-N 125.03 1.457 . . . . 0.0 111.732 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 75.21 1.48 64.12 Favored Glycine 0 CA--C 1.491 -1.434 0 CA-C-N 109.916 -3.311 . . . . 0.0 116.397 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.608 HG23 HG22 ' A' ' 66' ' ' THR 0.305 1.4 t -67.54 -45.77 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 CA-C-N 112.374 -1.913 . . . . 0.0 107.527 -179.944 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 72.9 92.3 0.08 Allowed 'General case' 0 C--N 1.353 0.72 0 CA-C-N 109.613 -3.449 . . . . 0.0 109.898 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.537 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.5 m-30 -71.55 82.82 0.83 Allowed 'General case' 0 C--N 1.356 0.879 0 O-C-N 128.085 3.366 . . . . 0.0 111.013 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 12.7 p30 -56.22 79.29 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 113.707 -1.588 . . . . 0.0 111.736 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 1.4 mt-10 56.38 89.71 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 123.182 1.468 . . . . 0.0 109.936 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.4 ' CD2' ' CE2' ' A' ' 71' ' ' PHE . 1.3 t60 -163.68 98.44 0.88 Allowed 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 111.69 -2.505 . . . . 0.0 115.107 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.42 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -127.81 -60.61 1.15 Allowed 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.33 -1.305 . . . . 0.0 111.139 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.437 ' HA ' ' HA2' ' A' ' 80' ' ' GLY . 0.1 OUTLIER 49.27 -178.86 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 128.428 3.966 . . . . 0.0 116.248 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.55 -84.7 0.27 Allowed Glycine 0 C--O 1.211 -1.326 0 CA-C-N 108.833 -3.803 . . . . 0.0 112.747 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.502 ' O ' HD12 ' A' ' 26' ' ' ILE . 5.4 tp -57.72 -60.98 2.87 Favored 'General case' 0 N--CA 1.451 -0.376 1 CA-C-N 107.481 -4.359 . . . . 0.0 114.285 179.874 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.662 ' HB2' HD13 ' A' ' 24' ' ' LEU . 8.1 t0 -115.09 -54.79 2.53 Favored 'General case' 0 CA--C 1.494 -1.187 0 O-C-N 126.928 2.642 . . . . 0.0 110.594 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 76' ' ' LYS . . . 68.64 89.25 0.07 OUTLIER Glycine 0 N--CA 1.473 1.129 0 CA-C-N 112.133 -2.303 . . . . 0.0 111.651 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.402 ' HD3' ' HA ' ' A' ' 81' ' ' ARG . 12.9 tpp85 -129.4 -131.65 0.21 Allowed 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 111.743 -2.228 . . . . 0.0 112.139 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.491 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 6.9 p-10 -164.09 81.05 0.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 117.997 -1.481 . . . . 0.0 107.729 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.466 HG12 ' C ' ' A' ' 99' ' ' LYS . 0.1 OUTLIER -126.31 133.41 68.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.505 0 N-CA-C 118.754 2.872 . . . . 0.0 118.754 -179.36 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.446 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -61.53 90.36 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.705 0 O-C-N 128.595 3.684 . . . . 0.0 107.421 179.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.537 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 94.6 m -86.73 58.14 4.89 Favored 'General case' 0 C--O 1.201 -1.49 0 CA-C-N 109.648 -3.433 . . . . 0.0 113.818 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.595 HD21 ' OG1' ' A' ' 88' ' ' THR . 8.4 tt -62.82 144.6 56.41 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 109.141 -3.663 . . . . 0.0 112.81 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.571 HG22 ' HA ' ' A' ' 67' ' ' VAL . 2.0 p -130.7 132.76 64.08 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 CA-C-N 110.812 -2.904 . . . . 0.0 109.466 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.595 ' OG1' HD21 ' A' ' 86' ' ' LEU 0.256 90.1 m -153.82 169.63 22.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 111.477 -2.601 . . . . 0.0 110.716 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.624 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 23.8 m95 -98.38 138.96 34.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 C-N-CA 128.55 2.74 . . . . 0.0 106.22 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.671 ' HB2' HG23 ' A' ' 95' ' ' VAL . 1.6 tt0 -95.96 -47.08 6.27 Favored 'General case' 0 CA--C 1.479 -1.773 1 CA-C-O 128.776 4.131 . . . . 0.0 116.292 -179.55 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -176.43 -51.65 0.06 OUTLIER Glycine 0 C--O 1.197 -2.196 0 CA-C-N 109.302 -3.59 . . . . 0.0 106.333 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.01 31.49 1.78 Allowed 'General case' 0 C--O 1.209 -1.036 1 O-C-N 131.945 5.144 . . . . 0.0 111.176 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.4 ' O ' ' N ' ' A' ' 90' ' ' GLU . 0.8 OUTLIER -167.83 165.46 13.97 Favored 'General case' 0 C--O 1.202 -1.425 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.683 HD22 ' CE1' ' A' ' 50' ' ' PHE . 2.1 tp -95.12 86.17 4.52 Favored 'General case' 0 C--O 1.204 -1.314 0 CA-C-N 111.138 -2.756 . . . . 0.0 117.477 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.671 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.344 2.5 t -82.25 125.82 39.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.737 0 CA-C-N 109.653 -3.43 . . . . 0.0 111.976 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.429 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 14.3 m -132.49 129.13 38.77 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 125.727 2.679 . . . . 0.0 105.24 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -114.19 77.57 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.58 0 CA-C-N 110.754 -2.93 . . . . 0.0 118.902 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.414 ' HB3' ' HB2' ' A' ' 105' ' ' ARG . 2.3 tt0 -60.62 111.44 1.61 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 119.682 -1.886 . . . . 0.0 108.088 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.466 ' C ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.27 143.5 35.96 Favored 'General case' 0 C--O 1.195 -1.813 0 C-N-CA 113.744 -3.182 . . . . 0.0 113.306 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 146.39 137.87 3.1 Favored Glycine 0 C--O 1.213 -1.159 0 C-N-CA 119.259 -1.448 . . . . 0.0 111.032 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 66.88 -59.92 0.36 Allowed 'General case' 0 C--N 1.353 0.753 0 CA-C-N 110.206 -2.997 . . . . 0.0 112.179 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.19 -31.81 0.05 Allowed 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.29 146.69 54.31 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 125.879 2.752 . . . . 0.0 117.311 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.404 ' O ' ' N ' ' A' ' 122' ' ' CYS . 11.6 m-20 -127.25 78.97 1.85 Allowed 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.224 -4.989 . . . . 0.0 101.683 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.414 ' HB2' ' HB3' ' A' ' 98' ' ' GLN . 6.9 mmm180 -98.42 3.11 48.39 Favored 'General case' 0 C--O 1.199 -1.602 1 O-C-N 131.078 5.237 . . . . 0.0 112.664 -179.634 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -33.56 85.66 0.01 OUTLIER Glycine 0 N--CA 1.428 -1.884 2 O-C-N 133.004 6.44 . . . . 0.0 114.929 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.915 ' CZ2' HD21 ' A' ' 63' ' ' LEU 0.273 0.0 OUTLIER -97.42 129.56 44.63 Favored 'General case' 0 C--O 1.197 -1.669 0 O-C-N 129.934 3.961 . . . . 0.0 109.807 179.308 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.03 156.67 36.33 Favored 'General case' 0 C--O 1.211 -0.942 0 O-C-N 129.011 3.944 . . . . 0.0 115.951 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.431 ' NE2' ' CD1' ' A' ' 107' ' ' TRP 0.299 39.2 mm-40 -114.05 165.97 12.09 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 111.201 -2.727 . . . . 0.0 110.927 -177.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -175.76 95.71 0.06 Allowed 'General case' 0 C--O 1.213 -0.858 1 O-C-N 129.986 4.553 . . . . 0.0 116.009 177.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.415 ' H ' HG23 ' A' ' 111' ' ' VAL . 48.3 t -38.85 98.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.91 0 CA-C-O 127.036 3.303 . . . . 0.0 112.277 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -104.2 56.19 0.72 Allowed 'General case' 0 CA--C 1.488 -1.408 0 CA-C-N 109.361 -3.563 . . . . 0.0 117.235 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 105.17 -111.61 3.79 Favored Glycine 0 C--O 1.205 -1.712 0 CA-C-N 113.593 -1.639 . . . . 0.0 113.09 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -112.74 19.36 17.49 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 117.413 2.375 . . . . 0.0 117.413 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.495 ' HB2' ' HB2' ' A' ' 131' ' ' PHE . 4.5 pttt -158.91 163.43 36.56 Favored 'General case' 0 N--CA 1.476 0.825 2 O-C-N 131.189 5.306 . . . . 0.0 109.807 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.488 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 4.8 mt -105.39 173.13 6.44 Favored 'General case' 0 CA--C 1.494 -1.206 0 O-C-N 127.104 2.753 . . . . 0.0 112.503 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -133.9 93.73 3.15 Favored 'General case' 0 C--O 1.206 -1.206 0 O-C-N 127.95 3.281 . . . . 0.0 113.803 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.657 HD13 ' CZ ' ' A' ' 131' ' ' PHE . 2.3 mp -79.6 70.93 6.17 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 111.467 -2.606 . . . . 0.0 106.479 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -85.6 108.14 17.84 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 127.387 2.929 . . . . 0.0 109.075 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.505 HD21 ' HB3' ' A' ' 127' ' ' CYS . 0.6 OUTLIER -126.28 177.78 6.22 Favored 'General case' 0 N--CA 1.484 1.275 1 O-C-N 130.091 4.619 . . . . 0.0 113.013 179.83 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.1 m -125.76 170.55 11.46 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 110.593 -3.003 . . . . 0.0 105.364 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 104' ' ' ASN . 0.2 OUTLIER -169.37 38.37 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 123.888 1.804 . . . . 0.0 111.592 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 117.18 -67.3 0.32 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 112.735 -2.03 . . . . 0.0 108.257 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -173.8 43.34 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.005 0 CA-C-N 109.661 -3.269 . . . . 0.0 109.932 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -120.86 4.89 10.49 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 111.669 -2.514 . . . . 0.0 110.006 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.51 ' O ' HG22 ' A' ' 126' ' ' VAL . 8.0 p 6.67 71.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 O-C-N 128.433 3.583 . . . . 0.0 114.925 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.505 ' HB3' HD21 ' A' ' 120' ' ' LEU . 0.5 OUTLIER -66.11 142.82 57.64 Favored 'General case' 0 C--O 1.219 -0.538 0 O-C-N 120.441 -1.412 . . . . 0.0 111.142 -179.532 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.61 147.54 48.68 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 128.432 3.583 . . . . 0.0 110.949 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -122.7 171.06 9.43 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 118.312 -1.355 . . . . 0.0 112.654 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.15 138.3 30.15 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.422 0 N-CA-C 103.543 -2.762 . . . . 0.0 103.543 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.657 ' CZ ' HD13 ' A' ' 118' ' ' LEU . 45.5 m-85 -126.31 179.97 5.03 Favored 'General case' 0 CA--C 1.488 -1.426 0 CA-C-O 128.149 3.833 . . . . 0.0 117.965 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.29 0.0 OUTLIER -161.89 113.35 1.68 Allowed 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 111.196 -2.729 . . . . 0.0 103.773 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.592 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 33.3 ttpt -58.07 89.77 0.01 OUTLIER 'General case' 0 C--O 1.194 -1.867 0 O-C-N 126.654 2.471 . . . . 0.0 115.299 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt . . . . . 0 C--O 1.26 1.616 0 O-C-N 127.866 3.229 . . . . 0.0 117.906 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.507 2.415 0 CA-C-O 123.052 1.406 . . . . 0.0 109.886 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.4 m -146.4 -54.47 0.26 Allowed 'General case' 0 C--O 1.21 -1.013 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.494 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -140.04 -175.5 4.26 Favored 'General case' 0 CA--C 1.491 -1.326 0 C-N-CA 116.268 -2.173 . . . . 0.0 113.096 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -72.02 -151.86 0.02 OUTLIER 'General case' 0 C--O 1.24 0.562 0 N-CA-C 104.531 -2.396 . . . . 0.0 104.531 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -171.14 135.89 1.03 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 103.28 -2.859 . . . . 0.0 103.28 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -51.43 124.76 12.71 Favored 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 131.456 5.472 . . . . 0.0 113.345 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.11 -173.95 43.97 Favored Glycine 0 C--O 1.206 -1.647 0 CA-C-O 116.426 -2.319 . . . . 0.0 113.895 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.702 HG23 HG23 ' A' ' 40' ' ' THR . 1.2 m -127.18 124.37 38.86 Favored 'General case' 0 C--O 1.209 -1.036 1 O-C-N 132.911 5.712 . . . . 0.0 104.937 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.509 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -118.0 90.35 3.31 Favored 'General case' 0 CA--C 1.493 -1.249 1 O-C-N 129.224 4.077 . . . . 0.0 114.467 179.882 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -57.57 100.19 0.05 OUTLIER 'General case' 0 C--O 1.218 -0.579 0 O-C-N 126.901 2.626 . . . . 0.0 108.039 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.408 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -33.37 -58.04 0.4 Allowed 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.04 3.337 . . . . 0.0 107.335 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 90.37 -28.21 0.04 OUTLIER 'General case' 0 C--O 1.199 -1.603 1 O-C-N 131.818 5.699 . . . . 0.0 111.006 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.256 3.3 p -175.7 177.25 1.75 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 124.513 2.102 . . . . 0.0 110.882 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -146.08 168.86 19.9 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 108.828 -3.805 . . . . 0.0 111.458 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -102.18 -107.09 0.25 Allowed 'General case' 0 CA--C 1.477 -1.841 2 O-C-N 133.237 6.586 . . . . 0.0 111.828 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -84.77 87.03 7.28 Favored 'General case' 0 C--O 1.21 -1.013 0 O-C-N 118.783 -2.448 . . . . 0.0 110.464 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.44 -52.23 65.45 Favored 'General case' 0 C--O 1.207 -1.176 0 CA-C-O 127.584 3.564 . . . . 0.0 112.62 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.469 ' CG ' ' HG3' ' A' ' 31' ' ' ARG . 1.1 mp0 -62.06 -51.79 66.54 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 112.297 -2.229 . . . . 0.0 116.379 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.483 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -53.07 -21.65 11.23 Favored Glycine 0 CA--C 1.484 -1.86 1 O-C-N 129.563 4.289 . . . . 0.0 113.651 -179.931 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.456 ' CD1' ' C ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -73.81 -45.7 49.81 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 126.237 2.922 . . . . 0.0 105.654 179.615 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.519 ' O ' HG22 ' A' ' 26' ' ' ILE . 24.6 mtm -71.73 -25.38 62.04 Favored 'General case' 0 CA--C 1.491 -1.313 0 CA-C-N 112.543 -2.117 . . . . 0.0 112.066 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.483 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 1.0 OUTLIER -79.73 -33.92 40.42 Favored 'General case' 0 C--O 1.215 -0.753 0 O-C-N 128.024 3.327 . . . . 0.0 114.989 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.97 78.0 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 109.462 -3.517 . . . . 0.0 113.675 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.661 ' O ' HD12 ' A' ' 24' ' ' LEU . 1.1 pp -84.19 -7.15 59.44 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 128.304 3.502 . . . . 0.0 108.093 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 46.35 93.67 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.59 0 CA-C-O 127.269 3.414 . . . . 0.0 111.105 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.519 HG22 ' O ' ' A' ' 21' ' ' MET . 19.7 tt -111.07 28.45 2.07 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 1 CA-C-O 129.093 4.282 . . . . 0.0 108.869 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.443 ' C ' ' CD1' ' A' ' 28' ' ' PHE . 30.5 m-20 77.03 53.35 0.04 OUTLIER 'General case' 0 C--N 1.361 1.1 0 CA-C-N 108.637 -3.892 . . . . 0.0 110.427 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.605 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER 12.15 69.97 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.104 1 O-C-N 130.319 4.762 . . . . 0.0 117.374 179.036 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.87 -175.01 2.91 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 112.591 -2.095 . . . . 0.0 106.677 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.474 HG21 HH21 ' A' ' 59' ' ' ARG . 3.2 m 93.57 -20.51 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 2 O-C-N 132.95 6.406 . . . . 0.0 114.707 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.511 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -77.53 -171.4 2.14 Favored 'General case' 0 N--CA 1.44 -0.936 1 O-C-N 130.83 5.081 . . . . 0.0 110.839 179.737 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.3 OUTLIER 75.75 21.26 1.69 Allowed 'General case' 0 CA--C 1.498 -1.034 0 O-C-N 128.749 3.78 . . . . 0.0 113.643 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.501 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -170.12 -40.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 O-C-N 128.917 3.886 . . . . 0.0 113.268 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.492 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -72.77 -12.91 61.19 Favored 'General case' 0 C--O 1.209 -1.048 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.56 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -15.03 -48.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 O-C-N 128.789 3.806 . . . . 0.0 114.659 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 14.7 tpt180 -177.79 144.56 0.37 Allowed 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 127.321 2.888 . . . . 0.0 115.219 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.788 ' C ' HD12 ' A' ' 37' ' ' LEU . 1.1 pp -175.52 147.96 0.88 Allowed 'General case' 0 CA--C 1.539 0.532 2 O-C-N 130.675 4.984 . . . . 0.0 109.005 178.73 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 m 1.97 58.42 0.0 OUTLIER 'General case' 0 CA--C 1.482 -1.653 1 O-C-N 133.467 6.729 . . . . 0.0 112.982 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 37' ' ' LEU . 1.4 tp60 -74.19 137.94 43.44 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.702 HG23 HG23 ' A' ' 8' ' ' THR . 2.9 m -150.6 124.28 9.13 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 109.524 -3.489 . . . . 0.0 114.782 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.68 ' NZ ' HD21 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -109.99 156.85 19.95 Favored 'General case' 0 N--CA 1.49 1.553 1 O-C-N 129.55 4.281 . . . . 0.0 101.938 179.044 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.53 HD12 ' HG2' ' A' ' 53' ' ' LYS . 66.3 mt -149.18 157.71 6.68 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 O-C-N 126.717 2.511 . . . . 0.0 112.198 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.503 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -142.02 135.79 29.24 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.472 0 CA-C-N 109.014 -3.721 . . . . 0.0 105.981 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.1 t -119.35 -32.62 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.194 0 CA-C-N 112.032 -2.349 . . . . 0.0 116.449 -178.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 23.45 72.09 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 117.426 2.38 . . . . 0.0 117.426 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -18.75 64.89 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 108.705 -3.861 . . . . 0.0 110.744 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 153.96 -95.92 0.16 Allowed Glycine 0 C--O 1.2 -2.016 0 CA-C-N 113.637 -1.619 . . . . 0.0 114.23 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -82.05 -27.44 32.99 Favored 'General case' 0 C--O 1.22 -0.497 0 O-C-N 125.874 1.573 . . . . 0.0 111.124 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -95.7 99.22 11.09 Favored 'General case' 0 CA--C 1.54 0.591 1 O-C-N 129.601 4.313 . . . . 0.0 108.462 179.32 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.554 ' CD2' HD13 ' A' ' 94' ' ' LEU . 90.5 t80 -100.38 104.16 15.58 Favored 'General case' 0 C--N 1.31 -1.109 0 O-C-N 128.447 3.592 . . . . 0.0 114.526 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 36.9 mttm -125.72 83.03 2.12 Favored 'General case' 0 CA--C 1.496 -1.115 1 O-C-N 129.181 4.051 . . . . 0.0 119.097 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.682 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.09 151.85 46.4 Favored 'General case' 0 C--N 1.362 1.146 1 O-C-N 129.281 4.113 . . . . 0.0 106.373 179.664 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.53 ' HG2' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -144.84 165.44 28.12 Favored 'General case' 0 CA--C 1.49 -1.342 0 C-N-CA 115.328 -2.549 . . . . 0.0 111.901 -179.477 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -129.8 137.05 50.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 125.234 2.445 . . . . 0.0 108.171 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -119.7 51.15 1.19 Allowed 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 110.799 -2.91 . . . . 0.0 115.725 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.45 115.05 27.69 Favored 'General case' 0 N--CA 1.483 1.192 1 O-C-N 133.832 6.957 . . . . 0.0 105.178 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.3 p -45.11 -44.36 10.46 Favored 'General case' 0 CA--C 1.511 -0.541 1 O-C-N 129.361 4.163 . . . . 0.0 110.296 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.742 ' CE2' HD23 ' A' ' 37' ' ' LEU . 6.3 m-85 -48.75 -71.57 0.06 Allowed 'General case' 0 C--N 1.366 1.311 0 O-C-N 128.433 3.583 . . . . 0.0 110.499 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.474 HH21 HG21 ' A' ' 30' ' ' THR . 9.2 mmt180 -128.44 133.29 48.51 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-N 108.876 -3.784 . . . . 0.0 113.257 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -136.39 83.53 2.01 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 126.821 2.576 . . . . 0.0 107.32 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -99.37 -37.37 9.26 Favored 'General case' 0 C--N 1.32 -0.677 0 O-C-N 127.952 3.283 . . . . 0.0 108.672 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.63 152.01 0.06 Allowed 'General case' 0 C--O 1.199 -1.556 0 O-C-N 128.527 3.642 . . . . 0.0 116.684 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.682 ' HB2' HG22 ' A' ' 52' ' ' THR . 7.3 tp -99.33 73.88 1.9 Allowed 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 112.577 -2.101 . . . . 0.0 110.908 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.86 100.26 9.49 Favored 'General case' 0 CA--C 1.487 -1.449 0 O-C-N 126.998 2.686 . . . . 0.0 113.148 -179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.53 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 21.0 m-85 -127.01 -175.23 3.36 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 126.093 2.854 . . . . 0.0 106.994 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -134.75 115.24 13.51 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 102.351 -3.203 . . . . 0.0 102.351 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.54 HG21 ' CD1' ' A' ' 89' ' ' TRP . 2.4 p -46.72 123.84 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.483 -1.616 0 O-C-N 126.954 2.659 . . . . 0.0 116.083 -179.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 60.8 53.8 42.24 Favored Glycine 0 CA--C 1.487 -1.683 0 O-C-N 127.324 2.89 . . . . 0.0 117.923 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 69' ' ' VAL 0.277 1.8 p -122.26 10.25 5.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.354 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 52.44 72.9 0.37 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.377 5.423 . . . . 0.0 108.308 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.531 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 7.7 t80 -63.71 82.16 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.066 0 CA-C-N 108.582 -3.917 . . . . 0.0 118.325 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -65.13 84.94 0.05 Allowed 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 123.436 1.588 . . . . 0.0 109.417 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.534 ' HG2' HG23 ' A' ' 75' ' ' THR . 32.3 tt0 -71.14 148.91 46.92 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-O 124.819 2.247 . . . . 0.0 108.168 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 82' ' ' ASN . 2.9 m80 -140.6 59.39 1.55 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-N 110.257 -3.156 . . . . 0.0 109.852 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.534 HG23 ' HG2' ' A' ' 73' ' ' GLU . 27.9 p -35.22 146.65 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 110.391 -3.095 . . . . 0.0 114.73 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.81 144.04 0.07 Allowed 'General case' 0 C--O 1.212 -0.911 0 O-C-N 128.994 3.934 . . . . 0.0 111.396 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.91 2.48 64.66 Favored Glycine 0 C--O 1.205 -1.675 0 CA-C-N 111.55 -2.568 . . . . 0.0 107.43 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 tp -147.99 -57.86 0.24 Allowed 'General case' 0 CA--C 1.506 -0.72 1 O-C-N 131.185 4.697 . . . . 0.0 117.266 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -111.13 -62.59 1.52 Allowed 'General case' 0 CA--C 1.502 -0.875 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.06 64.79 1.29 Allowed Glycine 0 N--CA 1.476 1.365 0 CA-C-O 126.171 3.095 . . . . 0.0 109.808 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.42 ' N ' ' OG1' ' A' ' 75' ' ' THR . 5.4 tpt180 -145.75 -131.63 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 109.166 -3.517 . . . . 0.0 112.635 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.443 ' HA ' ' HA ' ' A' ' 74' ' ' HIS . 1.2 p-10 -164.15 -100.78 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 115.114 -2.374 . . . . 0.0 108.294 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.418 HG13 ' C ' ' A' ' 99' ' ' LYS . 21.2 t 91.82 146.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.339 0 O-C-N 128.544 3.653 . . . . 0.0 117.027 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.86 87.31 6.6 Favored 'General case' 0 C--O 1.219 -0.522 2 O-C-N 129.398 4.186 . . . . 0.0 107.289 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.531 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 61.7 m -96.41 86.15 4.1 Favored 'General case' 0 C--O 1.202 -1.404 0 O-C-N 128.229 3.456 . . . . 0.0 112.091 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 tp -87.24 94.69 9.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 108.595 -3.911 . . . . 0.0 116.259 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.2 t -74.4 141.74 15.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 O-C-N 119.586 -1.946 . . . . 0.0 108.763 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.587 HG23 ' HB ' ' A' ' 95' ' ' VAL . 9.3 t -164.04 172.73 13.44 Favored 'General case' 0 CA--C 1.488 -1.43 0 CA-C-O 126.87 3.224 . . . . 0.0 110.833 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.696 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 49.7 m95 -98.71 136.93 38.05 Favored 'General case' 0 N--CA 1.437 -1.101 0 O-C-N 117.916 -2.99 . . . . 0.0 109.377 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 1.034 ' HB2' HG23 ' A' ' 93' ' ' THR . 0.3 OUTLIER -93.1 -11.15 33.64 Favored 'General case' 0 CA--C 1.475 -1.94 1 CA-C-O 133.642 6.449 . . . . 0.0 113.966 179.569 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.34 -42.18 1.33 Allowed Glycine 0 C--O 1.198 -2.152 1 CA-C-N 107.588 -4.369 . . . . 0.0 104.594 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.406 ' C ' HG22 ' A' ' 93' ' ' THR . 0.2 OUTLIER -152.85 60.8 0.79 Allowed 'General case' 0 C--O 1.204 -1.312 1 O-C-N 131.594 4.938 . . . . 0.0 110.577 -179.768 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 1.034 HG23 ' HB2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.91 130.5 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.124 0 O-C-N 127.084 2.74 . . . . 0.0 118.048 -179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.554 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -74.13 92.32 2.18 Favored 'General case' 0 CA--C 1.505 -0.774 1 O-C-N 130.323 4.765 . . . . 0.0 110.758 179.787 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.945 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.284 79.5 t -90.36 140.6 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 1 O-C-N 130.655 4.972 . . . . 0.0 115.248 -179.75 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.45 ' HB3' ' CZ3' ' A' ' 107' ' ' TRP . 4.5 t -143.95 122.71 12.63 Favored 'General case' 0 C--O 1.195 -1.778 0 O-C-N 125.573 1.796 . . . . 0.0 106.328 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 3.4 t -101.34 105.2 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.862 0 CA-C-N 111.172 -2.74 . . . . 0.0 111.902 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.509 ' NE2' ' HB3' ' A' ' 105' ' ' ARG . 5.1 mt-30 -86.29 100.79 12.53 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 123.822 1.772 . . . . 0.0 109.88 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.418 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.4 OUTLIER -97.12 96.75 8.67 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 110.037 -3.256 . . . . 0.0 110.507 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -93.29 -97.67 1.48 Allowed Glycine 0 C--O 1.206 -1.646 0 CA-C-N 112.719 -2.037 . . . . 0.0 110.891 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.64 -53.17 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 108.974 -3.613 . . . . 0.0 109.244 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -94.02 -39.61 10.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 111.047 -2.797 . . . . 0.0 112.833 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -115.96 146.63 41.94 Favored 'General case' 0 C--O 1.207 -1.138 0 CA-C-N 111.163 -2.744 . . . . 0.0 114.899 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -106.07 97.54 7.34 Favored 'General case' 0 N--CA 1.478 0.957 2 O-C-N 130.29 4.743 . . . . 0.0 102.9 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.509 ' HB3' ' NE2' ' A' ' 98' ' ' GLN . 0.1 OUTLIER -101.5 5.46 41.89 Favored 'General case' 0 C--O 1.214 -0.781 1 O-C-N 130.483 4.864 . . . . 0.0 110.065 -179.724 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.464 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -45.75 93.68 0.01 OUTLIER Glycine 0 N--CA 1.426 -2.012 2 O-C-N 132.393 6.058 . . . . 0.0 114.277 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.6 ' HE1' ' NE2' ' A' ' 109' ' ' GLN 0.289 0.0 OUTLIER -108.24 136.32 48.09 Favored 'General case' 0 C--O 1.214 -0.802 1 O-C-N 132.262 5.331 . . . . 0.0 110.304 179.808 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.39 159.33 43.52 Favored 'General case' 0 CA--C 1.506 -0.728 1 O-C-N 131.121 5.263 . . . . 0.0 113.391 -178.637 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.6 ' NE2' ' HE1' ' A' ' 107' ' ' TRP 0.279 1.0 OUTLIER -134.04 123.53 24.68 Favored 'General case' 0 C--N 1.368 1.371 0 C-N-CA 115.999 -2.28 . . . . 0.0 111.172 -178.393 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.516 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -117.46 171.32 8.07 Favored 'General case' 0 CA--C 1.498 -1.031 0 O-C-N 128.987 3.93 . . . . 0.0 112.163 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.1 t -109.57 98.81 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.905 0 CA-C-O 124.499 2.095 . . . . 0.0 112.443 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -108.14 85.68 2.16 Favored 'General case' 0 CA--C 1.479 -1.766 0 CA-C-O 125.816 2.722 . . . . 0.0 113.317 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 90.25 -109.28 3.63 Favored Glycine 0 C--O 1.2 -2.024 0 CA-C-N 113.027 -1.897 . . . . 0.0 115.439 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -105.93 -7.78 17.99 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 114.572 -2.632 . . . . 0.0 113.829 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -127.1 174.06 9.2 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 133.132 6.52 . . . . 0.0 110.227 179.954 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.68 HD21 ' NZ ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -136.43 128.26 29.21 Favored 'General case' 0 C--O 1.202 -1.429 0 O-C-N 124.787 1.305 . . . . 0.0 110.517 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.516 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.1 m-85 -78.57 167.17 21.66 Favored 'General case' 0 C--O 1.202 -1.44 0 O-C-N 128.618 3.699 . . . . 0.0 110.11 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.565 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -140.45 59.54 1.55 Allowed 'General case' 0 CA--C 1.509 -0.624 1 CA-C-N 107.291 -4.504 . . . . 0.0 108.079 -179.845 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.2 109.26 1.48 Allowed 'General case' 0 CA--C 1.506 -0.722 0 O-C-N 127.525 3.016 . . . . 0.0 110.525 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.13 148.98 39.75 Favored 'General case' 0 CA--C 1.487 -1.461 1 O-C-N 130.044 4.59 . . . . 0.0 109.902 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 45.5 m -118.47 162.03 19.02 Favored 'General case' 0 C--O 1.208 -1.113 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -161.25 33.52 0.14 Allowed 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 124.2 1.952 . . . . 0.0 113.941 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 104.04 -94.49 1.08 Allowed Glycine 0 CA--C 1.505 -0.531 0 CA-C-N 111.428 -2.624 . . . . 0.0 112.272 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -78.85 -31.58 45.69 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 112.171 -2.014 . . . . 0.0 111.625 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -103.33 176.87 5.01 Favored 'General case' 0 C--O 1.214 -0.785 1 O-C-N 129.104 4.003 . . . . 0.0 109.332 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.1 m -156.19 87.03 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 CA-C-N 108.842 -3.799 . . . . 0.0 111.672 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 t -66.49 113.71 4.93 Favored 'General case' 0 CA--C 1.489 -1.392 0 C-N-CA 125.58 1.552 . . . . 0.0 112.765 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.73 93.58 9.31 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 117.612 -1.635 . . . . 0.0 110.858 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.501 ' OE1' HD13 ' A' ' 118' ' ' LEU . 51.6 mt-30 -75.82 165.54 24.86 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 117.532 2.419 . . . . 0.0 117.532 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.508 ' C ' ' CD1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -132.46 150.11 32.97 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.428 0 CA-C-O 124.373 2.035 . . . . 0.0 109.058 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.565 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 88.7 m-85 -148.89 175.13 11.53 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 110.854 -2.884 . . . . 0.0 116.509 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.492 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -155.78 137.05 13.88 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 111.9 -2.409 . . . . 0.0 104.98 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.443 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 5.7 ttpt -77.74 94.91 4.54 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 118.185 2.661 . . . . 0.0 118.185 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt . . . . . 0 C--O 1.259 1.557 0 CA-C-O 114.895 -2.479 . . . . 0.0 116.852 179.857 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mtt . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.577 HG22 ' HB3' ' A' ' 92' ' ' ASN . 1.3 p -110.82 177.92 4.52 Favored 'General case' 0 C--O 1.205 -1.271 0 O-C-N 127.642 3.089 . . . . 0.0 110.784 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 mttt 55.87 76.99 0.25 Allowed 'General case' 0 CA--C 1.492 -1.275 0 O-C-N 126.878 2.611 . . . . 0.0 114.974 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -67.92 -53.36 27.0 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.24 169.67 0.3 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 126.956 2.66 . . . . 0.0 107.468 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 26.31 120.04 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.43 1 O-C-N 129.361 4.163 . . . . 0.0 117.876 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -169.51 -128.32 1.0 Allowed Glycine 0 CA--C 1.532 1.112 0 CA-C-N 112.267 -2.242 . . . . 0.0 114.2 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.538 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 3.7 t 168.63 147.74 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.948 1 O-C-N 133.323 5.954 . . . . 0.0 106.479 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.538 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -145.72 103.02 3.74 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.496 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.423 ' O ' ' N ' ' A' ' 12' ' ' GLU 0.259 1.8 mt-10 -64.56 92.49 0.09 Allowed 'General case' 0 C--O 1.213 -0.861 0 O-C-N 126.72 2.513 . . . . 0.0 108.52 -179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.594 ' HG3' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -42.26 96.01 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 1 O-C-N 130.227 4.704 . . . . 0.0 103.81 -179.917 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' GLU . 27.8 tt0 -35.81 -37.45 0.1 Allowed 'General case' 0 C--O 1.21 -1.014 1 O-C-N 130.383 4.802 . . . . 0.0 107.403 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.263 4.6 p 173.55 141.08 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 110.723 -2.944 . . . . 0.0 110.327 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -96.69 130.37 43.93 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 111.746 -2.479 . . . . 0.0 110.913 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -116.77 140.64 49.2 Favored 'General case' 0 CA--C 1.499 -1.01 0 O-C-N 128.047 3.342 . . . . 0.0 110.563 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 49.53 69.7 0.57 Allowed 'General case' 0 C--O 1.205 -1.287 0 CA-C-O 126.146 2.879 . . . . 0.0 109.963 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -95.38 -40.44 9.51 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 111.41 -2.632 . . . . 0.0 107.974 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -74.93 -39.13 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 111.183 -2.735 . . . . 0.0 111.089 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.09 -26.72 73.95 Favored Glycine 0 CA--C 1.487 -1.708 0 O-C-N 127.187 2.805 . . . . 0.0 110.771 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -71.61 -31.69 67.18 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-O 124.961 2.315 . . . . 0.0 109.054 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 12.0 mtt -75.11 -27.04 59.68 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.874 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -79.91 -31.24 40.15 Favored 'General case' 0 C--N 1.317 -0.814 1 O-C-N 133.475 6.734 . . . . 0.0 114.92 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.64 -41.82 91.38 Favored 'General case' 0 C--O 1.208 -1.086 2 O-C-N 130.835 5.084 . . . . 0.0 113.621 -179.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.718 HD11 ' HB ' ' A' ' 26' ' ' ILE . 1.5 pp -103.09 -8.26 20.67 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 110.623 -2.99 . . . . 0.0 109.543 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 49.17 99.18 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.155 1 CA-C-O 128.565 4.031 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.718 ' HB ' HD11 ' A' ' 24' ' ' LEU . 7.3 tt -124.53 42.67 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.484 0 CA-C-N 109.556 -3.474 . . . . 0.0 109.537 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 76.45 137.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.441 0 CA-C-N 110.339 -3.118 . . . . 0.0 107.479 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -106.0 -172.64 2.13 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 116.42 2.008 . . . . 0.0 116.42 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 58.03 30.85 19.85 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 124.443 2.068 . . . . 0.0 106.343 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.429 ' O ' HD11 ' A' ' 33' ' ' ILE . 0.5 OUTLIER -101.84 -16.05 16.7 Favored 'General case' 0 C--O 1.209 -1.057 1 CA-C-N 107.783 -4.281 . . . . 0.0 115.115 -179.916 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -86.57 -172.43 4.02 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 128.893 3.87 . . . . 0.0 109.949 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.46 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER 82.71 7.84 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 O-C-N 129.05 3.968 . . . . 0.0 113.254 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.429 HD11 ' O ' ' A' ' 30' ' ' THR . 0.3 OUTLIER -147.21 -41.46 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 128.561 3.663 . . . . 0.0 111.0 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.407 ' H ' HD12 ' A' ' 33' ' ' ILE . . . -90.5 24.93 2.44 Favored 'General case' 0 C--O 1.209 -1.032 0 CA-C-O 123.637 1.684 . . . . 0.0 113.865 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.436 ' C ' ' HD3' ' A' ' 36' ' ' ARG . 66.7 t -55.36 -27.41 20.48 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.399 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.203 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.436 ' HD3' ' C ' ' A' ' 35' ' ' VAL . 1.6 mpt_? 140.01 134.1 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.862 2 O-C-N 130.621 4.95 . . . . 0.0 108.975 179.141 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.516 ' CD2' ' CG ' ' A' ' 58' ' ' PHE . 0.3 OUTLIER -102.54 15.36 29.46 Favored 'General case' 0 N--CA 1.439 -1.019 2 O-C-N 130.377 4.798 . . . . 0.0 111.184 -179.703 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 173.54 -53.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.316 1 O-C-N 132.125 5.891 . . . . 0.0 111.113 179.64 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.433 ' NE2' ' HB3' ' A' ' 11' ' ' MET . 17.1 tt0 67.94 140.29 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.798 0 O-C-N 127.488 2.993 . . . . 0.0 115.439 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.0 m 162.42 109.39 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.82 1 O-C-N 131.189 5.305 . . . . 0.0 113.307 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.943 ' CE ' HD22 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -98.52 156.12 16.94 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 127.714 3.134 . . . . 0.0 106.764 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.488 HG22 ' N ' ' A' ' 43' ' ' ILE . 4.4 mp -135.99 162.94 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 O-C-N 128.58 3.675 . . . . 0.0 111.497 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.531 HD13 ' N ' ' A' ' 44' ' ' VAL 0.292 0.2 OUTLIER -134.5 133.25 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.566 1 CA-C-N 107.93 -4.214 . . . . 0.0 108.472 179.771 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.603 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.5 t -107.95 -64.71 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.312 0 CA-C-N 112.226 -2.261 . . . . 0.0 108.985 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.603 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.0 OUTLIER 56.01 91.96 0.03 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.01 -40.52 11.05 Favored 'General case' 0 CA--C 1.49 -1.328 2 O-C-N 131.031 5.207 . . . . 0.0 113.255 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -174.56 -93.23 0.09 OUTLIER Glycine 0 C--O 1.2 -1.977 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.808 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.51 -19.14 24.15 Favored 'General case' 0 C--O 1.217 -0.645 0 O-C-N 127.516 2.539 . . . . 0.0 110.332 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.43 110.93 23.29 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 129.078 3.986 . . . . 0.0 109.917 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.622 ' HD2' HD13 ' A' ' 94' ' ' LEU . 1.7 t80 -115.84 110.25 18.77 Favored 'General case' 0 CA--C 1.497 -1.061 0 O-C-N 127.53 3.019 . . . . 0.0 111.64 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 79.47 1.44 Allowed 'General case' 0 C--O 1.202 -1.401 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.85 160.75 5.49 Favored 'General case' 0 CA--C 1.506 -0.741 0 O-C-N 127.216 2.822 . . . . 0.0 107.507 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.423 ' NZ ' HD13 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -161.91 148.87 14.02 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 115.226 -2.59 . . . . 0.0 110.301 -179.254 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 t -103.83 136.73 42.95 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-O 124.135 1.922 . . . . 0.0 109.618 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -92.55 6.86 45.67 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 115.908 -1.996 . . . . 0.0 113.038 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.4 m -47.61 102.85 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 O-C-N 131.638 5.587 . . . . 0.0 104.872 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 p -33.13 -43.82 0.11 Allowed 'General case' 0 C--O 1.212 -0.89 1 O-C-N 131.479 5.487 . . . . 0.0 109.364 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.516 ' CG ' ' CD2' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -51.37 -68.19 0.19 Allowed 'General case' 0 C--N 1.35 0.62 0 O-C-N 128.755 3.784 . . . . 0.0 111.31 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.12 135.16 30.63 Favored 'General case' 0 CA--C 1.508 -0.641 1 O-C-N 129.283 4.114 . . . . 0.0 111.962 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -120.57 100.4 7.11 Favored 'General case' 0 C--O 1.2 -1.503 0 O-C-N 128.835 3.835 . . . . 0.0 112.275 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -177.39 113.61 0.09 Allowed 'General case' 0 N--CA 1.471 0.585 1 O-C-N 129.337 4.148 . . . . 0.0 108.186 -179.856 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -77.66 0.46 Allowed 'General case' 0 CA--C 1.495 -1.171 0 O-C-N 126.812 2.57 . . . . 0.0 116.56 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.997 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 9.8 tp -112.07 39.91 2.3 Favored 'General case' 0 N--CA 1.435 -1.207 0 N-CA-C 119.554 3.168 . . . . 0.0 119.554 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.09 101.99 0.26 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 104.276 -2.491 . . . . 0.0 104.276 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 1.019 ' CD1' HG21 ' A' ' 87' ' ' VAL . 2.2 m-85 -147.18 -175.23 4.75 Favored 'General case' 0 CA--C 1.496 -1.12 1 CA-C-O 128.726 4.108 . . . . 0.0 112.304 -179.633 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.529 ' CG2' HG21 ' A' ' 69' ' ' VAL . 2.0 m -150.74 166.45 30.4 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 110.508 -3.042 . . . . 0.0 105.481 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.747 HG21 ' CD1' ' A' ' 89' ' ' TRP . 14.0 t -96.07 130.4 44.8 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.33 0 O-C-N 127.395 2.934 . . . . 0.0 115.544 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.75 34.81 59.16 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.224 -1.941 . . . . 0.0 116.439 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.529 HG21 ' CG2' ' A' ' 66' ' ' THR . 15.0 t -118.21 55.92 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 117.528 -1.225 . . . . 0.0 109.601 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -15.42 86.13 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.801 1 O-C-N 131.934 5.771 . . . . 0.0 115.612 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.496 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.3 m-85 -59.74 94.09 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 109.528 -3.487 . . . . 0.0 114.082 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.84 80.27 0.3 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 126.984 2.677 . . . . 0.0 108.654 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.447 ' CD ' ' HB3' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 67.57 150.92 0.07 Allowed 'General case' 0 CA--C 1.492 -1.27 0 CA-C-O 125.408 2.528 . . . . 0.0 112.929 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.97 62.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 108.88 -3.782 . . . . 0.0 116.166 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.404 ' C ' ' CG ' ' A' ' 76' ' ' LYS . 55.9 p -136.09 115.94 13.12 Favored 'General case' 0 C--O 1.211 -0.954 0 O-C-N 119.434 -2.041 . . . . 0.0 109.743 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.404 ' CG ' ' C ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -155.24 -64.1 0.12 Allowed 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 126.501 3.048 . . . . 0.0 111.561 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -47.96 -37.76 16.28 Favored Glycine 0 N--CA 1.468 0.831 0 CA-C-N 109.289 -3.596 . . . . 0.0 111.516 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . 0.281 1.5 tp -124.28 32.89 5.4 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.705 ' HB2' HD13 ' A' ' 24' ' ' LEU . 2.3 t0 174.46 -83.43 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 123.499 1.618 . . . . 0.0 112.983 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.93 76.91 0.99 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.674 2.083 . . . . 0.0 110.57 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -148.74 -133.19 0.06 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 111.275 -2.462 . . . . 0.0 114.09 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.447 ' HB3' ' CD ' ' A' ' 73' ' ' GLU . 2.0 p30 177.95 105.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 125.199 1.562 . . . . 0.0 109.835 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.66 HG13 ' N ' ' A' ' 100' ' ' GLY . 99.6 t -136.67 134.04 48.81 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.299 0 N-CA-C 117.665 2.469 . . . . 0.0 117.665 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -60.56 107.88 0.75 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 112.116 -2.311 . . . . 0.0 106.809 178.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.496 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 94.9 m -109.77 65.55 0.62 Allowed 'General case' 0 C--O 1.204 -1.33 0 CA-C-O 126.34 2.971 . . . . 0.0 118.372 -178.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.441 ' HB3' HG23 ' A' ' 97' ' ' VAL . 4.7 tt -65.78 142.3 58.02 Favored 'General case' 0 CA--C 1.514 -0.426 1 CA-C-N 108.04 -4.164 . . . . 0.0 112.602 179.633 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 1.019 HG21 ' CD1' ' A' ' 65' ' ' PHE . 30.8 t -125.35 144.62 34.78 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 CA-C-N 110.995 -2.82 . . . . 0.0 109.682 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.619 ' HA ' HG13 ' A' ' 67' ' ' VAL . 3.6 t -159.72 170.54 21.32 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-O 125.743 2.687 . . . . 0.0 110.117 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.747 ' CD1' HG21 ' A' ' 67' ' ' VAL . 32.4 m95 -94.22 145.26 24.84 Favored 'General case' 0 CA--C 1.507 -0.703 0 C-N-CA 128.015 2.526 . . . . 0.0 106.156 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.606 ' HB2' HG23 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -95.82 -36.28 11.19 Favored 'General case' 0 C--O 1.197 -1.681 1 CA-C-O 129.888 4.661 . . . . 0.0 113.109 179.708 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.46 -47.02 0.44 Allowed Glycine 0 N--CA 1.481 1.659 1 CA-C-N 107.361 -4.472 . . . . 0.0 106.078 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.577 ' HB3' HG22 ' A' ' 2' ' ' THR . 7.1 p30 -122.84 2.17 9.4 Favored 'General case' 0 N--CA 1.429 -1.49 1 O-C-N 132.74 5.612 . . . . 0.0 113.207 -179.125 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.489 ' CB ' ' HA ' ' A' ' 110' ' ' TRP . 1.3 t -160.65 175.68 12.39 Favored 'General case' 0 C--O 1.202 -1.43 0 N-CA-C 119.407 3.114 . . . . 0.0 119.407 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.743 HD11 ' CG1' ' A' ' 87' ' ' VAL 0.257 2.9 tp -92.34 106.59 18.56 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 109.872 -3.331 . . . . 0.0 114.805 179.633 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.606 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.327 41.1 t -108.15 126.09 64.78 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.136 0 CA-C-N 111.003 -2.817 . . . . 0.0 111.862 179.506 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.448 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -137.56 150.69 47.68 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 122.255 1.026 . . . . 0.0 108.999 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.441 HG23 ' HB3' ' A' ' 86' ' ' LEU . 6.0 m -130.79 108.08 14.88 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.545 0 CA-C-O 127.229 3.395 . . . . 0.0 118.046 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.563 ' HB3' HG11 ' A' ' 83' ' ' VAL . 2.9 mm-40 -85.09 112.19 20.43 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 112.243 -2.253 . . . . 0.0 108.007 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.5 tptp -51.68 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.011 0 O-C-N 128.419 3.574 . . . . 0.0 112.585 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.66 ' N ' HG13 ' A' ' 83' ' ' VAL . . . 79.75 155.09 9.75 Favored Glycine 0 C--O 1.219 -0.811 0 CA-C-O 124.276 2.042 . . . . 0.0 109.128 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.29 -16.27 14.62 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 110.704 -2.748 . . . . 0.0 111.276 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -50.06 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 127.131 2.172 . . . . 0.0 113.122 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -97.04 166.56 11.54 Favored 'General case' 0 C--O 1.198 -1.633 0 CA-C-O 123.295 1.522 . . . . 0.0 113.486 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.484 ' O ' HG23 ' A' ' 121' ' ' THR . 7.0 m-20 -124.48 97.33 5.26 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 108.752 -3.84 . . . . 0.0 103.398 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.456 ' HD3' ' HB3' ' A' ' 122' ' ' CYS . 0.1 OUTLIER -89.65 2.38 54.82 Favored 'General case' 0 C--O 1.203 -1.36 0 C-N-CA 125.071 1.348 . . . . 0.0 113.421 -179.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.446 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -46.06 115.48 1.75 Allowed Glycine 0 C--O 1.203 -1.84 2 CA-C-N 108.177 -4.101 . . . . 0.0 112.506 179.816 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.997 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.262 0.0 OUTLIER -114.02 144.93 42.29 Favored 'General case' 0 C--O 1.193 -1.888 0 O-C-N 129.974 3.985 . . . . 0.0 110.344 179.218 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.3 169.74 21.53 Favored 'General case' 0 C--O 1.207 -1.141 1 O-C-N 129.851 4.47 . . . . 0.0 116.6 -179.053 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.525 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -138.42 157.4 46.28 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 109.221 -3.627 . . . . 0.0 109.503 -179.99 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.489 ' HA ' ' CB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -146.08 12.29 1.23 Allowed 'General case' 0 CA--C 1.502 -0.878 1 O-C-N 129.835 4.46 . . . . 0.0 116.044 179.228 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.464 HG22 HD12 ' A' ' 116' ' ' LEU . 5.8 t 34.22 55.4 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 CA-C-O 127.226 3.393 . . . . 0.0 116.303 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -60.63 104.53 0.35 Allowed 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 110.154 -3.203 . . . . 0.0 114.536 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 58.17 -84.1 0.01 OUTLIER Glycine 0 C--O 1.204 -1.771 0 CA-C-N 114.03 -1.441 . . . . 0.0 115.991 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -134.35 49.27 2.26 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 116.428 2.011 . . . . 0.0 116.428 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.405 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.322 -0.604 0 O-C-N 127.406 2.941 . . . . 0.0 109.488 -179.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.943 HD22 ' CE ' ' A' ' 41' ' ' LYS . 3.3 tt -116.0 82.23 1.74 Allowed 'General case' 0 CA--C 1.484 -1.558 0 O-C-N 128.434 3.584 . . . . 0.0 116.597 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -54.05 109.26 0.45 Allowed 'General case' 0 CA--C 1.502 -0.866 0 CA-C-N 109.984 -3.28 . . . . 0.0 114.878 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.489 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -92.02 56.77 2.96 Favored 'General case' 0 C--N 1.36 1.059 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.0 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -62.04 140.33 58.38 Favored 'General case' 0 CA--C 1.489 -1.366 0 C-N-CA 126.838 2.055 . . . . 0.0 107.945 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.65 162.6 41.06 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 118.32 -1.352 . . . . 0.0 109.062 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 104' ' ' ASN . 2.7 t -134.43 151.53 51.24 Favored 'General case' 0 C--O 1.199 -1.579 0 O-C-N 127.147 2.78 . . . . 0.0 104.421 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.456 ' HB3' ' HD3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -141.53 30.99 1.69 Allowed 'General case' 0 CA--C 1.496 -1.11 0 CA-C-O 123.768 1.747 . . . . 0.0 114.506 -179.237 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 119.38 -61.15 0.49 Allowed Glycine 0 C--O 1.223 -0.541 0 CA-C-N 109.732 -3.394 . . . . 0.0 113.587 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -162.75 69.87 0.26 Allowed 'General case' 0 C--O 1.205 -1.271 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.447 ' C ' HG12 ' A' ' 126' ' ' VAL . 7.2 tp60 -140.71 -49.95 0.44 Allowed 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 110.659 -2.973 . . . . 0.0 109.85 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.533 ' O ' HG22 ' A' ' 126' ' ' VAL . 2.4 p 49.1 87.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.131 1 O-C-N 131.55 5.531 . . . . 0.0 112.337 -179.676 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -72.34 126.9 30.97 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 112.528 -2.124 . . . . 0.0 109.728 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 6.2 mmt85 -106.69 80.39 1.45 Allowed 'General case' 0 CA--C 1.484 -1.578 0 O-C-N 125.762 1.913 . . . . 0.0 112.37 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.11 161.71 2.28 Favored 'General case' 0 C--N 1.35 0.617 0 O-C-N 127.396 2.935 . . . . 0.0 114.548 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -152.42 109.32 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.211 0 CA-C-O 126.449 3.023 . . . . 0.0 104.838 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.594 ' CZ ' ' HG3' ' A' ' 11' ' ' MET . 4.2 m-85 -109.69 174.28 5.94 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-N 108.859 -3.791 . . . . 0.0 116.743 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -154.47 125.38 7.17 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 110.821 -2.9 . . . . 0.0 104.508 179.637 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.531 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 18.8 ttpt -70.63 116.05 10.51 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 128.206 3.441 . . . . 0.0 109.72 178.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.461 ' HB3' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.486 -1.513 0 N-CA-C 118.038 2.607 . . . . 0.0 118.038 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.52 3.038 0 CA-C-O 117.666 -1.159 . . . . 0.0 108.354 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.64 127.7 0.03 OUTLIER 'General case' 0 C--O 1.212 -0.91 0 CA-C-O 122.296 1.046 . . . . 0.0 109.198 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.1 mttt 53.36 178.38 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 57.97 89.44 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 124.428 2.061 . . . . 0.0 108.142 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -148.96 47.21 1.0 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 112.945 -1.934 . . . . 0.0 107.633 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -41.24 148.88 0.11 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 127.409 2.943 . . . . 0.0 113.082 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.3 174.96 40.04 Favored Glycine 0 C--O 1.223 -0.567 0 CA-C-N 110.969 -2.832 . . . . 0.0 112.77 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.434 HG22 ' HG3' ' A' ' 134' ' ' LYS . 0.4 OUTLIER -116.77 136.87 52.62 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 130.104 4.061 . . . . 0.0 103.877 179.759 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.531 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.274 0.0 OUTLIER -138.88 100.2 3.98 Favored 'General case' 0 CA--C 1.495 -1.143 0 O-C-N 128.564 3.665 . . . . 0.0 112.085 -179.595 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.21 -24.4 0.46 Allowed 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 115.685 -2.102 . . . . 0.0 114.972 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.464 ' CB ' ' HG2' ' A' ' 39' ' ' GLN . 3.5 ttm 83.32 -67.58 0.07 Allowed 'General case' 0 C--O 1.244 0.813 0 O-C-N 128.364 3.54 . . . . 0.0 106.072 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.402 ' CB ' ' O ' ' A' ' 11' ' ' MET . 36.0 tt0 108.08 -44.77 0.0 OUTLIER 'General case' 0 C--O 1.206 -1.222 1 O-C-N 130.364 4.79 . . . . 0.0 111.231 179.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 177.39 153.64 0.26 Allowed 'General case' 0 C--N 1.353 0.744 0 CA-C-N 109.004 -3.725 . . . . 0.0 110.73 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -123.69 134.71 53.68 Favored 'General case' 0 CA--C 1.486 -1.502 0 CA-C-N 111.809 -2.451 . . . . 0.0 111.943 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -73.27 -176.56 2.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 128.936 3.898 . . . . 0.0 111.572 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -9.54 80.73 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.082 0 CA-C-O 124.648 2.166 . . . . 0.0 115.479 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.532 ' CD2' ' HA ' ' A' ' 35' ' ' VAL . 8.3 t80 -80.94 -31.92 34.77 Favored 'General case' 0 C--O 1.203 -1.379 0 CA-C-N 110.038 -3.255 . . . . 0.0 110.258 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -78.24 -49.4 13.82 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-N 110.725 -2.943 . . . . 0.0 112.905 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.428 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -60.95 -21.59 59.12 Favored Glycine 0 C--N 1.342 0.915 0 O-C-N 127.92 3.262 . . . . 0.0 111.723 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.434 ' CE1' HD11 ' A' ' 120' ' ' LEU . 0.3 OUTLIER -75.24 -39.34 59.98 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 127.399 2.47 . . . . 0.0 105.701 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . 0.251 31.9 mtt -79.74 -23.96 41.91 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 112.533 -2.121 . . . . 0.0 111.631 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.428 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 9.4 ttpt -76.99 -23.84 52.27 Favored 'General case' 0 C--N 1.313 -1.007 0 O-C-N 128.798 3.811 . . . . 0.0 113.102 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -72.05 -54.62 9.29 Favored 'General case' 0 C--O 1.201 -1.451 1 O-C-N 129.906 4.504 . . . . 0.0 109.453 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.856 HD11 ' HB ' ' A' ' 26' ' ' ILE . 0.4 OUTLIER -74.33 -18.93 60.63 Favored 'General case' 0 N--CA 1.488 1.457 1 O-C-N 129.809 4.443 . . . . 0.0 106.237 -179.984 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 45.34 84.33 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.363 0 CA-C-O 126.441 3.02 . . . . 0.0 106.705 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.856 ' HB ' HD11 ' A' ' 24' ' ' LEU . 9.9 tt -94.8 -30.26 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.531 1 CA-C-N 107.866 -4.243 . . . . 0.0 115.353 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -168.55 -175.74 2.58 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 118.345 -2.722 . . . . 0.0 109.997 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -127.52 115.5 18.94 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 63.81 41.46 6.82 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 112.624 -2.08 . . . . 0.0 110.871 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.11 -5.13 50.97 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 128.725 3.766 . . . . 0.0 110.648 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -75.94 -162.8 0.24 Allowed 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 128.647 2.779 . . . . 0.0 109.236 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HG2' HG13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER 77.46 4.75 3.1 Favored 'General case' 0 CA--C 1.485 -1.549 0 O-C-N 127.424 2.953 . . . . 0.0 114.133 179.553 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.473 ' O ' HD22 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -147.71 -73.52 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-N 113.416 -1.72 . . . . 0.0 113.43 179.418 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.695 ' HA ' HD21 ' A' ' 37' ' ' LEU . . . -48.98 -19.85 0.45 Allowed 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.532 ' HA ' ' CD2' ' A' ' 17' ' ' PHE . 53.7 t -26.48 -48.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.584 0 O-C-N 126.463 2.352 . . . . 0.0 109.841 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.658 ' C ' HD23 ' A' ' 37' ' ' LEU . 4.6 tpp180 164.54 125.58 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.376 2 O-C-N 131.145 5.278 . . . . 0.0 111.41 178.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.711 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -142.42 85.45 1.91 Allowed 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 110.006 -3.27 . . . . 0.0 104.994 -179.9 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m 87.85 120.81 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.896 1 O-C-N 135.346 7.904 . . . . 0.0 110.689 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.464 ' HG2' ' CB ' ' A' ' 11' ' ' MET . 46.4 tp60 -135.8 141.72 44.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 120.513 1.506 . . . . 0.0 110.821 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 40' ' ' THR . 99.3 m -168.99 80.74 0.13 Allowed 'General case' 0 C--O 1.212 -0.879 2 O-C-N 132.258 5.974 . . . . 0.0 112.364 -179.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.93 144.85 54.06 Favored 'General case' 0 N--CA 1.485 1.321 1 O-C-N 129.674 4.359 . . . . 0.0 103.415 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.488 ' N ' ' O ' ' A' ' 53' ' ' LYS . 4.2 mt -138.54 103.6 2.27 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.438 0 CA-C-O 124.087 1.899 . . . . 0.0 115.387 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.589 ' CD1' ' CE1' ' A' ' 50' ' ' PHE 0.289 0.3 OUTLIER -88.17 141.04 14.86 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 1 CA-C-N 107.753 -4.294 . . . . 0.0 108.81 179.8 . . . . . . . . 5 4 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.7 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.1 t -124.8 -66.5 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.367 0 CA-C-N 111.898 -2.41 . . . . 0.0 114.445 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.7 ' N ' HG12 ' A' ' 44' ' ' VAL . 9.6 mt-30 64.39 123.38 0.02 OUTLIER 'General case' 0 CA--C 1.488 -1.424 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -152.01 37.97 0.57 Allowed 'General case' 0 CA--C 1.489 -1.384 0 C-N-CA 114.563 -2.855 . . . . 0.0 116.362 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.0 93.22 0.54 Allowed Glycine 0 C--O 1.201 -1.954 0 CA-C-N 118.985 0.811 . . . . 0.0 111.575 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 53.22 43.92 30.9 Favored 'General case' 0 CA--C 1.507 -0.698 0 O-C-N 128.066 2.862 . . . . 0.0 113.449 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 179.68 96.06 0.02 OUTLIER 'General case' 0 C--O 1.232 0.175 1 O-C-N 129.465 4.228 . . . . 0.0 109.942 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.61 ' CD2' HD22 ' A' ' 94' ' ' LEU . 2.0 t80 -118.75 109.95 16.68 Favored 'General case' 0 CA--C 1.483 -1.613 1 O-C-N 130.094 4.621 . . . . 0.0 112.813 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 20.7 mttt -112.86 80.48 1.35 Allowed 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 118.951 2.945 . . . . 0.0 118.951 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.469 ' HB ' ' CD2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -63.01 150.36 42.65 Favored 'General case' 0 C--N 1.357 0.898 0 O-C-N 127.742 3.151 . . . . 0.0 105.668 179.072 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -159.14 133.36 7.71 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 115.845 -2.342 . . . . 0.0 110.502 -179.14 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.29 148.11 22.77 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 126.128 2.142 . . . . 0.0 111.006 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -112.16 48.35 0.99 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 127.305 2.878 . . . . 0.0 115.081 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.517 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 1.5 p -73.04 158.18 35.91 Favored 'General case' 0 N--CA 1.475 0.814 1 O-C-N 133.091 6.494 . . . . 0.0 105.166 179.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 57' ' ' THR . 1.0 OUTLIER -103.92 24.03 11.95 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 129.026 3.954 . . . . 0.0 107.141 179.51 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.568 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 14.5 p90 -137.36 -50.71 0.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.82 2.156 . . . . 0.0 116.82 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 -79.78 0.56 Allowed 'General case' 0 CA--C 1.503 -0.859 0 C-N-CA 115.238 -2.585 . . . . 0.0 116.781 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 64.82 67.9 0.53 Allowed 'General case' 0 C--O 1.2 -1.539 0 O-C-N 126.264 2.228 . . . . 0.0 108.883 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 -46.04 41.14 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 110.834 -2.894 . . . . 0.0 109.776 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 47.7 t0 74.24 122.13 0.04 OUTLIER 'General case' 0 CA--C 1.503 -0.838 1 O-C-N 130.437 4.836 . . . . 0.0 110.288 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 1.078 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 13.8 tp -77.14 47.45 0.55 Allowed 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 126.297 2.248 . . . . 0.0 112.028 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.464 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 54.8 t0 -63.08 96.88 0.1 Allowed 'General case' 0 CA--C 1.495 -1.172 0 N-CA-C 106.476 -1.676 . . . . 0.0 106.476 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -134.48 169.17 17.66 Favored 'General case' 0 N--CA 1.475 0.783 1 CA-C-O 129.828 4.632 . . . . 0.0 107.908 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.56 HG22 HG23 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -156.54 126.66 6.47 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 109.715 -3.402 . . . . 0.0 105.041 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.915 ' HA ' HG22 ' A' ' 87' ' ' VAL . 7.2 p -48.27 132.91 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 0 O-C-N 126.277 2.236 . . . . 0.0 116.15 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.14 -0.44 73.56 Favored Glycine 0 C--N 1.359 1.848 0 O-C-N 127.34 2.9 . . . . 0.0 116.943 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.56 HG23 HG22 ' A' ' 66' ' ' THR . 0.9 OUTLIER -65.08 -40.47 89.04 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 C-N-CA 118.398 -1.321 . . . . 0.0 109.565 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 65.12 88.41 0.11 Allowed 'General case' 0 C--N 1.361 1.096 0 O-C-N 128.337 3.523 . . . . 0.0 110.628 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.467 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.4 OUTLIER -70.44 75.94 0.56 Allowed 'General case' 0 C--O 1.216 -0.707 0 O-C-N 127.643 3.089 . . . . 0.0 110.743 -179.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -48.36 81.02 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.232 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 25.4 mt-10 60.47 -176.47 0.11 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 123.249 1.5 . . . . 0.0 107.9 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 47.7 t60 92.15 97.38 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 109.825 -3.352 . . . . 0.0 116.477 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.28 166.51 24.85 Favored 'General case' 0 C--O 1.198 -1.642 0 CA-C-N 112.111 -2.313 . . . . 0.0 108.925 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 172.07 -31.12 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 O-C-N 126.134 2.146 . . . . 0.0 113.187 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -53.7 -33.03 48.13 Favored Glycine 0 C--O 1.208 -1.511 0 N-CA-C 107.057 -2.417 . . . . 0.0 107.057 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.3 tp -140.68 101.49 4.09 Favored 'General case' 0 N--CA 1.448 -0.527 1 CA-C-N 107.427 -4.387 . . . . 0.0 115.399 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.794 ' HB2' HD13 ' A' ' 24' ' ' LEU . 23.4 t0 92.06 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.776 0 O-C-N 128.954 3.909 . . . . 0.0 113.489 179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.88 82.41 1.4 Allowed Glycine 0 N--CA 1.469 0.862 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.418 ' HB3' HG23 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -137.35 -170.4 2.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 111.476 -2.362 . . . . 0.0 109.663 -179.413 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.524 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.6 OUTLIER -135.59 87.79 2.35 Favored 'General case' 0 C--O 1.202 -1.431 0 O-C-N 127.552 3.032 . . . . 0.0 106.723 179.693 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.954 HG22 ' HA2' ' A' ' 100' ' ' GLY . 94.8 t -119.19 142.79 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.557 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -178.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.45 73.83 0.24 Allowed 'General case' 0 C--O 1.218 -0.604 0 O-C-N 127.22 2.825 . . . . 0.0 108.1 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.467 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 18.5 m -76.92 70.61 3.36 Favored 'General case' 0 C--O 1.195 -1.793 0 CA-C-N 109.76 -3.382 . . . . 0.0 112.096 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 165.98 7.82 Favored 'General case' 0 C--O 1.214 -0.788 1 CA-C-N 107.459 -4.428 . . . . 0.0 113.659 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.915 HG22 ' HA ' ' A' ' 67' ' ' VAL . 0.3 OUTLIER -157.52 116.5 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.364 0 CA-C-N 112.467 -2.151 . . . . 0.0 108.625 179.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.826 ' HA ' HG23 ' A' ' 67' ' ' VAL . 0.5 OUTLIER -150.0 173.98 13.23 Favored 'General case' 0 CA--C 1.474 -1.946 0 CA-C-N 110.574 -3.012 . . . . 0.0 111.023 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.701 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.0 m95 -96.71 151.67 19.41 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-O 114.832 -2.509 . . . . 0.0 107.982 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.631 ' HB2' HG23 ' A' ' 95' ' ' VAL . 7.0 tp10 -100.67 -40.55 7.31 Favored 'General case' 0 C--O 1.199 -1.597 1 CA-C-O 131.663 5.506 . . . . 0.0 112.143 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 176.35 -48.6 0.11 Allowed Glycine 0 C--O 1.207 -1.548 0 CA-C-N 108.723 -3.853 . . . . 0.0 105.708 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -151.09 41.73 0.75 Allowed 'General case' 0 N--CA 1.444 -0.748 1 O-C-N 130.586 4.345 . . . . 0.0 110.656 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.447 HG22 ' HB3' ' A' ' 90' ' ' GLU . 0.6 OUTLIER -172.37 153.86 3.07 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-N 112.091 -2.322 . . . . 0.0 115.367 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.61 HD22 ' CD2' ' A' ' 50' ' ' PHE . 3.1 tp -88.9 93.96 9.77 Favored 'General case' 0 CA--C 1.481 -1.684 0 O-C-N 128.32 3.513 . . . . 0.0 118.561 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.653 HG13 ' NZ ' ' A' ' 108' ' ' LYS 0.341 53.0 t -89.61 114.75 28.03 Favored 'Isoleucine or valine' 0 C--N 1.358 0.977 0 CA-C-N 113.014 -1.903 . . . . 0.0 112.72 178.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 75.4 m -119.41 110.35 16.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 103.333 -2.84 . . . . 0.0 103.333 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.8 t -101.56 74.36 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.482 -1.639 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.51 ' HB2' ' HA2' ' A' ' 106' ' ' GLY . 0.1 OUTLIER -53.49 100.19 0.03 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.694 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.4 OUTLIER -97.88 88.3 4.24 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-N 110.647 -2.979 . . . . 0.0 113.745 -178.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.954 ' HA2' HG22 ' A' ' 83' ' ' VAL . . . -62.66 -86.56 0.05 OUTLIER Glycine 0 CA--C 1.534 1.223 0 N-CA-C 106.631 -2.588 . . . . 0.0 106.631 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 177.25 -57.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 128.369 3.04 . . . . 0.0 111.312 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -37.07 18.79 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 110.653 -2.976 . . . . 0.0 115.62 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.431 ' HG3' ' CZ ' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -120.35 175.97 5.71 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 110.297 -3.138 . . . . 0.0 111.988 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.466 ' HB2' ' CG2' ' A' ' 121' ' ' THR . 0.0 OUTLIER -124.69 115.83 21.39 Favored 'General case' 0 N--CA 1.491 1.6 1 CA-C-N 106.637 -4.801 . . . . 0.0 102.212 179.267 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.431 ' CZ ' ' HG3' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -115.39 24.8 11.32 Favored 'General case' 0 C--O 1.209 -1.06 0 O-C-N 128.256 3.473 . . . . 0.0 108.217 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.51 ' HA2' ' HB2' ' A' ' 98' ' ' GLN . . . -81.65 129.29 8.95 Favored Glycine 0 N--CA 1.427 -1.953 2 O-C-N 133.492 6.745 . . . . 0.0 115.15 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 1.078 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.258 0.0 OUTLIER -115.57 136.22 53.29 Favored 'General case' 0 C--O 1.202 -1.409 0 O-C-N 129.554 3.737 . . . . 0.0 108.419 177.746 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.653 ' NZ ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -153.03 174.59 13.98 Favored 'General case' 0 C--O 1.206 -1.23 1 O-C-N 129.432 4.208 . . . . 0.0 114.484 -178.634 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.413 ' NE2' HD23 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -134.01 162.54 31.78 Favored 'General case' 0 C--N 1.361 1.102 0 CA-C-N 110.518 -3.037 . . . . 0.0 109.445 -179.502 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.523 ' CZ3' ' HD3' ' A' ' 108' ' ' LYS . 0.4 OUTLIER -170.0 66.47 0.05 Allowed 'General case' 0 C--N 1.31 -1.116 1 O-C-N 131.711 5.632 . . . . 0.0 115.799 -179.931 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.552 HG22 HD21 ' A' ' 116' ' ' LEU . 39.7 t -17.84 99.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.269 0 C-N-CA 128.213 2.605 . . . . 0.0 114.896 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.509 ' HB2' ' CE1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -94.08 38.54 1.08 Allowed 'General case' 0 CA--C 1.49 -1.361 0 CA-C-N 111.819 -2.446 . . . . 0.0 116.317 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.7 -100.82 1.02 Allowed Glycine 0 C--O 1.213 -1.191 0 O-C-N 126.448 2.343 . . . . 0.0 118.065 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -107.01 12.6 28.47 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 117.894 2.553 . . . . 0.0 117.894 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.402 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 6.6 pttt -157.08 150.03 23.68 Favored 'General case' 0 C--N 1.314 -0.936 1 O-C-N 129.437 4.211 . . . . 0.0 109.192 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.552 HD21 HG22 ' A' ' 111' ' ' VAL . 0.4 OUTLIER -84.34 174.16 10.35 Favored 'General case' 0 C--O 1.197 -1.692 0 O-C-N 126.203 2.189 . . . . 0.0 112.776 179.619 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.509 ' CE1' ' HB2' ' A' ' 112' ' ' GLU . 11.4 m-85 -146.9 89.61 1.83 Allowed 'General case' 0 C--O 1.213 -0.833 0 C-N-CA 115.129 -2.628 . . . . 0.0 112.513 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 118' ' ' LEU . 11.2 mt -83.01 58.86 4.61 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 110.08 -3.236 . . . . 0.0 108.423 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -76.32 91.96 3.29 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 129.713 3.205 . . . . 0.0 111.531 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.434 HD11 ' CE1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -90.73 -179.12 5.45 Favored 'General case' 0 N--CA 1.489 1.504 1 O-C-N 129.367 4.167 . . . . 0.0 110.365 179.628 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.466 ' CG2' ' HB2' ' A' ' 104' ' ' ASN . 18.3 m -129.38 159.08 37.32 Favored 'General case' 0 CA--C 1.492 -1.271 0 O-C-N 127.274 2.859 . . . . 0.0 105.792 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.55 73.27 0.37 Allowed 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 126.738 3.161 . . . . 0.0 113.268 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 63.76 33.29 86.83 Favored Glycine 0 C--O 1.217 -0.909 0 CA-C-N 110.218 -3.174 . . . . 0.0 112.151 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 79.24 51.72 0.03 OUTLIER 'General case' 0 CA--C 1.492 -1.26 0 O-C-N 128.854 3.326 . . . . 0.0 112.43 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.513 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 2.1 mm100 -129.8 24.24 5.36 Favored 'General case' 0 C--O 1.217 -0.614 0 O-C-N 127.572 3.045 . . . . 0.0 106.773 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.555 ' O ' HG22 ' A' ' 126' ' ' VAL . 7.7 p -10.91 79.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.98 0 CA-C-N 108.734 -3.848 . . . . 0.0 115.864 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 16.7 t -65.04 151.07 46.95 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.794 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.9 96.63 3.45 Favored 'General case' 0 CA--C 1.5 -0.967 0 O-C-N 125.101 1.5 . . . . 0.0 112.989 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -73.14 170.2 15.42 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 113.906 -3.118 . . . . 0.0 111.402 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 89.8 t -140.61 140.32 33.95 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.552 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.402 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 14.9 m-85 -123.2 -177.66 3.75 Favored 'General case' 0 CA--C 1.477 -1.857 0 CA-C-N 109.994 -3.275 . . . . 0.0 116.86 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.317 2.9 tptt -167.94 107.77 0.55 Allowed 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 103.218 -2.882 . . . . 0.0 103.218 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.459 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 23.0 ttpt -57.53 93.3 0.01 OUTLIER 'General case' 0 C--O 1.195 -1.796 0 O-C-N 127.094 2.746 . . . . 0.0 112.126 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.434 ' HG3' HG22 ' A' ' 8' ' ' THR . 0.8 OUTLIER . . . . . 0 C--O 1.265 1.876 0 O-C-N 126.85 2.593 . . . . 0.0 114.028 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 mtp . . . . . 0 N--CA 1.504 2.246 0 CA-C-O 120.567 0.222 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 92' ' ' ASN . 0.1 OUTLIER -129.56 -55.17 1.16 Allowed 'General case' 0 C--O 1.208 -1.081 0 O-C-N 125.916 2.01 . . . . 0.0 111.14 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.547 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 17.3 pttp -136.03 -40.5 0.67 Allowed 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 112.623 -2.08 . . . . 0.0 113.059 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -81.27 87.41 6.12 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 125.778 1.924 . . . . 0.0 107.024 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -117.84 138.71 51.91 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 103.859 -2.645 . . . . 0.0 103.859 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -125.51 77.7 1.67 Allowed 'General case' 0 C--N 1.317 -0.845 0 O-C-N 128.348 3.53 . . . . 0.0 111.6 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -125.64 -144.96 6.34 Favored Glycine 0 C--O 1.204 -1.733 0 CA-C-N 111.199 -2.728 . . . . 0.0 114.32 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.44 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -160.41 152.28 20.04 Favored 'General case' 0 N--CA 1.478 0.968 1 O-C-N 133.395 5.997 . . . . 0.0 104.898 179.974 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.679 ' CZ2' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -150.21 122.55 8.42 Favored 'General case' 0 C--O 1.219 -0.501 0 O-C-N 126.922 2.639 . . . . 0.0 117.13 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.45 95.52 10.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 126.678 2.486 . . . . 0.0 106.096 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.513 ' HB3' ' CD ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -33.85 -37.78 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 O-C-N 128.516 3.635 . . . . 0.0 106.236 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 78.97 -70.73 0.1 Allowed 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 125.43 2.538 . . . . 0.0 112.206 179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -134.39 169.69 16.86 Favored 'General case' 0 N--CA 1.433 -1.296 1 CA-C-N 108.175 -4.102 . . . . 0.0 107.809 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.568 ' N ' ' ND2' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -146.47 137.79 24.44 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 108.471 -3.968 . . . . 0.0 112.251 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -79.63 -74.35 0.3 Allowed 'General case' 0 CA--C 1.505 -0.775 0 O-C-N 126.181 2.176 . . . . 0.0 109.033 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -96.87 140.76 30.94 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.796 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -144.05 -52.32 0.32 Allowed 'General case' 0 CA--C 1.491 -1.291 0 CA-C-N 112.488 -2.142 . . . . 0.0 111.179 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.403 ' N ' ' CG ' ' A' ' 17' ' ' PHE . 1.8 tm-20 -70.25 -48.95 54.63 Favored 'General case' 0 C--O 1.209 -1.068 0 C-N-CA 124.484 1.114 . . . . 0.0 111.991 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.471 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -60.26 -22.19 58.03 Favored Glycine 0 CA--C 1.492 -1.376 1 O-C-N 129.219 4.074 . . . . 0.0 111.822 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.566 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -79.8 -38.53 32.81 Favored 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 105.044 -2.206 . . . . 0.0 105.044 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.545 ' HG3' ' CG2' ' A' ' 26' ' ' ILE 0.318 0.4 OUTLIER -70.37 -24.79 63.02 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 110.373 -3.103 . . . . 0.0 110.227 -179.598 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.471 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.53 -33.2 42.15 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 129.175 4.047 . . . . 0.0 112.697 179.705 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.45 ' HB2' ' HG2' ' A' ' 125' ' ' GLN . . . -61.59 -37.43 83.86 Favored 'General case' 0 C--O 1.207 -1.163 2 O-C-N 132.316 6.01 . . . . 0.0 113.979 -179.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.02 HD12 ' HB2' ' A' ' 79' ' ' ASP 0.351 2.3 mm? -74.87 -45.14 45.04 Favored 'General case' 0 C--O 1.211 -0.954 2 CA-C-N 106.38 -4.918 . . . . 0.0 109.041 -178.241 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.27 12.1 t70 91.83 46.35 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.512 3 O-C-N 133.302 6.626 . . . . 0.0 112.809 -179.892 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.545 ' CG2' ' HG3' ' A' ' 21' ' ' MET . 0.6 OUTLIER -105.28 21.33 3.57 Favored 'Isoleucine or valine' 0 C--N 1.361 1.104 1 CA-C-N 107.525 -4.398 . . . . 0.0 111.259 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -87.38 147.27 25.53 Favored 'General case' 0 C--N 1.359 0.988 0 CA-C-N 111.704 -2.498 . . . . 0.0 110.598 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -176.3 43.21 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.672 0 O-C-N 127.189 2.806 . . . . 0.0 113.242 179.867 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 69.22 48.48 0.66 Allowed 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 126.067 2.841 . . . . 0.0 109.392 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.491 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.3 OUTLIER -96.89 -45.78 6.49 Favored 'General case' 0 C--N 1.361 1.089 1 CA-C-N 107.231 -4.532 . . . . 0.0 114.386 -179.993 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.491 ' N ' HG22 ' A' ' 30' ' ' THR . 0.1 OUTLIER -62.89 -179.6 0.29 Allowed 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 114.504 -2.665 . . . . 0.0 111.392 -179.638 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 75.17 11.09 3.57 Favored 'General case' 0 CA--C 1.488 -1.406 1 O-C-N 130.881 5.113 . . . . 0.0 112.433 179.934 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.6 mt -147.9 -51.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.019 1 O-C-N 132.516 6.135 . . . . 0.0 111.043 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.438 ' HA ' ' CD2' ' A' ' 37' ' ' LEU . . . -77.62 1.72 18.81 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 114.042 -1.436 . . . . 0.0 112.523 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 t -51.74 -29.85 11.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 124.036 1.874 . . . . 0.0 109.971 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.685 ' HD2' ' HB3' ' A' ' 39' ' ' GLN . 0.0 OUTLIER 164.89 133.83 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 109.011 -3.722 . . . . 0.0 111.258 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.837 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.7 OUTLIER -157.94 96.85 1.5 Allowed 'General case' 0 C--O 1.215 -0.724 2 O-C-N 130.045 4.591 . . . . 0.0 108.081 179.152 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.1 m 62.77 52.65 2.7 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 128.677 3.736 . . . . 0.0 109.863 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.685 ' HB3' ' HD2' ' A' ' 36' ' ' ARG . 37.4 tt0 -74.3 154.38 38.95 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-N 113.047 -1.888 . . . . 0.0 112.104 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.459 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 82.7 m 177.59 125.3 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.209 1 O-C-N 132.754 6.284 . . . . 0.0 111.847 179.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.447 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 8.5 tmtt? -112.74 142.46 45.33 Favored 'General case' 0 C--O 1.237 0.417 0 O-C-N 127.23 2.831 . . . . 0.0 107.668 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.527 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.5 mp -131.6 159.85 42.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 127.456 2.973 . . . . 0.0 111.044 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.527 ' N ' HG22 ' A' ' 42' ' ' ILE 0.262 0.0 OUTLIER -131.41 150.74 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.604 0 CA-C-N 110.912 -2.858 . . . . 0.0 107.968 179.98 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.634 HG12 ' N ' ' A' ' 45' ' ' GLN . 1.2 t -132.4 -54.98 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.029 0 C-N-CA 116.544 -2.062 . . . . 0.0 116.102 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.634 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.0 OUTLIER 44.48 88.52 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.894 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 -179.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.71 45.9 0.98 Allowed 'General case' 0 N--CA 1.481 1.095 1 O-C-N 129.322 4.139 . . . . 0.0 114.622 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.58 93.42 0.36 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-O 117.8 -1.556 . . . . 0.0 113.61 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 75.49 -30.9 0.2 Allowed 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 117.527 2.417 . . . . 0.0 117.527 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 66' ' ' THR . 18.3 m-20 -109.11 100.98 10.07 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.415 2.686 . . . . 0.0 108.191 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.42 ' CE1' HG12 ' A' ' 43' ' ' ILE . 25.8 t80 -99.67 102.06 13.43 Favored 'General case' 0 C--N 1.311 -1.109 1 O-C-N 130.353 4.783 . . . . 0.0 115.059 -178.769 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -115.21 67.62 0.7 Allowed 'General case' 0 CA--C 1.493 -1.215 1 O-C-N 129.623 4.327 . . . . 0.0 117.797 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -58.52 125.88 25.22 Favored 'General case' 0 C--N 1.361 1.098 0 O-C-N 127.694 3.121 . . . . 0.0 105.838 179.247 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -129.56 154.17 47.32 Favored 'General case' 0 CA--C 1.485 -1.535 0 O-C-N 128.503 3.627 . . . . 0.0 112.284 -178.081 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.507 HG23 ' H ' ' A' ' 56' ' ' SER . 0.6 OUTLIER -106.56 167.46 9.84 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 126.039 2.087 . . . . 0.0 109.938 179.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.507 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -137.93 39.56 2.35 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.507 ' H ' HG23 ' A' ' 54' ' ' THR . 14.7 m -75.5 154.32 36.98 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 128.437 3.586 . . . . 0.0 105.245 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.813 ' OG1' HD12 ' A' ' 37' ' ' LEU . 40.6 p -85.65 -1.51 57.23 Favored 'General case' 0 N--CA 1.481 1.091 1 O-C-N 131.285 5.366 . . . . 0.0 109.125 -179.848 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.837 ' HB3' HD11 ' A' ' 37' ' ' LEU . 2.5 p90 -118.21 -40.87 2.91 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.66 128.02 18.86 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 112.695 -2.048 . . . . 0.0 115.052 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -113.09 -161.75 0.77 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 128.677 3.735 . . . . 0.0 107.256 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER 60.9 83.62 0.14 Allowed 'General case' 0 CA--C 1.504 -0.808 0 O-C-N 126.408 2.317 . . . . 0.0 110.194 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.19 -65.99 0.93 Allowed 'General case' 0 C--O 1.208 -1.114 0 O-C-N 126.749 2.53 . . . . 0.0 113.894 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 1.126 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 5.2 tp -136.82 41.87 2.49 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 118.455 2.761 . . . . 0.0 118.455 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.56 98.07 0.24 Allowed 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.543 ' CD2' HG21 ' A' ' 87' ' ' VAL . 5.9 m-85 -140.63 -178.36 5.49 Favored 'General case' 0 CA--C 1.488 -1.408 1 CA-C-O 129.427 4.442 . . . . 0.0 110.01 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.59 HG22 HG23 ' A' ' 69' ' ' VAL . 1.6 m -150.61 121.91 7.83 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 109.648 -3.433 . . . . 0.0 104.143 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.795 HG21 ' NE1' ' A' ' 89' ' ' TRP . 5.2 t -61.25 144.1 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 O-C-N 128.134 3.396 . . . . 0.0 116.59 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.95 15.97 61.12 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-N 108.94 -3.754 . . . . 0.0 117.201 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.59 HG23 HG22 ' A' ' 66' ' ' THR 0.269 11.1 t -81.07 -25.43 10.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 C-N-CA 119.044 -1.062 . . . . 0.0 109.344 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 67.86 77.6 0.25 Allowed 'General case' 0 C--N 1.364 1.208 0 O-C-N 129.06 3.975 . . . . 0.0 108.909 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.528 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 1.3 m-85 -60.51 99.0 0.07 Allowed 'General case' 0 C--N 1.355 0.811 0 O-C-N 127.497 2.998 . . . . 0.0 115.836 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.444 ' C ' ' HG3' ' A' ' 73' ' ' GLU . 74.2 m-20 -68.55 73.11 0.23 Allowed 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 112.358 -2.201 . . . . 0.0 111.352 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.493 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 6.7 mt-10 53.11 -156.51 0.18 Allowed 'General case' 0 CA--C 1.507 -0.683 0 CA-C-O 121.499 0.666 . . . . 0.0 112.339 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.8 m80 71.5 87.97 0.11 Allowed 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 124.763 2.221 . . . . 0.0 112.631 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -125.93 122.56 36.33 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-N 110.214 -3.175 . . . . 0.0 113.04 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.24 168.96 18.52 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 127.657 3.098 . . . . 0.0 112.254 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.13 34.63 64.52 Favored Glycine 0 C--O 1.207 -1.536 0 CA-C-N 111.782 -2.463 . . . . 0.0 107.845 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.52 ' O ' HD12 ' A' ' 26' ' ' ILE . 4.5 tp -167.45 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.51 -0.57 1 O-C-N 130.417 4.245 . . . . 0.0 116.501 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 1.02 ' HB2' HD12 ' A' ' 24' ' ' LEU . 7.7 t70 -155.17 -57.4 0.1 Allowed 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 116.197 -2.201 . . . . 0.0 113.055 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.63 76.86 1.31 Allowed Glycine 0 C--O 1.213 -1.169 0 O-C-N 126.104 2.127 . . . . 0.0 111.619 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.524 ' HG3' HG23 ' A' ' 83' ' ' VAL . 9.3 ptt180 -137.05 -156.91 0.73 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 111.342 -2.429 . . . . 0.0 111.168 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.493 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.5 OUTLIER -160.14 105.08 1.51 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 128.167 3.417 . . . . 0.0 108.488 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.524 HG23 ' HG3' ' A' ' 81' ' ' ARG . 12.8 t -144.27 135.33 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.2 0 N-CA-C 117.48 2.4 . . . . 0.0 117.48 -178.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.521 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -49.58 145.07 5.26 Favored 'General case' 0 N--CA 1.467 0.39 1 O-C-N 129.708 4.38 . . . . 0.0 106.266 178.183 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.528 ' HB ' ' CB ' ' A' ' 71' ' ' PHE . 78.3 m -150.42 66.14 0.95 Allowed 'General case' 0 C--O 1.201 -1.459 0 O-C-N 127.537 3.023 . . . . 0.0 115.251 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 6.0 tt -62.04 140.58 58.36 Favored 'General case' 0 N--CA 1.432 -1.373 1 CA-C-N 108.12 -4.127 . . . . 0.0 110.811 -179.765 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.543 HG21 ' CD2' ' A' ' 65' ' ' PHE . 3.9 t -132.39 135.98 56.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 C-N-CA 126.1 1.76 . . . . 0.0 108.414 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.47 ' HA ' ' CG1' ' A' ' 67' ' ' VAL . 9.7 t -159.81 156.67 27.89 Favored 'General case' 0 CA--C 1.473 -1.982 0 CA-C-O 124.462 2.077 . . . . 0.0 109.28 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.795 ' NE1' HG21 ' A' ' 67' ' ' VAL . 38.5 m95 -90.34 145.31 25.06 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-O 114.602 -2.618 . . . . 0.0 106.761 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.826 ' HB3' HG22 ' A' ' 93' ' ' THR . 7.0 tp10 -97.38 -8.53 29.32 Favored 'General case' 0 CA--C 1.489 -1.367 1 CA-C-O 129.462 4.458 . . . . 0.0 112.055 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.95 -19.17 11.22 Favored Glycine 0 C--O 1.2 -2.023 0 CA-C-N 108.731 -3.85 . . . . 0.0 106.097 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.498 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.8 OUTLIER -158.96 44.88 0.27 Allowed 'General case' 0 N--CA 1.431 -1.391 1 O-C-N 131.826 5.074 . . . . 0.0 111.766 179.978 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.826 HG22 ' HB3' ' A' ' 90' ' ' GLU . 15.1 t 164.1 144.88 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.916 2.561 . . . . 0.0 117.916 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.756 ' CD2' HD21 ' A' ' 63' ' ' LEU . 1.2 tp -87.55 83.17 7.28 Favored 'General case' 0 CA--C 1.504 -0.798 0 O-C-N 127.397 2.936 . . . . 0.0 114.907 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.479 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.355 73.8 t -81.03 127.63 39.38 Favored 'Isoleucine or valine' 0 C--N 1.351 0.672 1 O-C-N 129.285 4.116 . . . . 0.0 111.394 179.663 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -139.23 141.39 37.87 Favored 'General case' 0 C--O 1.196 -1.749 0 N-CA-C 103.953 -2.61 . . . . 0.0 103.953 -179.019 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.2 t -121.87 91.13 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.736 0 N-CA-C 119.719 3.229 . . . . 0.0 119.719 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.441 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 17.4 mm-40 -65.97 97.84 0.39 Allowed 'General case' 0 C--N 1.361 1.072 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.521 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 1.1 tmtm? -39.29 -49.24 1.93 Allowed 'General case' 0 N--CA 1.48 1.075 0 O-C-N 128.507 3.629 . . . . 0.0 112.417 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.467 ' H ' ' CG1' ' A' ' 83' ' ' VAL . . . 87.4 133.97 4.1 Favored Glycine 0 C--O 1.206 -1.652 1 CA-C-O 128.076 4.153 . . . . 0.0 113.879 179.382 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.412 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -100.78 -46.36 5.17 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 108.955 -3.622 . . . . 0.0 107.607 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.412 ' CG ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -146.24 16.44 1.34 Allowed 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 127.798 2.439 . . . . 0.0 115.965 179.773 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.65 -178.73 7.54 Favored 'General case' 0 C--O 1.2 -1.538 0 C-N-CA 125.859 1.664 . . . . 0.0 114.349 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.638 ' O ' HG22 ' A' ' 121' ' ' THR . 7.9 m120 -125.39 88.22 2.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 127.699 3.124 . . . . 0.0 102.827 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.639 HH21 HD13 ' A' ' 24' ' ' LEU . 57.9 mmt-85 -92.92 2.79 56.6 Favored 'General case' 0 C--O 1.212 -0.894 0 O-C-N 126.9 2.625 . . . . 0.0 113.427 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.417 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -37.98 99.44 0.01 OUTLIER Glycine 0 C--O 1.209 -1.41 2 O-C-N 131.974 5.796 . . . . 0.0 113.093 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 1.126 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.299 0.0 OUTLIER -108.63 126.8 53.36 Favored 'General case' 0 C--O 1.209 -1.032 0 O-C-N 128.954 3.385 . . . . 0.0 110.025 179.546 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -153.52 155.08 35.54 Favored 'General case' 0 C--O 1.201 -1.478 0 CA-C-O 128.299 3.904 . . . . 0.0 113.809 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.505 HE22 HD23 ' A' ' 94' ' ' LEU . 0.8 OUTLIER -114.93 -179.42 3.62 Favored 'General case' 0 C--N 1.366 1.283 1 CA-C-N 108.006 -4.179 . . . . 0.0 109.562 -179.186 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.455 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.6 OUTLIER 174.55 77.86 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.509 1 O-C-N 132.017 5.823 . . . . 0.0 117.743 179.113 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 63.6 t -27.55 101.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.817 1 CA-C-O 128.61 4.053 . . . . 0.0 117.435 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -111.06 -179.79 3.83 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 112.257 -2.247 . . . . 0.0 111.852 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -25.8 73.94 0.0 OUTLIER Glycine 0 C--O 1.204 -1.742 0 C-N-CA 127.284 2.373 . . . . 0.0 116.633 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 43.25 68.45 0.51 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 127.674 2.39 . . . . 0.0 116.823 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.473 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 9.3 pttt 160.33 164.83 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.161 1 O-C-N 133.128 6.517 . . . . 0.0 108.33 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.679 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -105.14 151.55 23.89 Favored 'General case' 0 CA--C 1.478 -1.789 0 O-C-N 127.088 2.743 . . . . 0.0 113.544 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.586 ' H ' HD23 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -113.14 98.34 7.08 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 113.425 -1.716 . . . . 0.0 115.609 -179.768 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.494 ' CD2' ' HG2' ' A' ' 109' ' ' GLN . 8.3 mt -85.98 77.61 9.63 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 128.178 3.424 . . . . 0.0 107.593 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.455 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.4 mt-10 -88.81 95.24 10.21 Favored 'General case' 0 CA--C 1.494 -1.19 0 O-C-N 126.666 2.479 . . . . 0.0 111.434 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.576 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -110.79 166.11 11.29 Favored 'General case' 0 N--CA 1.481 1.115 0 O-C-N 127.307 2.879 . . . . 0.0 108.466 179.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.638 HG22 ' O ' ' A' ' 104' ' ' ASN . 20.2 m -122.18 156.35 33.89 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 110.498 -3.046 . . . . 0.0 105.259 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.8 OUTLIER -162.35 59.9 0.23 Allowed 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 125.283 2.468 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.44 32.93 14.82 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 113.426 -1.715 . . . . 0.0 113.478 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 73.11 28.03 1.94 Allowed 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 111.576 -2.312 . . . . 0.0 111.485 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.45 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -87.15 -28.06 22.68 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 110.896 -2.866 . . . . 0.0 108.165 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.431 ' O ' HG22 ' A' ' 126' ' ' VAL . 0.3 OUTLIER 45.81 119.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 1 O-C-N 131.38 5.425 . . . . 0.0 113.477 -179.766 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.1 t -112.19 120.51 42.04 Favored 'General case' 0 CA--C 1.5 -0.954 0 O-C-N 117.991 -2.943 . . . . 0.0 111.452 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.38 99.0 8.09 Favored 'General case' 0 CA--C 1.51 -0.578 0 O-C-N 127.105 2.753 . . . . 0.0 112.038 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -79.68 172.2 14.1 Favored 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 12.2 t -140.42 148.66 22.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 103.788 -2.671 . . . . 0.0 103.788 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.473 ' CB ' ' HB2' ' A' ' 115' ' ' LYS . 18.8 m-85 -138.24 -177.18 4.72 Favored 'General case' 0 CA--C 1.485 -1.534 0 CA-C-O 127.454 3.502 . . . . 0.0 116.797 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.277 9.2 tppt? -162.7 105.18 1.07 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 110.975 -2.83 . . . . 0.0 103.418 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 6.2 ttpt -68.59 78.39 0.28 Allowed 'General case' 0 C--O 1.201 -1.455 0 CA-C-N 111.969 -2.378 . . . . 0.0 113.496 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt . . . . . 0 CA--C 1.481 -1.677 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -179.939 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 50.6 m -160.01 -62.13 0.07 Allowed 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 123.441 1.591 . . . . 0.0 107.847 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.517 ' HG2' ' CZ2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER -68.71 -150.93 0.01 OUTLIER 'General case' 0 C--N 1.357 0.929 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -71.2 -169.74 0.41 Allowed 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.399 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -164.95 148.54 8.65 Favored 'General case' 0 C--N 1.309 -1.152 0 N-CA-C 104.451 -2.425 . . . . 0.0 104.451 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -46.16 158.3 0.1 Allowed 'General case' 0 C--N 1.313 -0.982 1 O-C-N 132.83 6.331 . . . . 0.0 116.566 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.77 -167.53 33.68 Favored Glycine 0 C--O 1.203 -1.828 0 O-C-N 127.332 2.895 . . . . 0.0 112.314 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.01 147.01 33.29 Favored 'General case' 0 C--N 1.316 -0.852 1 O-C-N 132.64 5.553 . . . . 0.0 107.801 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.84 ' CE3' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -140.56 130.1 24.08 Favored 'General case' 0 C--N 1.323 -0.548 1 O-C-N 133.282 6.614 . . . . 0.0 111.137 -179.644 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -86.47 -6.25 58.96 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 126.753 2.533 . . . . 0.0 115.332 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.476 ' HG3' ' CE1' ' A' ' 131' ' ' PHE . 19.8 ttm 54.88 85.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.678 0 O-C-N 125.073 1.483 . . . . 0.0 107.257 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -25.43 -38.01 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 131.034 3.734 . . . . 0.0 110.741 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 173.47 169.17 0.17 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 126.753 3.168 . . . . 0.0 111.513 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -104.88 160.86 14.67 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 108.653 -3.885 . . . . 0.0 114.757 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -122.97 -64.41 1.18 Allowed 'General case' 0 CA--C 1.494 -1.183 1 O-C-N 130.275 4.734 . . . . 0.0 113.978 179.79 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -127.22 85.9 2.43 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.681 -1.145 . . . . 0.0 113.872 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -43.44 7.62 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.687 3.117 . . . . 0.0 112.378 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.262 32.9 tt0 -79.6 -35.34 39.73 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 111.096 -2.775 . . . . 0.0 114.282 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -76.91 -22.73 71.05 Favored Glycine 0 N--CA 1.478 1.481 0 C-N-CA 115.301 -3.333 . . . . 0.0 110.917 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.527 ' CE1' HD11 ' A' ' 120' ' ' LEU . 8.9 t80 -62.4 -33.38 74.65 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 124.608 2.147 . . . . 0.0 108.522 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.478 ' HB3' ' CG2' ' A' ' 26' ' ' ILE 0.282 51.4 mtp -75.64 -26.05 57.4 Favored 'General case' 0 CA--C 1.482 -1.667 0 CA-C-N 112.876 -1.965 . . . . 0.0 108.63 -179.752 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -80.02 -29.05 39.31 Favored 'General case' 0 C--N 1.312 -1.057 0 O-C-N 125.511 1.757 . . . . 0.0 112.841 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.61 -46.23 84.35 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 111.061 -2.79 . . . . 0.0 113.925 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.827 HD11 ' HB ' ' A' ' 26' ' ' ILE . 4.0 pp -83.82 -27.12 28.99 Favored 'General case' 0 N--CA 1.48 1.043 1 O-C-N 130.029 4.581 . . . . 0.0 103.005 179.11 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 80.99 93.4 0.05 OUTLIER 'General case' 0 CA--C 1.483 -1.633 1 CA-C-O 129.486 4.469 . . . . 0.0 114.312 179.252 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.827 ' HB ' HD11 ' A' ' 24' ' ' LEU . 1.0 OUTLIER -134.23 20.78 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-O 127.415 3.483 . . . . 0.0 107.669 179.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.54 99.45 0.03 OUTLIER 'General case' 0 C--N 1.366 1.309 0 CA-C-N 112.27 -2.241 . . . . 0.0 113.516 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -132.98 16.01 4.22 Favored 'General case' 0 CA--C 1.488 -1.423 0 O-C-N 128.81 3.819 . . . . 0.0 112.144 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 48.6 38.65 11.69 Favored 'General case' 0 C--O 1.208 -1.095 0 CA-C-O 126.321 2.962 . . . . 0.0 109.987 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.19 -11.17 33.38 Favored 'General case' 0 C--N 1.349 0.556 1 CA-C-N 108.326 -4.034 . . . . 0.0 112.092 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -102.31 -172.37 2.12 Favored 'General case' 0 C--O 1.222 -0.373 1 O-C-N 130.791 5.057 . . . . 0.0 110.872 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 91.6 -9.27 0.24 Allowed 'General case' 0 C--O 1.202 -1.428 1 O-C-N 131.312 5.383 . . . . 0.0 112.99 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.655 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.6 OUTLIER -125.79 4.16 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 O-C-N 128.238 3.461 . . . . 0.0 111.682 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -120.8 31.75 6.28 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 123.182 1.468 . . . . 0.0 108.488 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -41.19 -42.24 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.303 0 CA-C-N 110.739 -2.937 . . . . 0.0 111.242 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.734 ' C ' HD23 ' A' ' 37' ' ' LEU . 7.0 tmm_? 150.26 125.02 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.149 2 CA-C-N 107.472 -4.422 . . . . 0.0 113.07 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.914 HD11 ' CZ ' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -145.14 110.69 5.34 Favored 'General case' 0 N--CA 1.435 -1.178 1 O-C-N 129.428 4.205 . . . . 0.0 107.343 -179.961 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.7 m 75.94 25.43 1.11 Allowed 'General case' 0 CA--C 1.502 -0.9 1 O-C-N 132.991 6.432 . . . . 0.0 112.653 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.494 ' CB ' ' HG3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -70.12 110.67 5.28 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.026 2.704 . . . . 0.0 116.23 -179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.4 m -137.58 101.67 4.55 Favored 'General case' 0 C--O 1.206 -1.189 1 O-C-N 129.178 4.049 . . . . 0.0 113.203 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.589 ' HZ1' HD11 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -77.72 139.75 39.44 Favored 'General case' 0 C--O 1.222 -0.372 0 O-C-N 126.671 2.482 . . . . 0.0 108.795 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.443 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.3 mp -125.15 161.45 29.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 126.509 2.38 . . . . 0.0 109.698 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.742 HD11 ' HE2' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -137.12 126.14 35.76 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.528 0 O-C-N 127.504 3.003 . . . . 0.0 110.439 -179.813 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.655 ' N ' HD13 ' A' ' 43' ' ' ILE . 93.8 t -129.48 86.67 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 112.443 -2.162 . . . . 0.0 111.128 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.61 140.41 32.07 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 127.107 2.754 . . . . 0.0 112.199 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -151.7 31.95 0.57 Allowed 'General case' 0 CA--C 1.488 -1.408 1 CA-C-N 107.435 -4.438 . . . . 0.0 117.41 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 93.92 -70.07 1.35 Allowed Glycine 0 C--O 1.205 -1.682 0 O-C-N 119.941 -1.724 . . . . 0.0 111.29 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.61 98.28 3.65 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 129.159 3.505 . . . . 0.0 110.695 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.451 ' ND2' ' HE2' ' A' ' 51' ' ' LYS . 42.1 t30 116.66 79.68 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.604 1 O-C-N 129.577 4.298 . . . . 0.0 108.463 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.742 ' HE2' HD11 ' A' ' 43' ' ' ILE . 7.6 t80 -90.5 125.96 35.76 Favored 'General case' 0 C--N 1.313 -1.004 1 O-C-N 131.974 5.797 . . . . 0.0 110.08 179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.451 ' HE2' ' ND2' ' A' ' 49' ' ' ASN . 2.8 mttt -137.05 80.08 1.79 Allowed 'General case' 0 CA--C 1.492 -1.259 0 O-C-N 128.267 3.479 . . . . 0.0 119.027 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.517 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -60.3 157.64 13.23 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 128.397 3.561 . . . . 0.0 107.053 179.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 62' ' ' ASP . 0.3 OUTLIER -167.64 141.56 3.54 Favored 'General case' 0 CA--C 1.487 -1.454 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.571 -179.513 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.53 161.32 14.41 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.617 1.198 . . . . 0.0 111.258 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -128.59 28.72 5.38 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 116.219 1.933 . . . . 0.0 116.219 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 91.0 p -64.3 145.83 55.39 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 128.65 3.719 . . . . 0.0 105.102 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.8 m -64.82 -27.35 68.82 Favored 'General case' 0 N--CA 1.469 0.496 1 O-C-N 132.101 5.876 . . . . 0.0 107.46 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.914 ' CZ ' HD11 ' A' ' 37' ' ' LEU . 4.3 m-30 -82.21 -79.02 0.19 Allowed 'General case' 0 C--O 1.239 0.543 0 O-C-N 128.799 3.812 . . . . 0.0 117.615 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -115.8 88.58 2.91 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 127.603 3.064 . . . . 0.0 115.269 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -92.47 63.3 4.1 Favored 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.221 4.076 . . . . 0.0 110.636 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -88.57 111.79 22.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 111.772 -2.467 . . . . 0.0 109.394 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 17.5 p30 -77.64 161.87 27.47 Favored 'General case' 0 C--O 1.204 -1.294 0 O-C-N 127.437 2.961 . . . . 0.0 115.717 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.517 ' HB2' HG22 ' A' ' 52' ' ' THR . 12.4 tp -106.8 45.41 0.98 Allowed 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 112.697 -2.047 . . . . 0.0 111.554 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -71.59 95.0 1.37 Allowed 'General case' 0 C--O 1.203 -1.382 1 O-C-N 129.285 4.116 . . . . 0.0 110.704 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.681 ' CE2' HG22 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -159.57 132.29 6.74 Favored 'General case' 0 CA--C 1.483 -1.606 1 CA-C-O 131.111 5.243 . . . . 0.0 112.912 179.93 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.481 HG23 ' N ' ' A' ' 67' ' ' VAL . 0.4 OUTLIER -85.83 172.04 11.07 Favored 'General case' 0 C--O 1.21 -1.012 0 O-C-N 116.835 -3.666 . . . . 0.0 110.32 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.935 HG21 ' CD1' ' A' ' 89' ' ' TRP . 10.3 t -82.12 136.02 23.8 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.909 0 O-C-N 127.86 3.225 . . . . 0.0 112.916 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.56 5.85 19.48 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.687 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.427 HG11 ' HD1' ' A' ' 71' ' ' PHE . 8.2 p -60.87 -20.93 22.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.192 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 58.14 72.58 0.51 Allowed 'General case' 0 C--N 1.353 0.718 1 O-C-N 130.344 4.777 . . . . 0.0 109.047 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.58 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.4 OUTLIER -66.88 141.42 57.66 Favored 'General case' 0 CA--C 1.493 -1.24 2 CA-C-N 106.648 -4.796 . . . . 0.0 118.254 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -120.91 63.47 0.87 Allowed 'General case' 0 CA--C 1.485 -1.533 0 CA-C-O 124.21 1.957 . . . . 0.0 113.541 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -55.18 143.13 28.57 Favored 'General case' 0 CA--C 1.492 -1.262 0 CA-C-O 125.081 2.372 . . . . 0.0 108.514 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -111.32 18.69 19.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 112.972 -1.922 . . . . 0.0 115.789 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 16.73 98.77 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.06 0 O-C-N 127.095 2.747 . . . . 0.0 115.956 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.84 146.07 27.79 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 128.116 3.385 . . . . 0.0 115.479 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.16 -32.1 7.98 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-N 110.04 -3.255 . . . . 0.0 110.666 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.565 ' O ' HD12 ' A' ' 26' ' ' ILE . 7.2 tp -117.86 -4.23 11.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 129.617 3.775 . . . . 0.0 116.655 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.433 ' HB3' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -159.75 -72.43 0.08 Allowed 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 118.296 -1.361 . . . . 0.0 114.361 -179.879 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.21 84.88 1.79 Allowed Glycine 0 N--CA 1.466 0.688 0 CA-C-O 122.188 0.882 . . . . 0.0 111.273 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.446 ' O ' ' ND2' ' A' ' 82' ' ' ASN . 0.0 OUTLIER -148.87 -127.32 0.05 Allowed 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.861 -2.17 . . . . 0.0 114.716 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.446 ' ND2' ' O ' ' A' ' 81' ' ' ARG . 3.3 p30 164.43 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 124.533 1.145 . . . . 0.0 110.069 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.439 HG13 ' HA2' ' A' ' 100' ' ' GLY . 0.8 OUTLIER -146.59 165.92 7.67 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.798 0 N-CA-C 117.443 2.386 . . . . 0.0 117.443 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.482 ' CB ' ' HB2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -74.82 167.7 21.33 Favored 'General case' 0 C--O 1.241 0.628 2 O-C-N 132.58 6.175 . . . . 0.0 107.715 179.458 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.58 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.2 m -173.4 86.69 0.06 Allowed 'General case' 0 C--O 1.194 -1.828 1 O-C-N 130.197 4.685 . . . . 0.0 111.1 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 110.18 21.56 Favored 'General case' 0 N--CA 1.43 -1.444 1 CA-C-N 106.862 -4.699 . . . . 0.0 116.874 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.681 HG22 ' CE2' ' A' ' 65' ' ' PHE . 17.6 t -80.77 150.59 4.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 CA-C-N 111.859 -2.428 . . . . 0.0 108.667 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.287 22.3 m -160.14 145.77 15.28 Favored 'General case' 0 CA--C 1.474 -1.962 0 CA-C-N 112.608 -2.087 . . . . 0.0 109.964 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.935 ' CD1' HG21 ' A' ' 67' ' ' VAL . 8.9 m95 -85.69 129.09 34.91 Favored 'General case' 0 C--N 1.357 0.899 0 CA-C-O 113.696 -3.05 . . . . 0.0 105.461 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.544 ' HB3' HG21 ' A' ' 93' ' ' THR . 0.5 OUTLIER -99.33 -9.53 23.43 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 127.224 3.392 . . . . 0.0 116.243 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 147.34 -78.2 0.24 Allowed Glycine 0 C--O 1.194 -2.363 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.486 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -134.75 100.5 4.63 Favored 'General case' 0 C--O 1.195 -1.788 1 O-C-N 131.502 4.884 . . . . 0.0 103.265 179.591 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.544 HG21 ' HB3' ' A' ' 90' ' ' GLU . 4.5 t 166.42 -131.87 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 127.478 2.986 . . . . 0.0 113.132 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.587 HD22 ' CE1' ' A' ' 50' ' ' PHE 0.292 1.2 tp 166.19 70.03 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.08 0 C-N-CA 129.697 3.199 . . . . 0.0 113.925 179.465 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.36 45.5 t -74.66 132.72 32.9 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 N-CA-C 118.586 2.81 . . . . 0.0 118.586 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -137.72 129.67 28.78 Favored 'General case' 0 C--O 1.199 -1.56 0 N-CA-C 103.05 -2.944 . . . . 0.0 103.05 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 5.2 t -104.37 99.62 8.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 C-N-CA 127.254 2.222 . . . . 0.0 116.527 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -79.84 93.14 5.58 Favored 'General case' 0 C--N 1.36 1.022 0 CA-C-O 125.398 2.523 . . . . 0.0 110.682 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.482 ' HB2' ' CB ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -75.55 87.35 2.66 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 111.89 -2.413 . . . . 0.0 111.089 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.439 ' HA2' HG13 ' A' ' 83' ' ' VAL . . . -118.66 165.65 12.94 Favored Glycine 0 C--O 1.209 -1.432 1 CA-C-O 128.566 4.425 . . . . 0.0 113.823 -179.671 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -129.89 109.48 10.94 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 109.98 -3.11 . . . . 0.0 110.798 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? 125.89 -36.25 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.291 0 O-C-N 127.708 3.13 . . . . 0.0 110.881 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.18 156.24 43.28 Favored 'General case' 0 C--O 1.199 -1.587 1 CA-C-N 107.83 -4.259 . . . . 0.0 113.393 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -115.29 118.53 33.53 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 109.868 -3.333 . . . . 0.0 103.537 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 122' ' ' CYS . 6.5 mmt85 -110.91 11.84 22.27 Favored 'General case' 0 C--O 1.213 -0.835 1 O-C-N 129.746 4.404 . . . . 0.0 109.523 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -51.81 92.85 0.01 OUTLIER Glycine 0 N--CA 1.429 -1.789 2 CA-C-N 106.814 -4.721 . . . . 0.0 111.929 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.44 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.262 0.0 OUTLIER -107.43 143.14 36.19 Favored 'General case' 0 C--O 1.206 -1.214 1 O-C-N 130.786 4.463 . . . . 0.0 109.904 179.662 . . . . . . . . 5 4 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.524 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 2.3 ptpt -158.14 172.22 18.8 Favored 'General case' 0 CA--C 1.507 -0.705 1 O-C-N 132.095 5.872 . . . . 0.0 114.43 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.519 ' OE1' HD22 ' A' ' 118' ' ' LEU . 0.3 OUTLIER -122.44 176.69 5.75 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 113.86 -2.971 . . . . 0.0 105.0 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.524 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 20.0 m95 -133.28 -55.64 0.91 Allowed 'General case' 0 C--N 1.311 -1.075 0 O-C-N 125.988 2.055 . . . . 0.0 112.001 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.535 HG23 ' HA ' ' A' ' 93' ' ' THR . 10.8 t 87.37 57.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.214 -0.777 1 CA-C-O 130.222 4.82 . . . . 0.0 110.134 -176.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.95 67.55 1.27 Allowed 'General case' 0 CA--C 1.478 -1.812 1 CA-C-N 107.006 -4.634 . . . . 0.0 117.757 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 87.83 -88.39 1.56 Allowed Glycine 0 C--O 1.202 -1.887 0 N-CA-C 117.527 1.771 . . . . 0.0 117.527 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.474 ' HB2' ' HE2' ' A' ' 115' ' ' LYS . 74.5 m-20 -100.94 -23.9 14.45 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 118.962 2.949 . . . . 0.0 118.962 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.474 ' HE2' ' HB2' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -130.72 -168.45 1.99 Allowed 'General case' 0 CA--C 1.499 -0.981 1 O-C-N 130.205 4.691 . . . . 0.0 110.199 179.987 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.84 HD22 ' CE3' ' A' ' 9' ' ' TRP . 0.5 OUTLIER -146.31 94.66 2.49 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 128.123 3.821 . . . . 0.0 111.156 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.14 124.47 20.07 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 109.145 -3.662 . . . . 0.0 110.47 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.519 HD22 ' OE1' ' A' ' 109' ' ' GLN . 2.6 mt -95.2 72.2 3.32 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 127.539 3.024 . . . . 0.0 108.882 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -71.39 91.89 1.04 Allowed 'General case' 0 CA--C 1.494 -1.205 0 O-C-N 128.964 3.915 . . . . 0.0 110.909 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.658 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -102.87 160.4 14.64 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 114.26 -1.336 . . . . 0.0 107.55 179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.658 ' O ' HD12 ' A' ' 120' ' ' LEU . 4.7 m -124.17 168.73 12.53 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.365 1.666 . . . . 0.0 110.799 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.475 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 10.3 t -167.8 50.8 0.06 Allowed 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 126.347 2.975 . . . . 0.0 110.38 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 103.29 6.91 44.22 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 112.244 -2.253 . . . . 0.0 112.284 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.9 t0 100.57 28.45 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.058 0 O-C-N 128.523 3.131 . . . . 0.0 112.299 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -85.36 -17.27 37.23 Favored 'General case' 0 C--O 1.206 -1.188 0 C-N-CA 114.207 -2.997 . . . . 0.0 105.468 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 33.3 85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 O-C-N 129.051 3.969 . . . . 0.0 113.284 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 77.0 m -59.44 152.48 21.46 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 105.113 -2.18 . . . . 0.0 105.113 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.18 70.95 1.46 Allowed 'General case' 0 CA--C 1.486 -1.501 0 CA-C-O 124.374 2.035 . . . . 0.0 112.604 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -57.49 170.51 0.53 Allowed 'General case' 0 C--N 1.358 0.936 0 C-N-CA 116.611 -2.035 . . . . 0.0 111.695 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 11.5 t -141.62 105.03 1.4 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.295 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.476 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 12.0 m-85 -99.28 162.37 13.09 Favored 'General case' 0 CA--C 1.494 -1.204 1 CA-C-N 108.111 -4.131 . . . . 0.0 117.628 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.452 ' HD2' ' C ' ' A' ' 132' ' ' LYS 0.384 0.0 OUTLIER -147.82 129.44 15.04 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 110.579 -3.01 . . . . 0.0 104.471 179.989 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.516 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 17.0 tttm -68.53 122.62 18.85 Favored 'General case' 0 C--O 1.198 -1.606 0 O-C-N 127.406 2.941 . . . . 0.0 110.997 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.245 0.861 0 CA-C-O 115.932 -1.985 . . . . 0.0 115.028 -179.906 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 122.705 1.24 . . . . 0.0 108.696 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.3 m -162.67 -52.14 0.04 OUTLIER 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 112.196 -2.274 . . . . 0.0 107.096 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.77 157.6 25.25 Favored 'General case' 0 CA--C 1.491 -1.3 0 O-C-N 127.685 3.116 . . . . 0.0 115.01 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.48 136.63 53.51 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.5 -2.778 . . . . 0.0 103.5 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.622 HE21 ' N ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -178.83 154.14 0.7 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 114.875 -2.488 . . . . 0.0 105.262 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 24.29 108.67 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.712 1 O-C-N 133.398 6.686 . . . . 0.0 116.934 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.511 ' N ' HG22 ' A' ' 43' ' ' ILE . . . -177.22 147.86 8.52 Favored Glycine 0 C--O 1.211 -1.296 0 CA-C-N 113.411 -1.722 . . . . 0.0 113.333 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.676 HG22 HG23 ' A' ' 42' ' ' ILE . 62.7 p -124.7 63.39 1.12 Allowed 'General case' 0 C--O 1.201 -1.451 0 O-C-N 127.228 2.369 . . . . 0.0 105.813 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.625 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -62.77 128.1 34.34 Favored 'General case' 0 N--CA 1.451 -0.421 1 O-C-N 130.838 5.086 . . . . 0.0 111.282 -179.672 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -77.41 -12.06 59.91 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.483 ' HB2' ' HE3' ' A' ' 11' ' ' MET . 37.6 ttm 54.53 74.97 0.32 Allowed 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 105.439 -2.059 . . . . 0.0 105.439 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.538 ' HG3' ' HG2' ' A' ' 132' ' ' LYS . 91.3 mt-10 -47.77 -51.9 20.67 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 127.01 2.694 . . . . 0.0 109.883 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.96 154.54 42.03 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 111.511 -2.586 . . . . 0.0 111.356 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.428 ' ND2' ' O ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -134.58 141.12 46.55 Favored 'General case' 0 CA--C 1.483 -1.63 0 O-C-N 128.49 3.619 . . . . 0.0 111.403 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.428 ' O ' ' ND2' ' A' ' 14' ' ' ASN . 3.0 mt-10 -77.21 -169.81 1.5 Allowed 'General case' 0 CA--C 1.483 -1.612 0 CA-C-N 112.661 -2.063 . . . . 0.0 114.085 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -30.1 100.42 0.02 OUTLIER 'General case' 0 C--O 1.203 -1.386 0 C-N-CA 127.108 2.163 . . . . 0.0 114.326 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -96.91 -24.8 15.68 Favored 'General case' 0 C--O 1.204 -1.299 0 O-C-N 125.791 1.932 . . . . 0.0 109.547 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -76.67 -37.6 55.93 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 113.45 -1.704 . . . . 0.0 112.762 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.7 -24.62 60.03 Favored Glycine 0 N--CA 1.487 2.048 0 C-N-CA 115.951 -3.023 . . . . 0.0 106.547 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.529 ' O ' HD23 ' A' ' 24' ' ' LEU . 1.1 t80 -68.58 -27.77 66.35 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-O 127.236 3.398 . . . . 0.0 108.488 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.569 ' HG2' HG22 ' A' ' 26' ' ' ILE . 3.5 ttt -70.22 -33.57 71.83 Favored 'General case' 0 CA--C 1.488 -1.442 0 CA-C-N 112.704 -2.044 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.9 mtmt -77.0 -21.76 54.16 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 109.177 -3.647 . . . . 0.0 115.987 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.01 -46.49 74.34 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 127.637 3.085 . . . . 0.0 113.456 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.609 HD11 ' HB ' ' A' ' 26' ' ' ILE . 0.5 OUTLIER -96.77 -9.91 27.86 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 128.593 3.683 . . . . 0.0 108.176 -179.71 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 16.9 t0 38.75 93.78 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.436 1 CA-C-O 129.296 4.379 . . . . 0.0 112.078 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.609 ' HB ' HD11 ' A' ' 24' ' ' LEU . 14.0 tt -105.3 39.38 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 108.684 -3.871 . . . . 0.0 108.525 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.4 t70 81.83 144.77 0.08 Allowed 'General case' 0 C--N 1.352 0.676 0 CA-C-O 116.485 -1.722 . . . . 0.0 108.658 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -96.71 155.57 16.72 Favored 'General case' 0 C--O 1.204 -1.301 1 O-C-N 129.389 4.181 . . . . 0.0 115.746 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.3 77.84 0.29 Allowed 'General case' 0 C--O 1.206 -1.235 0 CA-C-N 111.951 -2.386 . . . . 0.0 105.268 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.6 m -137.62 -61.07 0.64 Allowed 'General case' 0 C--N 1.354 0.791 2 CA-C-N 105.502 -5.317 . . . . 0.0 116.135 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -69.98 -155.05 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.986 0 O-C-N 128.419 3.574 . . . . 0.0 114.423 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.424 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.1 OUTLIER 89.33 -2.77 0.38 Allowed 'General case' 0 C--O 1.204 -1.34 1 O-C-N 130.502 4.876 . . . . 0.0 111.293 -179.722 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.409 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.8 OUTLIER -149.92 35.92 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.671 0 CA-C-N 110.436 -3.075 . . . . 0.0 109.033 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -141.6 35.32 1.63 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 126.025 2.822 . . . . 0.0 108.573 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 t -53.71 -34.27 24.31 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.457 0 CA-C-N 110.564 -3.017 . . . . 0.0 110.327 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.706 ' C ' HD23 ' A' ' 37' ' ' LEU . 16.1 ttp85 158.0 131.52 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.35 1 CA-C-N 107.488 -4.414 . . . . 0.0 111.584 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.06 HD21 ' CE2' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -130.44 83.9 2.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.543 -3.026 . . . . 0.0 105.65 -179.253 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 m 70.14 -21.07 0.18 Allowed 'General case' 0 C--N 1.317 -0.814 1 O-C-N 134.123 7.139 . . . . 0.0 117.436 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -13.74 92.18 0.01 OUTLIER 'General case' 0 CA--C 1.492 -1.251 0 O-C-N 127.773 3.171 . . . . 0.0 118.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -99.58 101.81 13.13 Favored 'General case' 0 C--O 1.203 -1.375 1 O-C-N 133.443 6.714 . . . . 0.0 109.182 179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.535 ' HE3' HD22 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -81.57 131.64 35.28 Favored 'General case' 0 N--CA 1.485 1.291 1 O-C-N 129.152 4.033 . . . . 0.0 109.6 -179.353 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.676 HG23 HG22 ' A' ' 8' ' ' THR . 8.1 mt -117.82 158.67 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 127.19 2.806 . . . . 0.0 109.814 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.511 HG22 ' N ' ' A' ' 7' ' ' GLY 0.28 0.0 OUTLIER -140.17 146.95 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.444 1 O-C-N 129.123 4.014 . . . . 0.0 109.117 -179.752 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.454 ' N ' ' O ' ' A' ' 51' ' ' LYS . 79.6 t -153.14 85.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.208 -1.1 0 CA-C-N 113.204 -1.816 . . . . 0.0 108.299 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.502 ' HB3' ' HA ' ' A' ' 5' ' ' GLN . 0.3 OUTLIER -103.18 117.37 34.38 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 126.605 2.441 . . . . 0.0 113.367 -179.282 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -151.48 106.69 3.31 Favored 'General case' 0 C--N 1.36 1.052 0 CA-C-N 111.249 -2.705 . . . . 0.0 116.848 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 33.97 100.79 0.01 OUTLIER Glycine 0 C--O 1.22 -0.768 0 O-C-N 126.951 2.657 . . . . 0.0 117.913 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.7 t0 78.94 -59.04 0.41 Allowed 'General case' 0 N--CA 1.441 -0.888 0 O-C-N 125.951 1.618 . . . . 0.0 115.087 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.08 116.83 29.27 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 125.067 1.347 . . . . 0.0 112.818 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.602 ' CE2' HD22 ' A' ' 94' ' ' LEU . 8.4 t80 -121.16 119.9 33.69 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 127.271 2.857 . . . . 0.0 117.096 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.472 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 0.2 OUTLIER -134.32 152.61 51.91 Favored 'General case' 0 C--O 1.193 -1.914 0 O-C-N 128.412 3.57 . . . . 0.0 112.169 179.561 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.622 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -133.33 174.09 10.77 Favored 'General case' 0 CA--C 1.508 -0.635 2 O-C-N 129.914 4.509 . . . . 0.0 106.816 179.645 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.518 ' N ' HG23 ' A' ' 52' ' ' THR . 0.1 OUTLIER -177.22 142.61 0.36 Allowed 'General case' 0 CA--C 1.482 -1.636 0 O-C-N 128.442 3.589 . . . . 0.0 109.893 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.427 HG23 ' HA ' ' A' ' 60' ' ' ASN . 6.5 t -92.03 158.97 15.94 Favored 'General case' 0 CA--C 1.51 -0.565 0 O-C-N 127.917 3.26 . . . . 0.0 111.738 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -131.18 33.53 4.12 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 113.834 -1.53 . . . . 0.0 114.521 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.4 t -72.97 159.41 33.73 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 126.476 2.36 . . . . 0.0 108.2 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.5 m -70.8 -36.09 72.82 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 110.617 -2.992 . . . . 0.0 105.409 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 1.06 ' CE2' HD21 ' A' ' 37' ' ' LEU . 5.4 m-85 -66.8 -62.42 1.45 Allowed 'General case' 0 C--N 1.361 1.082 0 CA-C-N 112.698 -2.046 . . . . 0.0 111.321 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -139.37 174.99 9.95 Favored 'General case' 0 C--N 1.361 1.099 2 CA-C-N 107.049 -4.614 . . . . 0.0 114.625 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.427 ' HA ' HG23 ' A' ' 54' ' ' THR . 1.5 m120 -146.11 39.88 1.12 Allowed 'General case' 0 C--O 1.203 -1.381 2 O-C-N 130.596 4.935 . . . . 0.0 111.03 -179.573 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -64.02 176.95 0.86 Allowed 'General case' 0 C--N 1.324 -0.523 0 O-C-N 126.664 2.477 . . . . 0.0 109.089 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -146.19 146.22 30.73 Favored 'General case' 0 C--O 1.199 -1.597 0 O-C-N 128.207 3.442 . . . . 0.0 116.769 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.622 ' HB2' HG22 ' A' ' 52' ' ' THR . 14.0 tp -92.24 47.44 1.33 Allowed 'General case' 0 C--N 1.361 1.073 0 CA-C-N 111.644 -2.526 . . . . 0.0 111.283 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 -60.92 93.37 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 104.611 -2.366 . . . . 0.0 104.611 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.478 ' CD2' HG21 ' A' ' 87' ' ' VAL . 1.6 m-30 -121.12 -178.09 3.67 Favored 'General case' 0 CA--C 1.491 -1.291 0 CA-C-O 126.962 3.268 . . . . 0.0 110.647 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -164.32 148.83 9.8 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 109.995 -3.275 . . . . 0.0 104.446 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.547 HG23 ' HA ' ' A' ' 88' ' ' THR . 12.0 p -68.81 133.16 32.27 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.202 0 O-C-N 127.276 2.86 . . . . 0.0 113.698 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 56.32 40.13 84.29 Favored Glycine 0 N--CA 1.483 1.8 0 CA-C-N 109.984 -3.28 . . . . 0.0 115.789 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -85.71 -14.97 10.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 C-N-CA 117.761 -1.575 . . . . 0.0 108.873 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 53.66 64.96 1.65 Allowed 'General case' 0 C--O 1.217 -0.612 1 O-C-N 131.981 5.8 . . . . 0.0 108.463 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.436 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 5.5 t80 -54.81 137.86 43.89 Favored 'General case' 0 CA--C 1.499 -1.018 1 O-C-N 129.879 4.487 . . . . 0.0 114.779 -178.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -102.4 71.0 1.19 Allowed 'General case' 0 C--O 1.202 -1.439 0 O-C-N 125.547 1.78 . . . . 0.0 108.032 179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -53.64 130.59 36.83 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 125.161 2.41 . . . . 0.0 111.351 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -142.83 38.19 1.46 Allowed 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 110.675 -2.966 . . . . 0.0 112.028 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.442 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -38.61 160.68 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.733 0 CA-C-N 111.232 -2.713 . . . . 0.0 116.315 -179.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.442 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 173.6 135.83 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 126.796 3.189 . . . . 0.0 112.447 179.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 116.85 -12.61 14.92 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-N 111.252 -2.704 . . . . 0.0 106.84 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 tp -117.31 -61.36 1.72 Allowed 'General case' 0 C--N 1.352 0.677 0 CA-C-N 108.993 -3.603 . . . . 0.0 116.583 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -123.19 -53.89 1.81 Allowed 'General case' 0 C--O 1.214 -0.801 0 CA-C-O 123.226 1.489 . . . . 0.0 112.793 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.48 79.08 0.79 Allowed Glycine 0 C--O 1.207 -1.591 0 CA-C-O 125.191 2.551 . . . . 0.0 111.425 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.464 ' HG3' ' N ' ' A' ' 82' ' ' ASN . 2.6 tpt180 -144.36 -101.34 0.11 Allowed 'General case' 0 N--CA 1.486 1.372 1 CA-C-N 107.513 -4.344 . . . . 0.0 113.875 -179.877 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.464 ' N ' ' HG3' ' A' ' 81' ' ' ARG . 0.5 OUTLIER 153.76 120.7 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.256 0 O-C-N 127.147 2.78 . . . . 0.0 108.368 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.556 HG12 ' H ' ' A' ' 84' ' ' LYS . 2.1 t -141.97 178.22 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 0 O-C-N 127.717 3.136 . . . . 0.0 113.266 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.556 ' H ' HG12 ' A' ' 83' ' ' VAL . 1.7 mtmt -119.87 95.6 4.83 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 127.038 2.711 . . . . 0.0 110.701 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 91.1 m -91.54 81.06 5.37 Favored 'General case' 0 C--O 1.195 -1.785 0 O-C-N 126.34 2.275 . . . . 0.0 115.244 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 0.6 OUTLIER -69.84 148.36 49.17 Favored 'General case' 0 N--CA 1.433 -1.319 2 CA-C-N 106.525 -4.852 . . . . 0.0 110.849 179.882 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.605 HG13 ' SG ' ' A' ' 96' ' ' CYS . 38.7 t -131.48 143.95 38.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 124.766 1.226 . . . . 0.0 110.731 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.547 ' HA ' HG23 ' A' ' 67' ' ' VAL . 0.7 OUTLIER -164.93 174.06 10.95 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.085 -1.871 . . . . 0.0 111.853 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.697 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 68.9 m95 -98.35 150.0 22.05 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 114.625 -2.607 . . . . 0.0 110.317 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.63 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.6 OUTLIER -96.43 -8.28 32.73 Favored 'General case' 0 C--O 1.206 -1.231 1 CA-C-O 131.808 5.575 . . . . 0.0 112.911 179.665 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.32 -18.15 8.89 Favored Glycine 0 C--O 1.211 -1.283 2 CA-C-N 107.7 -4.318 . . . . 0.0 102.846 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.426 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.3 OUTLIER -171.27 75.39 0.06 Allowed 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 128.919 2.888 . . . . 0.0 110.731 -179.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 90' ' ' GLU . 6.4 t 132.92 154.88 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.716 3.206 . . . . 0.0 118.365 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.602 HD22 ' CE2' ' A' ' 50' ' ' PHE . 1.1 tp -81.65 105.6 12.92 Favored 'General case' 0 CA--C 1.493 -1.23 0 O-C-N 127.315 2.885 . . . . 0.0 114.868 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.63 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.296 88.8 t -107.43 110.62 32.5 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 111.589 -2.55 . . . . 0.0 111.771 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.605 ' SG ' HG13 ' A' ' 87' ' ' VAL . 33.0 m -130.41 144.34 51.33 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.74 118.18 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.069 0 CA-C-N 112.333 -2.212 . . . . 0.0 116.765 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.464 ' CG ' ' HB2' ' A' ' 105' ' ' ARG . 1.4 mt-30 -84.78 93.1 8.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 125.651 2.643 . . . . 0.0 109.009 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -86.33 123.11 31.21 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-N 107.485 -4.416 . . . . 0.0 109.016 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -131.83 -85.6 0.32 Allowed Glycine 0 C--O 1.202 -1.885 0 CA-C-O 126.415 3.23 . . . . 0.0 108.271 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.438 ' HG2' ' N ' ' A' ' 102' ' ' LYS . 43.7 tt0 -149.97 -78.42 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 1 CA-C-N 107.752 -4.224 . . . . 0.0 112.951 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.5 ' HD2' ' HG3' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -94.71 -9.22 35.44 Favored 'General case' 0 C--O 1.206 -1.224 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.5 ' HG3' ' HD2' ' A' ' 102' ' ' LYS . 4.5 mt-10 -97.51 152.99 18.44 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 117.282 2.327 . . . . 0.0 117.282 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -140.64 83.35 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 2 O-C-N 132.437 6.085 . . . . 0.0 101.906 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.464 ' HB2' ' CG ' ' A' ' 98' ' ' GLN . 16.7 mmm-85 -88.69 12.33 15.13 Favored 'General case' 0 C--O 1.22 -0.492 0 O-C-N 126.947 2.655 . . . . 0.0 115.284 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.53 109.37 1.74 Allowed Glycine 0 CA--C 1.541 1.702 1 O-C-N 130.533 4.895 . . . . 0.0 116.38 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.54 ' CH2' ' HB2' ' A' ' 96' ' ' CYS . 6.9 p90 -95.65 3.44 53.98 Favored 'General case' 0 N--CA 1.427 -1.623 2 O-C-N 134.858 6.858 . . . . 0.0 114.285 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -20.9 141.21 0.0 OUTLIER 'General case' 0 C--N 1.363 1.154 1 O-C-N 130.483 4.865 . . . . 0.0 115.886 -178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -107.46 167.96 9.57 Favored 'General case' 0 C--N 1.365 1.256 0 CA-C-N 111.566 -2.561 . . . . 0.0 110.531 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -173.94 61.9 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.02 1 O-C-N 130.736 5.022 . . . . 0.0 116.889 179.04 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.403 HG23 ' H ' ' A' ' 111' ' ' VAL . 99.9 t -22.53 94.1 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.634 0 O-C-N 126.672 2.483 . . . . 0.0 114.335 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.459 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 4.5 mt-10 -90.19 16.25 8.88 Favored 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 124.71 2.195 . . . . 0.0 115.341 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.74 122.6 4.02 Favored Glycine 0 C--O 1.197 -2.175 0 CA-C-N 113.908 -1.496 . . . . 0.0 114.378 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 63.23 6.09 2.23 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 119.216 3.043 . . . . 0.0 119.216 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.457 ' HE2' ' CE1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -167.97 -153.95 0.14 Allowed 'General case' 0 CA--C 1.496 -1.106 1 O-C-N 129.539 4.274 . . . . 0.0 110.977 179.931 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.535 HD22 ' HE3' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -162.78 110.48 1.28 Allowed 'General case' 0 CA--C 1.478 -1.805 0 C-N-CA 113.556 -3.258 . . . . 0.0 112.886 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.459 ' CD1' ' HB2' ' A' ' 112' ' ' GLU . 83.0 m-85 -66.48 80.52 0.1 Allowed 'General case' 0 C--N 1.351 0.66 1 CA-C-N 108.023 -4.171 . . . . 0.0 117.227 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 116' ' ' LEU . 1.3 tt -67.04 105.58 1.7 Allowed 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 111.716 -2.493 . . . . 0.0 104.82 178.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -109.92 115.72 30.32 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 116.416 -1.754 . . . . 0.0 109.15 -178.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -121.89 138.77 54.27 Favored 'General case' 0 CA--C 1.504 -0.816 1 O-C-N 130.386 4.804 . . . . 0.0 113.912 -179.98 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.62 ' O ' HD12 ' A' ' 120' ' ' LEU . 80.5 m -110.63 162.53 14.64 Favored 'General case' 0 C--O 1.2 -1.55 0 CA-C-N 108.642 -3.89 . . . . 0.0 105.651 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.92 54.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 127.051 3.31 . . . . 0.0 112.394 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 94.88 -43.56 2.27 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 109.813 -3.358 . . . . 0.0 114.156 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -141.28 -52.7 0.45 Allowed 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 113.412 -1.394 . . . . 0.0 110.279 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.1 mp0 -67.01 148.19 52.26 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 126.919 2.637 . . . . 0.0 107.136 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.1 m -132.7 77.05 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.212 -0.875 1 O-C-N 129.321 4.138 . . . . 0.0 111.973 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.76 142.81 58.27 Favored 'General case' 0 CA--C 1.497 -1.074 0 CA-C-N 114.59 -1.187 . . . . 0.0 112.133 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -125.47 115.14 19.78 Favored 'General case' 0 CA--C 1.506 -0.724 0 O-C-N 125.515 1.759 . . . . 0.0 115.107 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -99.46 167.42 10.63 Favored 'General case' 0 N--CA 1.487 1.379 1 O-C-N 129.118 4.012 . . . . 0.0 110.416 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.7 t -116.3 -46.14 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-N 119.595 1.089 . . . . 0.0 111.776 -178.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.422 ' C ' ' HB2' ' A' ' 115' ' ' LYS . 7.3 m-85 66.3 174.68 0.24 Allowed 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 128.955 2.902 . . . . 0.0 116.549 -179.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.538 ' HG2' ' HG3' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -157.11 118.34 3.68 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 178.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.625 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 21.2 ttpt -61.6 125.82 25.18 Favored 'General case' 0 C--O 1.207 -1.16 0 CA-C-O 116.231 -1.843 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.528 ' HG2' ' HG2' ' A' ' 133' ' ' LYS . 14.8 ptmt . . . . . 0 C--O 1.265 1.901 0 O-C-N 128.931 3.894 . . . . 0.0 118.864 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.374 0 N-CA-C 105.794 -1.928 . . . . 0.0 105.794 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.0 m -64.17 -44.29 92.5 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.535 ' HB3' ' CH2' ' A' ' 89' ' ' TRP . 5.7 mttt -129.44 -29.02 2.24 Favored 'General case' 0 C--N 1.361 1.104 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.55 120.96 32.08 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -134.8 30.49 3.4 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 113.506 -3.14 . . . . 0.0 108.742 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -12.5 115.81 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 129.024 3.952 . . . . 0.0 112.097 179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -153.38 -123.5 0.95 Allowed Glycine 0 C--O 1.203 -1.807 0 CA-C-O 117.201 -1.888 . . . . 0.0 114.885 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.491 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER 179.53 148.95 0.28 Allowed 'General case' 0 N--CA 1.475 0.806 1 O-C-N 132.616 5.539 . . . . 0.0 107.686 -179.907 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.556 ' CZ3' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -156.93 106.2 2.22 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 128.932 3.895 . . . . 0.0 116.463 -179.726 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -38.74 -39.14 0.47 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 85.53 34.64 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 113.946 -2.93 . . . . 0.0 107.099 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 20.4 -75.94 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.973 1 O-C-N 130.845 5.091 . . . . 0.0 110.552 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -149.74 160.77 43.27 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 111.649 -2.523 . . . . 0.0 110.662 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -116.47 114.02 23.64 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 110.844 -2.889 . . . . 0.0 117.051 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -47.0 83.87 Favored 'General case' 0 CA--C 1.504 -0.806 1 O-C-N 130.085 4.616 . . . . 0.0 113.269 -179.766 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -128.76 95.93 4.24 Favored 'General case' 0 C--O 1.2 -1.505 0 CA-C-N 112.362 -2.199 . . . . 0.0 114.739 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.675 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 2.2 t80 -100.31 -57.1 2.19 Favored 'General case' 0 CA--C 1.489 -1.383 0 CA-C-O 127.12 3.343 . . . . 0.0 108.395 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.475 ' N ' ' CD2' ' A' ' 17' ' ' PHE . 0.2 OUTLIER -65.05 -52.9 53.17 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 118.966 -2.333 . . . . 0.0 114.717 179.814 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.422 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -62.33 -25.14 66.36 Favored Glycine 0 N--CA 1.48 1.607 1 O-C-N 130.09 4.619 . . . . 0.0 111.63 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.538 ' OH ' HD21 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -66.98 -43.74 82.27 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-O 125.148 2.404 . . . . 0.0 108.221 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 mtp -72.05 -23.85 61.44 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-N 113.673 -1.603 . . . . 0.0 112.877 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.422 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 2.2 ttpt -76.21 -27.61 56.91 Favored 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 109.568 -3.469 . . . . 0.0 111.819 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.35 66.73 Favored 'General case' 0 C--N 1.318 -0.804 1 O-C-N 130.099 4.624 . . . . 0.0 112.089 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.79 -11.07 49.07 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 127.421 2.951 . . . . 0.0 104.372 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.3 t0 45.71 80.63 0.04 OUTLIER 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.137 3.827 . . . . 0.0 109.128 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.666 HD12 ' O ' ' A' ' 78' ' ' LEU . 14.1 tt -82.7 -15.8 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 1 CA-C-N 108.065 -4.152 . . . . 0.0 109.772 -179.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.405 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 1.3 t0 -173.38 -179.26 1.86 Allowed 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 117.523 -1.671 . . . . 0.0 112.289 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -119.25 86.5 2.56 Favored 'General case' 0 CA--C 1.49 -1.363 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 62.5 49.88 3.85 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 126.959 2.662 . . . . 0.0 109.297 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' A' ' 27' ' ' ASP . 1.7 t -88.67 -26.59 21.76 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 108.571 -3.922 . . . . 0.0 113.186 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.403 ' O ' HD13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -68.84 -138.24 0.01 OUTLIER 'General case' 0 C--O 1.242 0.697 1 O-C-N 130.127 4.642 . . . . 0.0 108.435 179.953 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 32' ' ' LYS . 0.1 OUTLIER 84.35 4.38 0.71 Allowed 'General case' 0 CA--C 1.497 -1.077 0 O-C-N 128.82 3.825 . . . . 0.0 113.291 179.422 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.403 HD13 ' O ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -137.43 -21.92 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.928 0 CA-C-N 110.111 -3.222 . . . . 0.0 114.426 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.721 ' HB1' ' CE2' ' A' ' 58' ' ' PHE . . . -90.49 11.34 22.04 Favored 'General case' 0 C--O 1.206 -1.217 0 CA-C-O 123.386 1.565 . . . . 0.0 112.365 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 4.5 t -44.73 -40.04 1.93 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.25 0 CA-C-O 123.758 1.742 . . . . 0.0 109.931 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 169.34 117.78 0.01 OUTLIER 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 109.337 -3.574 . . . . 0.0 115.399 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.864 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.4 OUTLIER -147.86 53.76 1.04 Allowed 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 110.704 -2.953 . . . . 0.0 104.972 179.53 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.1 m 68.87 139.94 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.243 1 O-C-N 135.106 7.754 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -125.78 -65.89 0.97 Allowed 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 117.296 2.332 . . . . 0.0 117.296 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.9 m 56.48 108.49 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.622 1 O-C-N 131.971 5.795 . . . . 0.0 111.628 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.7 149.05 23.23 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 127.988 3.305 . . . . 0.0 103.373 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.462 HG22 ' N ' ' A' ' 43' ' ' ILE . 5.1 mt -137.43 156.24 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 1 O-C-N 129.189 4.056 . . . . 0.0 110.29 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.5 ' HA ' ' HA ' ' A' ' 52' ' ' THR 0.32 6.6 tt -130.36 131.51 65.35 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 O-C-N 126.905 2.628 . . . . 0.0 108.257 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.271 72.4 t -137.58 125.98 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 113.412 -1.722 . . . . 0.0 110.312 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -132.67 88.66 2.55 Favored 'General case' 0 CA--C 1.489 -1.371 0 N-CA-C 118.979 2.955 . . . . 0.0 118.979 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -68.0 -54.78 15.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 C-N-CA 114.266 -2.973 . . . . 0.0 115.018 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -178.54 105.47 0.2 Allowed Glycine 0 C--O 1.205 -1.719 0 O-C-N 121.169 -0.957 . . . . 0.0 112.489 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 63.41 19.27 11.59 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 119.011 -1.075 . . . . 0.0 110.52 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -130.48 154.3 47.9 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 128.144 3.403 . . . . 0.0 108.399 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.719 ' CD1' HD13 ' A' ' 94' ' ' LEU . 51.1 t80 -155.02 99.92 2.15 Favored 'General case' 0 CA--C 1.484 -1.593 1 O-C-N 129.983 4.552 . . . . 0.0 112.932 -179.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -120.12 75.72 1.12 Allowed 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 126.508 2.38 . . . . 0.0 112.546 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 43' ' ' ILE . 0.7 OUTLIER -57.68 145.65 33.55 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 128.857 3.848 . . . . 0.0 106.04 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.479 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 4.2 ptmm? -145.26 152.57 40.17 Favored 'General case' 0 CA--C 1.487 -1.457 0 C-N-CA 115.396 -2.522 . . . . 0.0 111.397 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.499 HG23 ' HA ' ' A' ' 60' ' ' ASN . 4.1 t -106.43 155.16 19.85 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 124.934 2.302 . . . . 0.0 112.153 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -130.15 52.21 2.03 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 111.543 -2.571 . . . . 0.0 110.302 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 10.5 p -69.12 -99.69 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.078 1 O-C-N 129.332 4.145 . . . . 0.0 112.33 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.465 ' OG1' HD12 ' A' ' 37' ' ' LEU . 0.6 OUTLIER 153.81 -34.05 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.159 0 O-C-N 127.281 2.863 . . . . 0.0 104.27 -179.046 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.864 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -82.39 -60.88 2.05 Favored 'General case' 0 C--N 1.368 1.37 0 O-C-N 128.579 3.674 . . . . 0.0 112.111 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.3 98.41 3.43 Favored 'General case' 0 C--O 1.216 -0.704 2 CA-C-N 107.479 -4.418 . . . . 0.0 113.869 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.499 ' HA ' HG23 ' A' ' 54' ' ' THR . 54.3 m-20 -82.99 65.95 8.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 109.556 -3.475 . . . . 0.0 110.507 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -96.72 80.68 3.09 Favored 'General case' 0 CA--C 1.503 -0.862 0 O-C-N 127.058 2.724 . . . . 0.0 109.052 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.479 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 5.7 p-10 -79.72 132.63 36.24 Favored 'General case' 0 C--O 1.2 -1.507 1 O-C-N 129.685 4.366 . . . . 0.0 116.423 -179.605 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.52 HD23 ' CE1' ' A' ' 50' ' ' PHE . 3.2 tp -52.86 118.05 3.4 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 128.537 3.648 . . . . 0.0 109.563 177.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -135.46 84.69 2.11 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 116.766 -1.974 . . . . 0.0 111.639 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.759 ' CD1' HG21 ' A' ' 87' ' ' VAL . 6.5 p90 -171.62 145.07 1.96 Allowed 'General case' 0 N--CA 1.474 0.749 1 CA-C-O 128.939 4.209 . . . . 0.0 111.228 -179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.86 163.34 26.86 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 110.867 -2.879 . . . . 0.0 106.468 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.646 HG21 ' CD1' ' A' ' 89' ' ' TRP . 9.3 p -77.75 142.28 14.39 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.787 0 O-C-N 128.652 3.72 . . . . 0.0 112.127 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 59.17 14.58 26.11 Favored Glycine 0 N--CA 1.484 1.894 0 C-N-CA 116.217 -2.897 . . . . 0.0 117.323 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -83.63 -18.62 10.04 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.351 0 C-N-CA 118.062 -1.455 . . . . 0.0 107.819 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.492 ' HG3' HD12 ' A' ' 86' ' ' LEU . 1.4 mt-10 74.33 130.72 0.04 OUTLIER 'General case' 0 C--N 1.349 0.584 1 O-C-N 131.488 5.493 . . . . 0.0 109.536 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.685 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.5 t80 -107.74 29.12 7.52 Favored 'General case' 0 C--O 1.216 -0.709 0 O-C-N 127.647 3.092 . . . . 0.0 110.62 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -14.23 84.41 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.976 0 O-C-N 127.34 2.9 . . . . 0.0 115.585 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.421 ' HG2' ' HB3' ' A' ' 82' ' ' ASN . 3.0 mp0 59.62 173.23 0.08 Allowed 'General case' 0 C--O 1.209 -1.04 1 CA-C-O 129.128 4.299 . . . . 0.0 111.965 -179.345 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.509 ' ND1' ' N ' ' A' ' 74' ' ' HIS . 1.6 m-70 69.98 78.18 0.2 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-N 110.035 -3.257 . . . . 0.0 114.284 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 76.3 p -85.1 -82.32 0.18 Allowed 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 112.868 -1.969 . . . . 0.0 112.015 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.0 mtmt 60.96 168.98 0.09 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 126.215 2.912 . . . . 0.0 115.542 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.18 19.72 77.55 Favored Glycine 0 C--O 1.207 -1.565 0 CA-C-N 111.239 -2.709 . . . . 0.0 109.921 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.666 ' O ' HD12 ' A' ' 26' ' ' ILE . 3.1 tp -172.1 -44.39 0.02 OUTLIER 'General case' 0 CA--C 1.505 -0.756 1 O-C-N 130.74 4.435 . . . . 0.0 113.399 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.18 -70.21 0.57 Allowed 'General case' 0 CA--C 1.5 -0.948 0 CA-C-O 124.119 1.914 . . . . 0.0 113.011 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.76 87.88 1.21 Allowed Glycine 0 N--CA 1.476 1.332 0 CA-C-N 113.722 -1.581 . . . . 0.0 111.114 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.4 mmt-85 -144.44 178.96 7.57 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 127.084 2.284 . . . . 0.0 109.5 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.421 ' HB3' ' HG2' ' A' ' 73' ' ' GLU . 63.6 m-20 -120.47 75.07 1.09 Allowed 'General case' 0 CA--C 1.501 -0.934 0 O-C-N 124.901 1.376 . . . . 0.0 110.714 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.455 HG13 ' N ' ' A' ' 99' ' ' LYS . 17.5 t -113.47 139.15 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 O-C-N 128.815 3.822 . . . . 0.0 111.421 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.464 ' HE2' ' CA ' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -32.35 -69.34 0.08 Allowed 'General case' 0 CA--C 1.504 -0.794 1 O-C-N 131.864 5.727 . . . . 0.0 112.87 -179.856 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.685 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 62.4 m 62.65 68.47 0.65 Allowed 'General case' 0 C--O 1.199 -1.573 0 C-N-CA 127.432 2.293 . . . . 0.0 110.585 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.551 ' HB3' HG23 ' A' ' 97' ' ' VAL . 4.0 tt -91.3 112.82 24.89 Favored 'General case' 0 N--CA 1.429 -1.514 2 O-C-N 131.502 5.501 . . . . 0.0 116.425 -179.429 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.759 HG21 ' CD1' ' A' ' 65' ' ' PHE . 38.4 t -92.88 151.25 3.65 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 CA-C-O 122.764 1.268 . . . . 0.0 109.175 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.477 ' HA ' ' CG2' ' A' ' 67' ' ' VAL . 4.0 t -164.3 159.08 19.49 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 112.203 -2.271 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.683 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.252 18.1 m95 -86.49 149.56 24.89 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 114.083 -2.865 . . . . 0.0 105.171 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.532 ' CB ' HG22 ' A' ' 93' ' ' THR . 2.8 tm-20 -96.82 -47.06 6.01 Favored 'General case' 0 C--O 1.195 -1.786 1 CA-C-O 128.949 4.214 . . . . 0.0 111.974 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -179.76 -49.72 0.08 OUTLIER Glycine 0 C--O 1.197 -2.179 1 CA-C-N 107.669 -4.332 . . . . 0.0 103.899 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -141.54 29.03 1.78 Allowed 'General case' 0 N--CA 1.447 -0.613 1 O-C-N 133.118 5.834 . . . . 0.0 111.344 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.532 HG22 ' CB ' ' A' ' 90' ' ' GLU . 1.5 t -162.42 160.91 26.94 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.719 HD13 ' CD1' ' A' ' 50' ' ' PHE . 3.4 tt -93.51 112.48 24.38 Favored 'General case' 0 CA--C 1.487 -1.479 0 O-C-N 127.951 3.282 . . . . 0.0 114.679 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . 0.352 52.9 t -116.83 134.91 58.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 111.726 -2.488 . . . . 0.0 114.552 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 34.4 t -137.18 140.92 42.1 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.551 HG23 ' HB3' ' A' ' 86' ' ' LEU . 6.1 m -128.93 101.34 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.205 1 CA-C-O 128.635 4.064 . . . . 0.0 118.949 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.437 ' NE2' HG11 ' A' ' 83' ' ' VAL 0.302 4.0 mm100 -71.9 111.01 6.8 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-N 110.185 -3.189 . . . . 0.0 107.464 179.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.455 ' N ' HG13 ' A' ' 83' ' ' VAL . 3.3 ttmt -37.3 -46.03 0.72 Allowed 'General case' 0 C--O 1.195 -1.81 1 O-C-N 129.579 4.299 . . . . 0.0 111.014 -179.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.403 ' H ' HG13 ' A' ' 83' ' ' VAL . . . 114.89 -86.63 0.42 Allowed Glycine 0 C--O 1.203 -1.833 0 CA-C-O 125.925 2.958 . . . . 0.0 113.37 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.78 16.18 7.88 Favored 'General case' 0 CA--C 1.497 -1.095 1 CA-C-N 106.421 -4.889 . . . . 0.0 109.423 -179.633 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.402 ' HD3' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 155.53 -33.83 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 125.852 2.739 . . . . 0.0 113.516 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.402 ' N ' ' HD3' ' A' ' 102' ' ' LYS . 2.7 mt-10 -104.99 178.73 4.48 Favored 'General case' 0 C--O 1.207 -1.137 0 CA-C-N 110.037 -3.256 . . . . 0.0 117.301 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . 0.251 7.7 m-20 -144.94 79.9 1.61 Allowed 'General case' 0 N--CA 1.489 1.49 2 CA-C-N 106.535 -4.848 . . . . 0.0 101.732 179.447 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.402 ' C ' ' HG3' ' A' ' 98' ' ' GLN . 2.5 tpt180 -101.21 -3.3 29.3 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 126.376 2.989 . . . . 0.0 114.172 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -52.15 103.53 0.12 Allowed Glycine 0 N--CA 1.426 -1.968 1 CA-C-N 107.271 -4.513 . . . . 0.0 118.724 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.45 ' C ' ' HD2' ' A' ' 108' ' ' LYS . 0.1 OUTLIER -97.16 146.46 25.04 Favored 'General case' 0 C--O 1.214 -0.778 0 O-C-N 129.299 3.588 . . . . 0.0 110.283 178.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.604 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -163.08 177.19 9.35 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 128.747 3.779 . . . . 0.0 113.097 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.916 ' HG2' HD13 ' A' ' 116' ' ' LEU . 1.1 mp0 -143.12 173.37 11.63 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 116.26 -2.176 . . . . 0.0 108.324 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.604 ' CH2' ' HG3' ' A' ' 108' ' ' LYS 0.29 0.0 OUTLIER -159.23 24.77 0.2 Allowed 'General case' 0 CA--C 1.501 -0.912 1 O-C-N 129.623 4.327 . . . . 0.0 117.542 179.551 . . . . . . . . 5 4 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 32.0 t 23.68 78.62 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.613 0 CA-C-O 127.973 3.749 . . . . 0.0 117.432 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -90.13 57.73 3.86 Favored 'General case' 0 CA--C 1.484 -1.562 0 O-C-N 118.753 -2.467 . . . . 0.0 112.441 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.09 -126.23 7.37 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 111.685 -2.507 . . . . 0.0 111.424 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -106.69 39.49 1.83 Allowed 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 113.875 -1.162 . . . . 0.0 113.139 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.9 pttt -170.48 142.3 2.08 Favored 'General case' 0 C--N 1.316 -0.867 1 O-C-N 130.104 4.627 . . . . 0.0 105.836 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.916 HD13 ' HG2' ' A' ' 109' ' ' GLN . 3.7 pp -115.49 133.89 55.6 Favored 'General case' 0 C--O 1.194 -1.855 0 O-C-N 128.093 3.371 . . . . 0.0 111.202 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.428 ' O ' ' N ' ' A' ' 119' ' ' GLU . 2.9 m-85 -77.7 92.81 4.18 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 109.441 -3.527 . . . . 0.0 114.364 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -74.73 76.88 2.07 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 109.096 -3.684 . . . . 0.0 106.197 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 117' ' ' TYR . 40.8 mt-10 -85.29 101.86 12.89 Favored 'General case' 0 CA--C 1.485 -1.539 0 O-C-N 129.094 3.996 . . . . 0.0 110.682 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.44 154.67 33.35 Favored 'General case' 0 CA--C 1.487 -1.472 1 O-C-N 129.311 4.132 . . . . 0.0 111.686 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.0 m -111.89 160.01 17.81 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 110.458 -3.065 . . . . 0.0 105.738 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 3.3 m -151.85 33.85 0.54 Allowed 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 119.541 1.064 . . . . 0.0 111.647 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.71 -41.26 2.25 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 22.6 t70 172.12 91.45 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.295 0 C-N-CA 125.941 1.697 . . . . 0.0 108.609 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -167.78 -53.47 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 111.067 -2.788 . . . . 0.0 105.435 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.424 HG12 ' O ' ' A' ' 126' ' ' VAL . 4.1 t 58.26 54.22 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.686 1 O-C-N 130.14 4.65 . . . . 0.0 113.716 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 49.6 t -42.11 124.69 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 124.663 1.227 . . . . 0.0 110.193 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.48 92.89 4.31 Favored 'General case' 0 CA--C 1.486 -1.506 0 CA-C-N 113.732 -1.576 . . . . 0.0 114.043 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -74.17 157.21 36.35 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 114.919 -2.712 . . . . 0.0 113.658 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 130' ' ' VAL . 52.0 t -142.51 86.97 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.216 0 CA-C-O 125.066 2.365 . . . . 0.0 108.068 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.532 ' CE2' ' HB2' ' A' ' 9' ' ' TRP 0.266 6.2 m-85 -72.2 -179.33 2.8 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 109.583 -3.462 . . . . 0.0 116.335 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.67 120.95 0.93 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 109.118 -3.673 . . . . 0.0 103.607 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.556 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 3.2 ttpm? -70.72 90.37 0.77 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 112.111 -2.313 . . . . 0.0 115.048 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.405 ' HD3' HG22 ' A' ' 8' ' ' THR . 3.9 ttpt . . . . . 0 CA--C 1.482 -1.664 0 CA-C-O 114.149 -2.834 . . . . 0.0 118.186 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 mtt . . . . . 0 N--CA 1.51 2.57 0 CA-C-O 123.112 1.434 . . . . 0.0 108.492 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.9 -164.68 1.99 Allowed 'General case' 0 C--O 1.206 -1.215 0 CA-C-N 112.919 -1.946 . . . . 0.0 108.353 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.409 ' CD ' ' H ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -82.4 43.81 0.84 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 115.834 -2.346 . . . . 0.0 116.196 -179.804 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -106.82 97.94 7.66 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -92.76 -124.42 0.09 Allowed 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 115.354 -2.26 . . . . 0.0 107.261 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 71.52 100.02 0.07 Allowed 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 130.329 3.452 . . . . 0.0 112.542 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.27 -130.44 1.18 Allowed Glycine 0 CA--C 1.534 1.242 0 CA-C-O 114.789 -3.228 . . . . 0.0 113.759 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.534 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.3 OUTLIER -169.6 147.35 3.5 Favored 'General case' 0 C--O 1.214 -0.811 1 O-C-N 133.59 6.112 . . . . 0.0 104.519 -179.892 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.534 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -148.24 109.42 4.32 Favored 'General case' 0 CA--C 1.494 -1.176 1 O-C-N 130.941 5.151 . . . . 0.0 114.78 -179.894 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -78.41 119.99 22.51 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 127.4 2.937 . . . . 0.0 111.576 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.531 ' HB3' ' HG2' ' A' ' 39' ' ' GLN . 3.4 ttp -57.54 96.05 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.867 0 O-C-N 126.243 2.215 . . . . 0.0 106.53 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -62.59 -14.23 40.3 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 130.207 3.403 . . . . 0.0 111.688 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.415 ' HB3' HG23 ' A' ' 130' ' ' VAL . 0.2 OUTLIER -173.8 158.29 3.22 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 113.609 -1.632 . . . . 0.0 113.262 -179.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.422 ' HB3' ' CE ' ' A' ' 11' ' ' MET . 14.1 p-10 -133.86 129.47 36.48 Favored 'General case' 0 CA--C 1.493 -1.228 0 O-C-N 127.947 3.28 . . . . 0.0 111.337 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -101.25 -71.31 0.71 Allowed 'General case' 0 CA--C 1.477 -1.833 1 O-C-N 129.779 4.425 . . . . 0.0 115.247 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -82.98 -71.07 0.51 Allowed 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 118.845 -2.409 . . . . 0.0 115.697 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 71.73 -72.58 0.11 Allowed 'General case' 0 C--O 1.198 -1.609 0 O-C-N 126.546 2.403 . . . . 0.0 112.156 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.49 ' CB ' ' HB3' ' A' ' 31' ' ' ARG . 0.1 OUTLIER -76.49 -30.44 57.25 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.123 -1.418 . . . . 0.0 113.987 -179.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.47 -22.97 77.89 Favored Glycine 0 N--CA 1.484 1.843 1 O-C-N 130.345 4.778 . . . . 0.0 108.404 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.58 -46.65 53.3 Favored 'General case' 0 C--O 1.194 -1.837 0 CA-C-O 126.006 2.813 . . . . 0.0 108.933 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.7 mtt -59.93 -29.5 68.43 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 110.451 -3.068 . . . . 0.0 112.928 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -79.72 -23.93 42.01 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 127.757 3.16 . . . . 0.0 112.008 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.37 -29.09 64.55 Favored 'General case' 0 C--O 1.205 -1.243 1 O-C-N 132.211 5.944 . . . . 0.0 114.419 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.484 HD11 ' O ' ' A' ' 78' ' ' LEU . 0.9 OUTLIER -111.06 20.06 17.82 Favored 'General case' 0 CA--C 1.539 0.538 1 O-C-N 129.807 4.442 . . . . 0.0 108.529 179.975 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 20.45 86.75 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.571 1 O-C-N 130.053 4.596 . . . . 0.0 110.279 179.675 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.419 ' CG2' ' N ' ' A' ' 27' ' ' ASP . 6.4 tp -98.77 -39.78 8.41 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 CA-C-O 127.045 3.307 . . . . 0.0 112.017 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.419 ' N ' ' CG2' ' A' ' 26' ' ' ILE . 0.3 OUTLIER -171.61 -158.61 0.13 Allowed 'General case' 0 C--N 1.359 0.994 0 O-C-N 119.241 -2.162 . . . . 0.0 109.183 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -143.84 49.14 1.39 Allowed 'General case' 0 C--O 1.207 -1.152 0 O-C-N 121.441 -0.787 . . . . 0.0 112.335 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 152.19 78.98 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.792 0 O-C-N 127.942 3.277 . . . . 0.0 107.699 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.5 m -139.17 22.42 2.59 Favored 'General case' 0 CA--C 1.504 -0.798 2 CA-C-N 106.282 -4.963 . . . . 0.0 113.357 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.49 ' HB3' ' CB ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.44 24.05 10.89 Favored 'General case' 0 CA--C 1.509 -0.603 0 O-C-N 128.186 3.429 . . . . 0.0 113.945 179.744 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.501 ' O ' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -114.45 15.19 17.93 Favored 'General case' 0 CA--C 1.488 -1.441 0 O-C-N 127.284 2.865 . . . . 0.0 112.464 -179.44 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.506 ' N ' HD12 ' A' ' 33' ' ' ILE . 0.4 OUTLIER -170.04 74.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.362 1.132 1 CA-C-N 107.931 -4.213 . . . . 0.0 109.493 -179.791 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 33' ' ' ILE . . . 172.32 -38.25 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.182 0 O-C-N 120.367 -1.458 . . . . 0.0 109.079 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 51.1 t -17.95 -47.85 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.003 0 O-C-N 128.935 3.897 . . . . 0.0 112.717 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.654 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 159.42 114.68 0.0 OUTLIER 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 108.955 -3.748 . . . . 0.0 113.333 179.515 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.944 HD11 ' HB3' ' A' ' 58' ' ' PHE . 0.1 OUTLIER -145.53 85.94 1.73 Allowed 'General case' 0 C--O 1.212 -0.905 1 CA-C-N 108.249 -4.069 . . . . 0.0 107.138 179.722 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.5 m 72.91 47.35 0.21 Allowed 'General case' 0 N--CA 1.485 1.318 1 O-C-N 133.973 7.046 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 11' ' ' MET . 4.0 tt0 -79.52 135.36 36.61 Favored 'General case' 0 CA--C 1.492 -1.257 0 C-N-CA 118.393 -1.323 . . . . 0.0 113.277 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.4 m -152.52 120.47 6.17 Favored 'General case' 0 C--O 1.212 -0.905 0 C-N-CA 130.26 3.424 . . . . 0.0 111.5 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.782 ' HE2' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -103.62 152.97 21.13 Favored 'General case' 0 N--CA 1.48 1.048 1 O-C-N 129.169 4.043 . . . . 0.0 103.486 179.853 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.502 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.2 mp -140.0 156.64 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 O-C-N 126.886 2.616 . . . . 0.0 109.71 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.502 ' N ' HG22 ' A' ' 42' ' ' ILE 0.295 1.4 tt -127.38 138.08 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.495 0 O-C-N 128.217 3.448 . . . . 0.0 109.45 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.8 t -137.14 87.69 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.274 0 CA-C-N 112.038 -2.346 . . . . 0.0 109.704 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -99.61 102.99 14.66 Favored 'General case' 0 C--O 1.21 -0.982 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.86 -14.27 23.32 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 128.012 3.32 . . . . 0.0 112.477 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 144.69 -96.23 0.18 Allowed Glycine 0 C--O 1.203 -1.795 0 CA-C-O 122.955 1.308 . . . . 0.0 111.208 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.628 ' O ' HG23 ' A' ' 66' ' ' THR . 96.1 m-20 -86.36 -13.6 45.98 Favored 'General case' 0 C--O 1.21 -1.002 0 CA-C-N 110.872 -2.664 . . . . 0.0 110.661 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.47 HD22 ' N ' ' A' ' 49' ' ' ASN . 2.4 m-80 -109.69 93.34 4.45 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 128.438 3.586 . . . . 0.0 109.57 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.877 ' CD2' HD13 ' A' ' 94' ' ' LEU . 91.3 t80 -108.15 101.04 10.3 Favored 'General case' 0 CA--C 1.501 -0.926 1 O-C-N 129.66 4.35 . . . . 0.0 115.446 -179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 30.4 mttt -112.35 85.98 2.26 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 119.022 2.971 . . . . 0.0 119.022 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.428 ' O ' HG22 ' A' ' 52' ' ' THR . 0.9 OUTLIER -65.25 120.47 12.8 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 128.255 3.472 . . . . 0.0 106.222 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -125.43 150.82 46.94 Favored 'General case' 0 CA--C 1.493 -1.232 0 O-C-N 126.513 2.383 . . . . 0.0 112.31 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -98.14 175.3 6.14 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 125.407 1.692 . . . . 0.0 110.457 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.486 ' HB2' HD11 ' A' ' 42' ' ' ILE . 2.4 t-20 -148.65 35.75 0.78 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.827 -1.988 . . . . 0.0 115.483 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.542 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 9.6 p -73.04 167.86 20.25 Favored 'General case' 0 C--N 1.323 -0.549 1 O-C-N 130.66 4.975 . . . . 0.0 111.927 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 57' ' ' THR . 10.3 m -101.56 -1.84 31.98 Favored 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 128.738 3.774 . . . . 0.0 110.746 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.944 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -108.93 -58.95 1.95 Allowed 'General case' 0 C--O 1.218 -0.597 0 O-C-N 123.962 0.789 . . . . 0.0 110.864 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.7 mtt85 -137.8 122.59 18.78 Favored 'General case' 0 C--N 1.357 0.899 1 O-C-N 130.183 4.677 . . . . 0.0 116.186 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.4 99.38 5.81 Favored 'General case' 0 N--CA 1.439 -0.988 1 O-C-N 129.168 4.042 . . . . 0.0 111.209 -179.894 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.58 -67.78 0.92 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 110.177 -3.192 . . . . 0.0 107.653 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.441 ' HB2' ' CB ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER 98.02 176.81 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.364 5.415 . . . . 0.0 110.692 179.963 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 65' ' ' PHE . 8.6 tp -113.92 49.91 0.96 Allowed 'General case' 0 N--CA 1.436 -1.155 0 O-C-N 127.183 2.802 . . . . 0.0 112.643 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.509 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 14.9 t70 -59.59 89.37 0.01 OUTLIER 'General case' 0 C--O 1.211 -0.958 0 O-C-N 128.742 3.776 . . . . 0.0 105.923 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.548 ' CD2' HG11 ' A' ' 87' ' ' VAL . 0.8 OUTLIER -125.81 -174.1 3.0 Favored 'General case' 0 CA--C 1.495 -1.165 1 CA-C-O 128.994 4.235 . . . . 0.0 110.141 -179.763 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.628 HG23 ' O ' ' A' ' 48' ' ' ASP . 1.0 OUTLIER -167.12 122.15 1.07 Allowed 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 109.856 -3.338 . . . . 0.0 106.374 179.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.851 HG13 ' HA ' ' A' ' 88' ' ' THR . 3.7 t -36.92 119.9 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.202 -1.412 1 O-C-N 129.638 4.336 . . . . 0.0 115.769 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 76.32 23.8 70.03 Favored Glycine 0 N--CA 1.487 2.05 0 C-N-CA 115.544 -3.217 . . . . 0.0 115.3 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.575 HG23 ' HB ' ' A' ' 66' ' ' THR . 1.2 t -69.09 -32.39 53.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.508 0 CA-C-N 112.162 -2.019 . . . . 0.0 109.939 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 57.03 73.99 0.43 Allowed 'General case' 0 C--N 1.356 0.867 1 O-C-N 130.555 4.909 . . . . 0.0 108.697 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -84.29 122.97 29.65 Favored 'General case' 0 CA--C 1.498 -1.042 1 O-C-N 129.352 4.157 . . . . 0.0 119.225 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -91.49 54.71 2.58 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 117.269 -1.348 . . . . 0.0 109.091 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HG2' HG23 ' A' ' 75' ' ' THR . 5.5 tt0 -21.94 109.01 0.02 OUTLIER 'General case' 0 CA--C 1.483 -1.617 0 CA-C-O 126.051 2.834 . . . . 0.0 113.257 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.82 54.73 0.86 Allowed 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 110.3 -3.137 . . . . 0.0 112.044 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.475 HG23 ' HG2' ' A' ' 73' ' ' GLU . 0.8 OUTLIER -53.16 169.95 0.1 Allowed 'General case' 0 C--O 1.201 -1.471 0 CA-C-N 110.809 -2.905 . . . . 0.0 112.316 -179.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.441 ' HA ' ' CA ' ' A' ' 80' ' ' GLY . 0.1 OUTLIER 158.89 -32.19 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.807 1 O-C-N 130.036 4.585 . . . . 0.0 115.807 -179.917 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.59 -21.49 57.89 Favored Glycine 0 C--O 1.218 -0.868 0 CA-C-N 108.441 -3.981 . . . . 0.0 112.843 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.484 ' O ' HD11 ' A' ' 24' ' ' LEU 0.311 5.6 tp -171.32 36.47 0.02 OUTLIER 'General case' 0 CA--C 1.503 -0.849 1 O-C-N 132.977 5.751 . . . . 0.0 113.477 -179.844 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.475 ' HB3' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -170.65 -58.47 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.66 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.441 ' CA ' ' HA ' ' A' ' 76' ' ' LYS . . . 67.36 58.33 8.06 Favored Glycine 0 C--O 1.204 -1.734 0 C-N-CA 125.976 1.75 . . . . 0.0 111.463 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.28 -170.24 1.6 Allowed 'General case' 0 CA--C 1.505 -0.777 0 O-C-N 129.707 3.828 . . . . 0.0 115.255 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -163.43 81.62 0.46 Allowed 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 113.445 -1.707 . . . . 0.0 109.411 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.519 HG11 ' HG2' ' A' ' 98' ' ' GLN . 3.6 t -125.02 155.37 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 0 O-C-N 127.528 3.017 . . . . 0.0 117.511 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -87.25 86.08 7.24 Favored 'General case' 0 CA--C 1.492 -1.267 0 CA-C-N 109.686 -3.416 . . . . 0.0 111.22 -179.79 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.4 m -90.52 85.64 6.19 Favored 'General case' 0 C--O 1.206 -1.201 0 O-C-N 127.202 2.814 . . . . 0.0 111.2 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.7 tt -79.85 146.97 31.93 Favored 'General case' 0 CA--C 1.511 -0.534 2 CA-C-N 106.521 -4.854 . . . . 0.0 112.019 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.548 HG11 ' CD2' ' A' ' 65' ' ' PHE . 1.4 p -134.9 143.4 37.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 125.792 1.637 . . . . 0.0 112.126 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.851 ' HA ' HG13 ' A' ' 67' ' ' VAL . 5.8 t -166.98 169.48 12.95 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-O 126.75 3.166 . . . . 0.0 112.209 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.705 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 55.8 m95 -91.83 145.01 24.9 Favored 'General case' 0 CA--C 1.509 -0.628 0 O-C-N 117.579 -3.201 . . . . 0.0 105.732 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.565 ' HB3' HG22 ' A' ' 93' ' ' THR . 1.1 tm-20 -85.9 -59.54 2.27 Favored 'General case' 0 C--O 1.203 -1.374 0 CA-C-O 127.813 3.673 . . . . 0.0 111.077 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.71 59.52 0.01 OUTLIER Glycine 0 C--O 1.195 -2.33 2 N-CA-C 100.818 -4.913 . . . . 0.0 100.818 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.491 ' O ' ' HB ' ' A' ' 93' ' ' THR . 11.6 t30 99.2 93.06 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.721 2 O-C-N 131.929 5.135 . . . . 0.0 104.142 -178.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.565 HG22 ' HB3' ' A' ' 90' ' ' GLU . 1.2 t 127.04 152.47 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.389 0 C-N-CA 130.291 3.436 . . . . 0.0 118.352 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.877 HD13 ' CD2' ' A' ' 50' ' ' PHE 0.268 0.6 OUTLIER -93.64 97.69 10.64 Favored 'General case' 0 CA--C 1.486 -1.495 0 CA-C-N 110.209 -3.178 . . . . 0.0 117.585 -179.407 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.529 ' CG2' ' HB2' ' A' ' 90' ' ' GLU 0.418 42.3 t -92.65 151.1 3.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 CA-C-N 112.803 -1.999 . . . . 0.0 113.883 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.652 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 0.8 OUTLIER -165.84 157.23 13.9 Favored 'General case' 0 C--O 1.204 -1.328 0 O-C-N 126.977 2.673 . . . . 0.0 105.041 179.435 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.422 HG22 ' C ' ' A' ' 96' ' ' CYS 0.286 0.0 OUTLIER -150.93 115.33 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.741 2 O-C-N 129.746 4.404 . . . . 0.0 115.259 -179.869 . . . . . . . . 5 4 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.519 ' HG2' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -78.25 98.14 5.79 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 126.329 2.966 . . . . 0.0 109.444 -179.873 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.3 tttt -85.27 84.62 7.61 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 109.595 -3.457 . . . . 0.0 110.898 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.469 ' CA ' HG13 ' A' ' 83' ' ' VAL . . . -94.4 -155.95 31.96 Favored Glycine 0 C--O 1.2 -2.016 0 CA-C-O 125.53 2.739 . . . . 0.0 108.058 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -93.02 -47.42 7.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 110.528 -2.836 . . . . 0.0 113.066 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.458 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -111.29 -61.32 1.71 Allowed 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 117.292 2.33 . . . . 0.0 117.292 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.458 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -75.31 167.19 22.38 Favored 'General case' 0 C--O 1.202 -1.417 0 CA-C-N 111.391 -2.641 . . . . 0.0 117.385 -179.832 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.43 ' O ' ' HB ' ' A' ' 121' ' ' THR . 44.9 m-80 -121.6 86.71 2.62 Favored 'General case' 0 CA--C 1.537 0.471 1 CA-C-N 107.353 -4.476 . . . . 0.0 103.592 179.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.502 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 28.4 mmm-85 -87.8 175.03 8.02 Favored 'General case' 0 N--CA 1.48 1.066 1 O-C-N 129.672 4.357 . . . . 0.0 107.374 179.549 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.23 -167.39 33.9 Favored Glycine 0 C--O 1.207 -1.554 1 O-C-N 130.705 5.003 . . . . 0.0 115.693 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.652 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 1.6 p90 -175.52 16.44 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.76 1 O-C-N 131.977 5.163 . . . . 0.0 121.15 178.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.54 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -45.24 133.33 7.03 Favored 'General case' 0 C--O 1.208 -1.126 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 -176.83 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.401 ' O ' ' CE3' ' A' ' 110' ' ' TRP . 24.5 mm-40 -93.06 168.09 11.36 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 113.975 -2.916 . . . . 0.0 109.525 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.54 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 10.8 m95 -125.07 -38.58 2.31 Favored 'General case' 0 C--O 1.211 -0.956 1 O-C-N 130.226 4.704 . . . . 0.0 114.231 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.5 t 67.3 51.99 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.81 1 CA-C-O 129.721 4.581 . . . . 0.0 109.048 -175.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -98.97 122.72 42.59 Favored 'General case' 0 CA--C 1.475 -1.916 1 CA-C-N 107.043 -4.617 . . . . 0.0 119.009 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 35.35 74.2 0.09 OUTLIER Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 118.147 2.019 . . . . 0.0 118.147 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 73.57 -30.85 0.21 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 129.398 3.079 . . . . 0.0 119.257 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.462 ' HG3' ' CE1' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -106.12 174.65 5.79 Favored 'General case' 0 CA--C 1.498 -1.034 1 O-C-N 130.272 4.733 . . . . 0.0 109.756 -179.784 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.782 HD22 ' HE2' ' A' ' 41' ' ' LYS . 4.4 tt -121.04 94.97 4.51 Favored 'General case' 0 C--O 1.197 -1.708 1 O-C-N 129.951 4.532 . . . . 0.0 112.269 179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.462 ' CE1' ' HG3' ' A' ' 115' ' ' LYS . 5.9 m-30 -66.39 131.26 45.68 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 109.938 -3.301 . . . . 0.0 111.123 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.592 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -109.21 102.98 11.88 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 111.171 -2.74 . . . . 0.0 107.947 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -107.44 139.08 42.49 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.705 HD12 ' O ' ' A' ' 121' ' ' THR . 0.1 OUTLIER -137.29 149.91 47.42 Favored 'General case' 0 CA--C 1.485 -1.546 1 O-C-N 129.941 4.525 . . . . 0.0 108.487 -179.568 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.705 ' O ' HD12 ' A' ' 120' ' ' LEU . 4.0 m -111.23 156.48 21.4 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.21 -2.144 . . . . 0.0 105.21 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -162.24 88.66 0.67 Allowed 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 119.13 -1.028 . . . . 0.0 110.959 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 46.24 39.93 10.05 Favored Glycine 0 CA--C 1.508 -0.399 0 CA-C-O 122.725 1.18 . . . . 0.0 114.776 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 t70 71.21 92.31 0.09 Allowed 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 126.275 1.83 . . . . 0.0 110.432 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.22 -53.1 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.374 1 O-C-N 130.275 4.734 . . . . 0.0 105.467 179.813 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.623 HG22 HG23 ' A' ' 121' ' ' THR . 15.8 t 61.78 78.02 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 CA-C-N 108.834 -3.803 . . . . 0.0 117.953 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.429 ' HB3' HD23 ' A' ' 120' ' ' LEU . 4.5 t -58.89 125.99 25.82 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 113.436 -1.711 . . . . 0.0 108.671 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -110.72 100.41 9.18 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 125.606 1.816 . . . . 0.0 110.615 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -93.6 163.93 13.36 Favored 'General case' 0 CA--C 1.489 -1.398 0 O-C-N 124.691 1.244 . . . . 0.0 112.258 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.415 HG23 ' HB3' ' A' ' 13' ' ' SER . 0.7 OUTLIER -136.46 137.34 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-O 126.288 2.947 . . . . 0.0 106.996 -179.882 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.592 ' CE1' ' HB2' ' A' ' 118' ' ' LEU 0.273 64.1 m-85 -124.56 177.41 5.95 Favored 'General case' 0 CA--C 1.497 -1.09 1 CA-C-N 108.055 -4.157 . . . . 0.0 116.612 179.855 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.77 139.31 19.61 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 110.622 -2.99 . . . . 0.0 103.774 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.506 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 4.9 ttmm -79.17 119.62 22.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-O 116.654 -1.641 . . . . 0.0 111.939 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.404 ' HB3' HG22 ' A' ' 8' ' ' THR . 13.7 ptpt . . . . . 0 CA--C 1.49 -1.348 0 O-C-N 128.885 3.865 . . . . 0.0 118.863 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.505 2.311 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.96 157.93 39.89 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 119.482 -0.887 . . . . 0.0 108.845 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.415 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 1.2 ptmm? 27.86 37.48 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.176 0 O-C-N 128.327 3.517 . . . . 0.0 117.988 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -148.63 71.98 1.17 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -133.2 160.28 37.71 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 104.832 -2.284 . . . . 0.0 104.832 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -147.25 165.66 29.41 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.632 3.708 . . . . 0.0 112.614 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.3 -149.53 9.89 Favored Glycine 0 C--O 1.203 -1.802 0 CA-C-O 116.619 -2.212 . . . . 0.0 112.693 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.7 t -163.65 41.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 129.236 3.551 . . . . 0.0 105.155 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.731 ' CZ2' HD23 ' A' ' 116' ' ' LEU 0.307 0.1 OUTLIER -36.69 103.43 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.816 1 O-C-N 131.45 5.469 . . . . 0.0 112.179 -179.208 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.41 -51.17 60.49 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 126.689 2.493 . . . . 0.0 114.884 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.2 ttt 93.41 86.85 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.669 1 O-C-N 129.904 4.503 . . . . 0.0 103.591 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -43.9 -47.54 8.37 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 129.059 3.974 . . . . 0.0 110.802 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -158.33 -179.77 8.41 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 111.214 -2.721 . . . . 0.0 112.111 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -156.22 151.8 27.01 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 17' ' ' PHE . 3.1 mm-40 -93.82 -164.07 1.13 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 108.628 -3.896 . . . . 0.0 110.769 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.412 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 11.3 p30 -30.21 83.69 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 C-N-CA 127.401 2.28 . . . . 0.0 111.85 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.4 ' N ' ' O ' ' A' ' 15' ' ' GLU . 13.3 t80 -69.7 -31.12 68.96 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 128.342 3.925 . . . . 0.0 107.898 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.533 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -73.69 -49.17 27.11 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 110.649 -2.978 . . . . 0.0 111.48 179.659 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.433 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -53.57 -22.44 16.98 Favored Glycine 0 CA--C 1.487 -1.7 1 O-C-N 130.425 4.828 . . . . 0.0 113.506 179.784 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.54 ' OH ' HD21 ' A' ' 78' ' ' LEU . 6.5 t80 -79.72 -38.02 34.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.576 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -77.25 -20.59 54.94 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 113.046 -1.888 . . . . 0.0 112.055 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.433 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 2.3 ttmt -73.48 -39.99 64.47 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 110.468 -3.06 . . . . 0.0 111.659 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.53 -40.18 85.05 Favored 'General case' 0 C--O 1.211 -0.933 1 O-C-N 130.429 4.831 . . . . 0.0 111.383 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.673 HD13 HD13 ' A' ' 26' ' ' ILE 0.322 15.1 mt -70.53 -29.74 66.3 Favored 'General case' 0 C--O 1.208 -1.107 2 O-C-N 130.002 4.564 . . . . 0.0 104.861 -179.885 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t0 56.55 43.97 24.83 Favored 'General case' 0 C--O 1.202 -1.425 3 O-C-N 131.696 5.622 . . . . 0.0 103.806 -177.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.673 HD13 HD13 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -70.9 -9.91 13.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 1 CA-C-N 105.665 -5.243 . . . . 0.0 112.592 -178.403 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 50.2 -157.45 0.09 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 109.015 -3.721 . . . . 0.0 114.133 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 1.9 m-30 79.98 -20.38 0.39 Allowed 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 127.956 3.285 . . . . 0.0 115.741 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.49 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . . . 58.25 60.62 2.58 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 103.721 -2.696 . . . . 0.0 103.721 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 30' ' ' THR . 34.2 m -127.87 42.76 3.26 Favored 'General case' 0 N--CA 1.475 0.786 2 CA-C-N 105.369 -5.378 . . . . 0.0 115.294 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.533 ' HB2' ' HA ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -119.06 -34.69 3.81 Favored 'General case' 0 CA--C 1.499 -1.017 1 O-C-N 129.457 4.223 . . . . 0.0 113.536 -179.629 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.472 ' N ' ' HG2' ' A' ' 31' ' ' ARG 0.258 19.7 tttm -99.11 55.6 1.01 Allowed 'General case' 0 C--N 1.309 -1.158 0 O-C-N 125.762 1.914 . . . . 0.0 107.7 179.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.73 -49.77 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.293 2 O-C-N 132.67 6.231 . . . . 0.0 109.732 -179.703 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.554 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -89.57 11.71 18.81 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-N 114.16 -1.382 . . . . 0.0 111.511 179.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.2 t -37.15 -46.22 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.206 -1.212 0 O-C-N 125.897 1.998 . . . . 0.0 111.167 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.585 ' HD2' ' HB3' ' A' ' 39' ' ' GLN . 0.8 OUTLIER 169.13 100.6 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.63 1 O-C-N 130.103 4.627 . . . . 0.0 115.351 -179.991 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.711 HD23 ' CD2' ' A' ' 58' ' ' PHE . 1.4 pp -96.71 -8.72 30.69 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 128.329 3.518 . . . . 0.0 107.314 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.648 ' N ' HD12 ' A' ' 37' ' ' LEU . 1.8 m 143.94 112.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.128 1 O-C-N 133.109 6.506 . . . . 0.0 110.282 -179.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.585 ' HB3' ' HD2' ' A' ' 36' ' ' ARG . 61.8 tt0 -127.47 148.2 50.3 Favored 'General case' 0 C--N 1.315 -0.924 0 O-C-N 127.619 3.074 . . . . 0.0 115.301 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.417 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 41.7 m -144.46 119.37 9.95 Favored 'General case' 0 C--N 1.318 -0.769 1 O-C-N 131.469 5.481 . . . . 0.0 111.147 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -103.7 107.91 18.97 Favored 'General case' 0 C--N 1.351 0.631 0 O-C-N 127.471 2.982 . . . . 0.0 103.761 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.534 HD11 ' HB2' ' A' ' 55' ' ' ASN . 3.9 mp -98.02 158.26 3.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 O-C-N 127.252 2.845 . . . . 0.0 110.699 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.519 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -134.77 144.83 33.65 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.527 0 CA-C-N 110.188 -3.187 . . . . 0.0 109.005 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.441 HG21 ' NZ ' ' A' ' 53' ' ' LYS . 56.9 t -149.1 78.85 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.33 0 CA-C-N 111.82 -2.446 . . . . 0.0 111.951 -179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' A' ' 3' ' ' LYS . 0.8 OUTLIER -77.75 150.48 34.39 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -166.64 91.18 0.42 Allowed 'General case' 0 CA--C 1.498 -1.036 1 O-C-N 129.42 4.2 . . . . 0.0 111.747 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 54.55 -89.48 0.01 OUTLIER Glycine 0 C--N 1.345 1.066 0 CA-C-O 119.833 -0.426 . . . . 0.0 112.523 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -99.55 -39.71 8.19 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 126.796 2.115 . . . . 0.0 116.458 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -85.84 112.98 21.62 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 126.086 2.116 . . . . 0.0 111.975 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.495 ' CE2' HD22 ' A' ' 94' ' ' LEU . 76.8 t80 -112.8 97.98 6.91 Favored 'General case' 0 C--N 1.316 -0.89 1 O-C-N 129.707 4.379 . . . . 0.0 112.315 -179.915 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -117.21 89.36 3.1 Favored 'General case' 0 CA--C 1.491 -1.318 0 N-CA-C 119.282 3.068 . . . . 0.0 119.282 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.537 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -76.86 158.42 30.8 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 127.443 2.964 . . . . 0.0 106.691 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.441 ' NZ ' HG21 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -155.31 148.94 25.25 Favored 'General case' 0 CA--C 1.486 -1.482 0 O-C-N 127.654 3.096 . . . . 0.0 109.575 -179.168 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.2 t -105.4 116.87 32.67 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.652 2.781 . . . . 0.0 107.196 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.534 ' HB2' HD11 ' A' ' 42' ' ' ILE . 0.1 OUTLIER -82.31 15.75 2.32 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 117.037 2.236 . . . . 0.0 117.037 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.409 ' O ' ' ND2' ' A' ' 60' ' ' ASN . 0.5 OUTLIER -56.81 155.81 7.35 Favored 'General case' 0 C--N 1.314 -0.954 0 O-C-N 127.356 2.91 . . . . 0.0 109.248 -179.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.419 ' H ' HD11 ' A' ' 37' ' ' LEU . 7.0 p -89.77 -34.2 16.26 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 128.977 3.923 . . . . 0.0 104.01 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.711 ' CD2' HD23 ' A' ' 37' ' ' LEU . 1.3 m-85 -57.97 -65.15 0.69 Allowed 'General case' 0 C--O 1.24 0.562 0 O-C-N 126.922 2.639 . . . . 0.0 111.223 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -151.56 110.2 3.82 Favored 'General case' 0 C--N 1.362 1.151 1 CA-C-N 108.24 -4.073 . . . . 0.0 116.726 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.409 ' ND2' ' O ' ' A' ' 56' ' ' SER . 0.0 OUTLIER -111.64 87.75 2.63 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 127.316 2.885 . . . . 0.0 108.934 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.57 -56.46 4.0 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 128.708 3.755 . . . . 0.0 107.377 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 53' ' ' LYS . 0.0 OUTLIER 89.6 154.35 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.646 1 O-C-N 132.924 6.39 . . . . 0.0 115.697 -179.944 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.603 HD11 ' CZ2' ' A' ' 107' ' ' TRP . 11.6 tp -99.34 47.25 0.96 Allowed 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 111.536 -2.574 . . . . 0.0 112.376 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.83 94.75 1.44 Allowed 'General case' 0 C--O 1.206 -1.205 0 O-C-N 123.903 0.752 . . . . 0.0 109.054 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.526 ' CD2' HG21 ' A' ' 87' ' ' VAL . 0.5 OUTLIER -127.15 178.54 5.96 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-O 127.116 3.341 . . . . 0.0 108.558 -179.681 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.2 m -151.53 143.47 23.84 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 112.583 -2.099 . . . . 0.0 105.44 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.836 HG21 ' NE1' ' A' ' 89' ' ' TRP . 1.6 t -70.07 152.12 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 0 O-C-N 127.223 2.827 . . . . 0.0 114.194 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 47.37 37.49 12.07 Favored Glycine 0 N--CA 1.469 0.883 0 CA-C-N 111.238 -2.71 . . . . 0.0 114.373 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.262 9.9 p -98.16 -14.37 7.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.042 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.478 ' HA ' HD12 ' A' ' 86' ' ' LEU . 1.3 tt0 55.68 74.14 0.39 Allowed 'General case' 0 C--N 1.352 0.696 0 O-C-N 128.665 3.728 . . . . 0.0 110.884 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.579 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 6.4 t80 -64.35 70.63 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.903 1 O-C-N 129.745 4.403 . . . . 0.0 113.67 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -51.83 87.59 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.32 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.505 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 40.11 -160.72 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 O-C-N 126.934 2.646 . . . . 0.0 112.924 179.54 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 91.62 90.98 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.341 -2.209 . . . . 0.0 116.436 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.466 ' C ' ' HG2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -148.01 153.66 39.27 Favored 'General case' 0 C--O 1.201 -1.492 0 CA-C-N 111.251 -2.704 . . . . 0.0 112.0 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.466 ' HG2' ' C ' ' A' ' 75' ' ' THR . 0.0 OUTLIER 178.99 136.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.795 1 O-C-N 129.111 4.007 . . . . 0.0 111.271 -179.887 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 103.47 7.41 42.74 Favored Glycine 0 C--O 1.204 -1.725 0 CA-C-N 111.232 -2.713 . . . . 0.0 109.993 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.608 ' HA ' HD11 ' A' ' 26' ' ' ILE . 4.0 tp -165.6 36.38 0.06 Allowed 'General case' 0 C--N 1.351 0.648 0 O-C-N 128.439 3.082 . . . . 0.0 116.36 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.465 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 7.6 t0 159.3 -66.54 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.044 2.715 . . . . 0.0 113.189 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.67 78.61 0.82 Allowed Glycine 0 C--O 1.204 -1.719 0 O-C-N 126.097 2.123 . . . . 0.0 110.144 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.27 -146.53 0.15 Allowed 'General case' 0 CA--C 1.494 -1.182 0 O-C-N 129.44 3.671 . . . . 0.0 113.193 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.505 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 15.2 m-20 -163.38 112.91 1.31 Allowed 'General case' 0 C--O 1.202 -1.431 0 CA-C-O 117.471 -1.252 . . . . 0.0 108.934 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.7 HG22 ' HA2' ' A' ' 100' ' ' GLY . 71.1 t -146.95 131.83 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 N-CA-C 117.833 2.531 . . . . 0.0 117.833 -178.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -60.48 115.56 3.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 110.657 -2.974 . . . . 0.0 107.701 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.579 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 40.8 m -122.4 74.31 1.17 Allowed 'General case' 0 C--O 1.198 -1.656 0 O-C-N 127.915 3.26 . . . . 0.0 115.633 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.491 ' HB3' ' CG2' ' A' ' 97' ' ' VAL . 5.3 tp -67.33 143.44 56.38 Favored 'General case' 0 N--CA 1.437 -1.079 2 CA-C-N 106.037 -5.074 . . . . 0.0 108.908 -179.684 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.526 HG21 ' CD2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -123.34 131.09 73.78 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.984 0 O-C-N 126.402 2.314 . . . . 0.0 107.415 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 89' ' ' TRP 0.333 1.7 m -151.3 159.42 44.33 Favored 'General case' 0 CA--C 1.479 -1.782 0 CA-C-N 113.027 -1.897 . . . . 0.0 109.585 -179.562 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.836 ' NE1' HG21 ' A' ' 67' ' ' VAL . 58.8 m95 -87.07 143.66 27.22 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 114.509 -2.662 . . . . 0.0 106.503 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.841 ' HB3' HG22 ' A' ' 93' ' ' THR . 11.0 tp10 -90.28 -35.45 15.27 Favored 'General case' 0 CA--C 1.479 -1.752 1 CA-C-O 133.074 6.178 . . . . 0.0 112.469 179.798 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.18 -41.75 0.27 Allowed Glycine 0 C--O 1.206 -1.602 1 CA-C-N 107.009 -4.632 . . . . 0.0 103.2 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.533 ' O ' ' HB ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -155.65 67.64 0.63 Allowed 'General case' 0 C--O 1.197 -1.69 1 O-C-N 131.267 4.745 . . . . 0.0 107.897 -179.787 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.841 HG22 ' HB3' ' A' ' 90' ' ' GLU . 14.6 t 159.18 147.19 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 118.051 2.611 . . . . 0.0 118.051 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.681 HD23 ' NE2' ' A' ' 109' ' ' GLN . 0.7 OUTLIER -85.97 82.66 8.04 Favored 'General case' 0 CA--C 1.495 -1.165 1 O-C-N 132.679 6.237 . . . . 0.0 116.816 179.491 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.538 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.343 54.5 t -84.12 135.71 24.27 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 CA-C-O 115.558 -2.163 . . . . 0.0 112.663 179.492 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.11 137.77 29.38 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 105.518 -2.03 . . . . 0.0 105.518 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.491 ' CG2' ' HB3' ' A' ' 86' ' ' LEU . 16.4 m -113.14 118.49 58.19 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.996 1 O-C-N 130.098 4.624 . . . . 0.0 117.15 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.402 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 3.7 mm-40 -94.95 99.02 11.12 Favored 'General case' 0 C--O 1.221 -0.416 0 O-C-N 119.373 -2.079 . . . . 0.0 108.766 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.2 OUTLIER -93.74 77.6 4.26 Favored 'General case' 0 C--O 1.201 -1.47 0 CA-C-N 111.059 -2.791 . . . . 0.0 108.324 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.7 ' HA2' HG22 ' A' ' 83' ' ' VAL . . . -81.65 -117.98 0.46 Allowed Glycine 0 C--O 1.207 -1.573 0 CA-C-N 112.286 -2.234 . . . . 0.0 112.082 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 174.03 94.62 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.984 -2.108 . . . . 0.0 111.731 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? 128.19 -28.62 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 129.159 2.984 . . . . 0.0 111.772 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.35 174.33 10.73 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 110.091 -3.231 . . . . 0.0 116.552 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 38.3 m-20 -125.38 97.36 5.17 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 113.579 -3.105 . . . . 0.0 105.888 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.473 ' HD3' ' HA ' ' A' ' 122' ' ' CYS 0.285 17.9 mmt180 -91.47 6.76 44.28 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 128.844 3.84 . . . . 0.0 113.809 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.402 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -49.0 97.14 0.01 OUTLIER Glycine 0 CA--C 1.533 1.194 2 O-C-N 133.166 6.541 . . . . 0.0 111.48 179.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.603 ' CZ2' HD11 ' A' ' 63' ' ' LEU 0.263 0.0 OUTLIER -104.16 137.92 41.4 Favored 'General case' 0 C--N 1.317 -0.815 1 O-C-N 130.97 4.571 . . . . 0.0 108.55 178.541 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.401 ' HA ' HE21 ' A' ' 109' ' ' GLN . 0.0 OUTLIER -152.65 -179.46 7.63 Favored 'General case' 0 C--O 1.204 -1.302 1 O-C-N 131.853 5.721 . . . . 0.0 115.101 -178.047 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.681 ' NE2' HD23 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -139.77 177.37 8.0 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 109.147 -3.661 . . . . 0.0 107.747 -179.835 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.466 ' CD1' ' HB3' ' A' ' 117' ' ' TYR 0.27 0.5 OUTLIER 177.93 100.45 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.642 1 O-C-N 132.694 6.246 . . . . 0.0 115.713 178.637 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.4 t -46.62 96.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.486 -1.491 0 CA-C-O 126.416 3.008 . . . . 0.0 115.63 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.91 96.7 6.41 Favored 'General case' 0 CA--C 1.484 -1.595 0 CA-C-O 125.221 2.439 . . . . 0.0 115.945 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.76 72.78 0.47 Allowed Glycine 0 N--CA 1.439 -1.141 0 CA-C-N 112.049 -2.341 . . . . 0.0 117.101 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 49.48 63.08 2.3 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 126.587 1.992 . . . . 0.0 116.057 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 160.63 148.9 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.667 1 O-C-N 130.003 4.564 . . . . 0.0 109.419 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.731 HD23 ' CZ2' ' A' ' 9' ' ' TRP . 1.2 mm? -83.19 -174.82 5.51 Favored 'General case' 0 CA--C 1.495 -1.149 0 O-C-N 127.156 2.785 . . . . 0.0 111.679 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.466 ' HB3' ' CD1' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -155.81 69.53 0.67 Allowed 'General case' 0 C--O 1.203 -1.355 0 O-C-N 128.053 3.346 . . . . 0.0 110.751 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.83 87.24 0.06 Allowed 'General case' 0 CA--C 1.505 -0.767 1 CA-C-N 107.512 -4.404 . . . . 0.0 109.022 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -105.78 97.64 7.44 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 125.644 1.84 . . . . 0.0 111.081 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.574 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -102.74 162.66 12.74 Favored 'General case' 0 C--N 1.365 1.24 0 O-C-N 126.645 2.466 . . . . 0.0 108.406 179.568 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.469 ' O ' HD12 ' A' ' 120' ' ' LEU . 0.6 OUTLIER -139.53 160.84 38.91 Favored 'General case' 0 C--O 1.2 -1.518 0 O-C-N 128.372 3.545 . . . . 0.0 105.541 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.473 ' HA ' ' HD3' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -159.11 59.66 0.41 Allowed 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 126.795 3.188 . . . . 0.0 110.185 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.97 -69.97 0.5 Allowed Glycine 0 N--CA 1.435 -1.397 0 CA-C-N 110.282 -3.145 . . . . 0.0 111.075 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -162.45 64.13 0.22 Allowed 'General case' 0 C--O 1.206 -1.228 0 CA-C-N 110.646 -2.777 . . . . 0.0 109.197 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -158.09 36.96 0.25 Allowed 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 111.336 -2.665 . . . . 0.0 105.562 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.519 ' O ' HG13 ' A' ' 126' ' ' VAL . 7.9 p -35.06 111.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 O-C-N 128.847 3.842 . . . . 0.0 113.792 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.6 t -89.71 119.44 30.12 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 119.352 -2.092 . . . . 0.0 107.577 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.4 ttp180 -106.55 111.46 24.02 Favored 'General case' 0 N--CA 1.477 0.913 1 O-C-N 129.3 4.125 . . . . 0.0 110.678 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -108.76 164.89 11.98 Favored 'General case' 0 CA--C 1.506 -0.748 0 O-C-N 126.175 2.172 . . . . 0.0 112.763 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -127.1 157.19 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 N-CA-C 103.24 -2.874 . . . . 0.0 103.24 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -136.22 173.51 11.63 Favored 'General case' 0 CA--C 1.477 -1.863 0 CA-C-N 108.712 -3.858 . . . . 0.0 117.84 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.321 0.5 OUTLIER -162.17 97.02 1.01 Allowed 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 110.575 -3.011 . . . . 0.0 103.827 -179.621 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.52 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 12.2 pttt -33.39 -44.42 0.14 Allowed 'General case' 0 C--O 1.198 -1.607 1 O-C-N 131.168 5.293 . . . . 0.0 117.521 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.447 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 30.0 ttmt . . . . . 0 CA--C 1.481 -1.698 0 CA-C-O 114.745 -2.55 . . . . 0.0 111.817 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.6 mtp . . . . . 0 N--CA 1.501 2.108 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.8 -162.11 0.85 Allowed 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 118.253 -0.88 . . . . 0.0 108.704 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.536 ' HB2' ' CH2' ' A' ' 89' ' ' TRP . 0.0 OUTLIER -49.3 -19.12 0.45 Allowed 'General case' 0 C--N 1.356 0.873 0 O-C-N 125.644 1.84 . . . . 0.0 113.402 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -63.07 104.35 0.56 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 103.443 -2.799 . . . . 0.0 103.443 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -138.4 -177.59 4.92 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 111.684 -2.507 . . . . 0.0 104.96 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -178.54 145.72 0.33 Allowed 'General case' 0 C--O 1.22 -0.482 1 O-C-N 129.499 4.249 . . . . 0.0 111.554 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -176.23 -151.56 8.92 Favored Glycine 0 C--O 1.201 -1.923 0 CA-C-O 115.652 -2.749 . . . . 0.0 115.066 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 ' HD2' ' A' ' 134' ' ' LYS . 5.5 t -167.05 42.73 0.05 OUTLIER 'General case' 0 C--O 1.204 -1.32 1 O-C-N 134.444 6.614 . . . . 0.0 107.791 179.727 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.539 ' CZ2' HD12 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -34.42 136.74 0.13 Allowed 'General case' 0 C--O 1.242 0.673 1 O-C-N 132.073 5.858 . . . . 0.0 112.024 179.926 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.494 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.4 mt-10 -103.84 53.36 0.75 Allowed 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 117.715 -1.594 . . . . 0.0 110.934 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.421 ' O ' ' N ' ' A' ' 13' ' ' SER . 15.8 ttp -4.92 67.28 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 O-C-N 128.978 3.924 . . . . 0.0 108.957 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.494 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.6 tt0 -12.82 -45.09 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.803 1 O-C-N 133.182 6.551 . . . . 0.0 112.427 -178.518 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 11' ' ' MET . 1.2 t -173.7 161.69 3.95 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 109.524 -3.489 . . . . 0.0 109.886 -179.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -116.08 156.61 26.09 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 109.686 -3.416 . . . . 0.0 112.735 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -117.77 -56.66 2.18 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 127.067 2.729 . . . . 0.0 110.609 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -116.68 113.41 22.6 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 119.8 -1.812 . . . . 0.0 107.822 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . 0.296 25.0 t80 -115.29 -47.41 2.85 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 127.659 3.6 . . . . 0.0 112.524 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -76.38 -48.75 18.78 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 110.969 -2.832 . . . . 0.0 114.274 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -53.4 -21.84 14.09 Favored Glycine 0 CA--C 1.484 -1.869 0 O-C-N 124.982 1.426 . . . . 0.0 113.465 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.512 ' N ' HE21 ' A' ' 125' ' ' GLN . 0.1 OUTLIER -69.14 -48.0 63.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.206 -1.775 . . . . 0.0 106.206 179.541 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.462 ' O ' HG22 ' A' ' 26' ' ' ILE . 1.7 mtm -70.42 -32.28 69.82 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 111.807 -2.451 . . . . 0.0 112.472 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.68 -23.39 56.21 Favored 'General case' 0 C--O 1.202 -1.445 0 C-N-CA 128.569 2.748 . . . . 0.0 114.998 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.0 -32.13 50.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 110.226 -3.17 . . . . 0.0 108.804 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.49 HD13 ' HB2' ' A' ' 79' ' ' ASP 0.291 3.3 mt -74.03 -23.99 59.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 111.229 -2.714 . . . . 0.0 104.464 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 t70 63.24 58.86 1.35 Allowed 'General case' 0 C--O 1.216 -0.705 1 CA-C-O 128.514 4.006 . . . . 0.0 106.416 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.608 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 1.3 tt -71.72 -47.44 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.983 1 CA-C-N 106.73 -4.759 . . . . 0.0 110.594 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 178.59 123.25 0.05 OUTLIER 'General case' 0 C--N 1.361 1.102 0 CA-C-N 113.981 -1.463 . . . . 0.0 109.231 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.449 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 93.1 m-85 -72.65 121.71 20.23 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 117.093 -1.843 . . . . 0.0 114.512 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 78.93 51.65 0.03 OUTLIER 'General case' 0 C--O 1.209 -1.054 0 C-N-CA 126.995 2.118 . . . . 0.0 110.527 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.423 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.4 OUTLIER -87.67 -52.64 5.21 Favored 'General case' 0 C--N 1.355 0.848 2 O-C-N 130.018 4.574 . . . . 0.0 112.001 -179.921 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.535 ' HD3' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.25 -138.42 0.01 OUTLIER 'General case' 0 C--O 1.244 0.777 0 CA-C-O 112.437 -3.649 . . . . 0.0 111.92 -179.734 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.535 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER 98.18 -38.7 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.206 0 O-C-N 128.633 3.708 . . . . 0.0 111.071 -179.864 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.694 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -117.44 8.42 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 1 O-C-N 131.057 5.223 . . . . 0.0 110.383 -179.787 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -116.28 22.04 13.17 Favored 'General case' 0 C--N 1.346 0.429 0 O-C-N 124.735 1.272 . . . . 0.0 107.779 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.4 t -49.77 -36.37 11.15 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.344 0 CA-C-O 123.881 1.801 . . . . 0.0 111.483 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.58 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.5 OUTLIER 171.36 128.7 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.828 1 CA-C-N 108.22 -4.082 . . . . 0.0 110.858 179.837 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.741 HD23 ' N ' ' A' ' 37' ' ' LEU . 1.4 mt -97.74 -50.24 4.53 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 129.038 3.961 . . . . 0.0 104.049 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.3 m -170.23 142.96 2.31 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.727 5.642 . . . . 0.0 112.008 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.533 ' HG2' ' N ' ' A' ' 40' ' ' THR . 0.1 OUTLIER -125.03 150.43 46.76 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 126.074 2.109 . . . . 0.0 114.853 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.533 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 66.2 m 178.23 109.11 0.03 OUTLIER 'General case' 0 N--CA 1.433 -1.287 1 O-C-N 129.478 4.237 . . . . 0.0 111.904 178.815 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.89 152.56 19.63 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 127.928 3.267 . . . . 0.0 105.272 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 43' ' ' ILE . 5.1 mp -137.48 157.81 34.3 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.369 0 C-N-CA 117.635 -1.626 . . . . 0.0 110.467 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.552 HG12 ' CE1' ' A' ' 50' ' ' PHE 0.251 3.4 tt -136.43 125.71 38.14 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.513 2 O-C-N 131.646 5.591 . . . . 0.0 109.07 -179.685 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 59.7 t -124.94 102.97 11.61 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 CA-C-N 111.837 -2.438 . . . . 0.0 111.988 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.593 ' HG3' ' CD1' ' A' ' 50' ' ' PHE . 9.6 mt-30 -121.83 89.47 3.13 Favored 'General case' 0 CA--C 1.488 -1.429 0 CA-C-O 125.137 2.399 . . . . 0.0 114.743 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -78.64 -8.41 58.63 Favored 'General case' 0 CA--C 1.493 -1.25 0 CA-C-N 108.788 -3.824 . . . . 0.0 113.006 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 170.51 -106.8 0.25 Allowed Glycine 0 C--O 1.203 -1.841 0 CA-C-O 123.504 1.613 . . . . 0.0 113.741 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.559 ' O ' HG23 ' A' ' 67' ' ' VAL . 2.0 m-20 -98.62 -1.19 41.47 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 112.728 -1.736 . . . . 0.0 113.059 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.88 90.25 3.3 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 127.793 3.183 . . . . 0.0 108.907 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.593 ' CD1' ' HG3' ' A' ' 45' ' ' GLN . 6.4 t80 -96.44 103.66 15.58 Favored 'General case' 0 CA--C 1.496 -1.108 0 O-C-N 128.278 3.486 . . . . 0.0 113.305 -179.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.0 73.25 1.01 Allowed 'General case' 0 CA--C 1.496 -1.124 0 O-C-N 128.169 3.418 . . . . 0.0 118.202 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.633 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -52.28 165.55 0.23 Allowed 'General case' 0 C--N 1.358 0.95 0 CA-C-N 112.221 -2.263 . . . . 0.0 108.87 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.511 ' N ' HG23 ' A' ' 52' ' ' THR . 0.0 OUTLIER -170.91 153.31 3.84 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 114.843 -2.743 . . . . 0.0 106.653 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.406 HG22 ' HA ' ' A' ' 60' ' ' ASN . 0.7 OUTLIER -108.11 152.34 24.66 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 127.382 2.927 . . . . 0.0 107.847 178.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -104.84 10.44 34.44 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 125.562 1.789 . . . . 0.0 115.258 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.533 ' HB3' ' CD1' ' A' ' 58' ' ' PHE . 54.4 m -44.35 152.2 0.21 Allowed 'General case' 0 N--CA 1.477 0.924 1 O-C-N 129.199 4.062 . . . . 0.0 105.513 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.552 HG23 HD12 ' A' ' 37' ' ' LEU 0.266 7.3 t -83.51 -35.24 25.0 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-N 111.752 -2.476 . . . . 0.0 110.719 -179.049 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.651 ' CE2' HD21 ' A' ' 37' ' ' LEU 0.251 0.0 OUTLIER -60.2 -38.34 83.02 Favored 'General case' 0 C--N 1.366 1.301 0 O-C-N 126.811 2.57 . . . . 0.0 111.524 -179.475 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 168.57 162.43 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.516 1 O-C-N 130.723 5.014 . . . . 0.0 112.05 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.406 ' HA ' HG22 ' A' ' 54' ' ' THR . 1.1 m120 -113.38 127.65 56.2 Favored 'General case' 0 C--O 1.209 -1.074 1 O-C-N 130.366 4.791 . . . . 0.0 107.903 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -106.38 28.42 7.79 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 126.331 2.269 . . . . 0.0 108.39 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -13.62 112.52 0.02 OUTLIER 'General case' 0 C--O 1.205 -1.257 1 O-C-N 130.287 4.742 . . . . 0.0 117.502 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.832 HD21 ' CZ ' ' A' ' 65' ' ' PHE . 9.9 tt -68.16 121.82 16.99 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 127.503 3.002 . . . . 0.0 108.796 177.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -141.02 83.08 1.87 Allowed 'General case' 0 CA--C 1.485 -1.549 0 C-N-CA 113.956 -3.098 . . . . 0.0 112.237 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.947 ' CD1' HG21 ' A' ' 87' ' ' VAL . 5.3 p90 -142.49 167.42 22.14 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-O 126.076 2.846 . . . . 0.0 110.926 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -119.88 157.3 29.02 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 112.647 -2.069 . . . . 0.0 108.115 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 48' ' ' ASP . 1.9 t -51.67 141.74 4.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.119 0 O-C-N 127.027 2.705 . . . . 0.0 115.085 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 23.37 47.55 0.01 OUTLIER Glycine 0 CA--C 1.5 -0.875 1 O-C-N 131.501 5.5 . . . . 0.0 117.857 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -97.84 0.12 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 59.03 73.59 0.48 Allowed 'General case' 0 C--N 1.357 0.892 0 O-C-N 128.947 3.904 . . . . 0.0 109.254 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.46 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 5.3 t80 -67.59 138.14 56.21 Favored 'General case' 0 N--CA 1.451 -0.405 2 O-C-N 129.602 4.314 . . . . 0.0 116.652 -179.801 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -112.79 93.63 4.52 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 113.171 -1.832 . . . . 0.0 110.62 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -72.39 154.21 41.02 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-O 126.517 3.056 . . . . 0.0 109.796 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -131.78 74.15 1.57 Allowed 'General case' 0 C--O 1.205 -1.285 0 CA-C-N 108.984 -3.735 . . . . 0.0 109.764 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 70.3 p -49.85 -79.49 0.01 OUTLIER 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 114.265 -2.779 . . . . 0.0 116.19 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 13.0 97.32 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.816 1 O-C-N 129.656 4.347 . . . . 0.0 115.782 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 142.01 -29.14 2.22 Favored Glycine 0 C--O 1.213 -1.212 0 CA-C-N 110.345 -3.116 . . . . 0.0 107.666 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.608 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 12.6 tp -141.13 50.01 1.63 Allowed 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 108.481 -3.86 . . . . 0.0 115.395 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.498 ' N ' HD12 ' A' ' 26' ' ' ILE . 5.6 t70 151.73 -67.78 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.893 1.996 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.03 65.28 1.18 Allowed Glycine 0 C--O 1.229 -0.217 0 O-C-N 126.235 2.21 . . . . 0.0 112.818 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.46 ' CG ' ' N ' ' A' ' 82' ' ' ASN 0.267 3.3 tpt180 -139.97 -122.05 0.12 Allowed 'General case' 0 N--CA 1.482 1.139 0 CA-C-O 113.836 -2.983 . . . . 0.0 112.936 -179.721 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.46 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER 156.15 101.81 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.181 0 O-C-N 128.299 3.499 . . . . 0.0 108.665 -179.275 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.771 HG13 ' HA2' ' A' ' 100' ' ' GLY . 1.9 t -134.33 165.18 32.29 Favored 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 127.043 2.714 . . . . 0.0 117.684 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.48 ' N ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -75.24 163.88 27.05 Favored 'General case' 0 C--O 1.218 -0.56 2 O-C-N 133.426 6.704 . . . . 0.0 107.503 179.19 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.46 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.1 m -168.76 98.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.983 1 O-C-N 130.799 5.062 . . . . 0.0 110.152 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.06 93.55 7.44 Favored 'General case' 0 C--O 1.209 -1.043 2 O-C-N 130.911 5.132 . . . . 0.0 116.626 -179.666 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.947 HG21 ' CD1' ' A' ' 65' ' ' PHE . 26.1 t -68.4 131.66 33.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.197 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -157.95 160.77 37.91 Favored 'General case' 0 CA--C 1.498 -1.038 0 CA-C-O 124.188 1.947 . . . . 0.0 111.711 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.741 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 70.3 m95 -88.8 142.5 27.61 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 114.649 -2.596 . . . . 0.0 106.708 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.871 ' HB2' HG23 ' A' ' 93' ' ' THR . 0.0 OUTLIER -92.76 -60.37 1.83 Allowed 'General case' 0 CA--C 1.48 -1.718 1 CA-C-O 132.477 5.894 . . . . 0.0 113.456 179.552 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.02 61.72 0.03 OUTLIER Glycine 0 CA--C 1.542 1.778 1 CA-C-N 107.84 -4.255 . . . . 0.0 104.428 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.1 m120 92.39 66.08 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.038 1 O-C-N 132.388 5.405 . . . . 0.0 105.701 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.871 HG23 ' HB2' ' A' ' 90' ' ' GLU . 1.9 t 166.21 141.95 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 50' ' ' PHE . 4.8 tp -86.05 106.5 17.25 Favored 'General case' 0 CA--C 1.487 -1.458 1 O-C-N 131.239 5.337 . . . . 0.0 114.161 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.735 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.376 40.8 t -109.87 148.68 13.33 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.014 0 CA-C-N 109.385 -3.552 . . . . 0.0 114.418 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.22 133.07 17.0 Favored 'General case' 0 C--O 1.219 -0.532 0 O-C-N 125.739 1.899 . . . . 0.0 106.544 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.8 t -103.11 73.46 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.598 0 CA-C-N 110.133 -3.212 . . . . 0.0 115.256 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.575 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -53.36 101.4 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 122.383 1.087 . . . . 0.0 109.084 179.664 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -95.98 98.23 10.22 Favored 'General case' 0 C--O 1.205 -1.254 0 CA-C-N 109.315 -3.584 . . . . 0.0 112.358 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.771 ' HA2' HG13 ' A' ' 83' ' ' VAL . . . -94.19 -136.72 8.32 Favored Glycine 0 C--O 1.212 -1.239 0 O-C-N 127.94 3.275 . . . . 0.0 111.063 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -154.66 -47.39 0.09 Allowed 'General case' 0 CA--C 1.502 -0.891 1 CA-C-N 107.695 -4.252 . . . . 0.0 109.631 179.675 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.433 ' C ' ' HD3' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -101.86 3.6 39.4 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-O 123.408 1.575 . . . . 0.0 115.033 179.966 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -160.78 174.62 13.64 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 110.222 -3.172 . . . . 0.0 117.307 -179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -121.2 96.59 5.15 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 108.838 -3.801 . . . . 0.0 101.637 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.418 ' HB3' ' CD ' ' A' ' 98' ' ' GLN . 12.2 mmm-85 -87.68 -2.41 58.59 Favored 'General case' 0 C--O 1.208 -1.122 1 O-C-N 129.506 4.254 . . . . 0.0 111.593 -179.693 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.575 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.66 95.52 0.01 OUTLIER Glycine 0 C--O 1.208 -1.501 2 O-C-N 133.719 6.887 . . . . 0.0 115.551 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.517 ' CD1' ' C ' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -110.46 137.69 47.83 Favored 'General case' 0 C--N 1.319 -0.754 1 O-C-N 130.997 4.586 . . . . 0.0 108.242 178.04 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -163.19 177.84 8.72 Favored 'General case' 0 CA--C 1.506 -0.717 1 O-C-N 130.454 4.846 . . . . 0.0 111.403 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.532 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 1.1 mp0 -139.71 -174.33 3.87 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 113.849 -2.977 . . . . 0.0 108.133 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.431 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.2 OUTLIER 179.4 89.17 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.235 1 O-C-N 130.377 4.798 . . . . 0.0 117.683 178.961 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . 0.25 70.3 t -34.71 104.57 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-O 125.051 2.358 . . . . 0.0 112.187 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.526 ' HG2' ' CD2' ' A' ' 117' ' ' TYR . 0.7 OUTLIER -107.29 28.87 7.66 Favored 'General case' 0 CA--C 1.478 -1.811 0 CA-C-N 111.534 -2.575 . . . . 0.0 117.81 -179.633 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.42 95.36 0.84 Allowed Glycine 0 C--O 1.21 -1.392 0 O-C-N 119.576 -1.952 . . . . 0.0 117.944 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 61.83 35.03 16.77 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 165.19 154.91 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.153 1 O-C-N 130.729 5.018 . . . . 0.0 110.015 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.539 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 1.1 mt -91.69 -172.75 3.32 Favored 'General case' 0 CA--C 1.484 -1.575 0 O-C-N 127.378 2.924 . . . . 0.0 112.399 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.526 ' CD2' ' HG2' ' A' ' 112' ' ' GLU . 0.0 OUTLIER -150.46 83.86 1.36 Allowed 'General case' 0 C--N 1.362 1.142 0 CA-C-N 111.659 -2.519 . . . . 0.0 113.182 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.479 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -73.33 88.14 1.54 Allowed 'General case' 0 N--CA 1.475 0.778 2 CA-C-N 107.989 -4.187 . . . . 0.0 109.562 -179.894 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -100.47 102.34 13.5 Favored 'General case' 0 CA--C 1.499 -0.985 0 O-C-N 128.863 3.852 . . . . 0.0 109.803 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.516 HD11 ' SG ' ' A' ' 122' ' ' CYS . 0.2 OUTLIER -121.52 155.27 35.33 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 128.136 3.397 . . . . 0.0 109.347 -179.847 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.1 t -133.59 154.76 50.63 Favored 'General case' 0 C--N 1.311 -1.103 1 O-C-N 129.56 4.288 . . . . 0.0 104.759 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.516 ' SG ' HD11 ' A' ' 120' ' ' LEU 0.273 2.8 m -139.43 39.78 2.06 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.887 1.327 . . . . 0.0 110.962 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 132.93 -57.51 0.71 Allowed Glycine 0 CA--C 1.526 0.781 0 CA-C-N 111.696 -2.502 . . . . 0.0 108.526 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -172.77 49.64 0.02 OUTLIER 'General case' 0 CA--C 1.491 -1.294 0 CA-C-N 109.845 -3.177 . . . . 0.0 106.955 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.512 HE21 ' N ' ' A' ' 20' ' ' TYR . 1.4 tm0? -103.38 -22.93 13.6 Favored 'General case' 0 C--O 1.208 -1.122 0 C-N-CA 116.666 -2.014 . . . . 0.0 110.369 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.511 ' O ' HG13 ' A' ' 126' ' ' VAL . 11.8 p 27.1 63.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.495 -1.163 0 CA-C-O 125.297 2.475 . . . . 0.0 117.11 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.412 ' N ' ' O ' ' A' ' 120' ' ' LEU . 0.0 OUTLIER -57.71 149.29 22.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 O-C-N 118.923 -2.361 . . . . 0.0 108.191 -179.691 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -135.09 87.71 2.36 Favored 'General case' 0 N--CA 1.476 0.838 0 O-C-N 128.181 3.426 . . . . 0.0 111.002 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -83.02 164.52 20.3 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.8 t -131.42 139.45 50.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-O 123.963 1.839 . . . . 0.0 106.078 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.479 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 39.6 m-85 -123.02 179.66 4.59 Favored 'General case' 0 CA--C 1.492 -1.263 0 CA-C-O 126.716 3.15 . . . . 0.0 117.42 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.415 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.297 0.0 OUTLIER -165.76 122.41 1.39 Allowed 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 109.903 -3.317 . . . . 0.0 104.473 -179.936 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.492 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 19.7 ttpt -71.6 57.35 0.28 Allowed 'General case' 0 C--O 1.202 -1.445 0 N-CA-C 117.94 2.57 . . . . 0.0 117.94 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.518 ' HD2' HG22 ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.796 0 N-CA-C 117.976 2.584 . . . . 0.0 117.976 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mtt . . . . . 0 N--CA 1.509 2.525 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 m -80.35 141.14 35.7 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 113.857 -1.519 . . . . 0.0 111.88 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.462 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 17.0 mttt 45.83 34.96 2.05 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.71 104.53 5.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 104.006 -2.59 . . . . 0.0 104.006 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . 0.262 7.7 mt-30 -139.39 145.75 39.33 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 103.616 -2.735 . . . . 0.0 103.616 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 156.7 126.16 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.919 1 O-C-N 131.571 5.545 . . . . 0.0 112.108 179.944 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 150.48 -169.91 30.39 Favored Glycine 0 C--O 1.2 -1.97 0 O-C-N 127.054 2.721 . . . . 0.0 110.224 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.553 HG23 HG23 ' A' ' 40' ' ' THR . 0.9 OUTLIER -129.57 145.08 51.51 Favored 'General case' 0 C--N 1.318 -0.8 1 O-C-N 131.963 5.155 . . . . 0.0 107.664 -179.962 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.573 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -138.04 109.2 6.82 Favored 'General case' 0 CA--C 1.498 -1.028 1 O-C-N 131.199 5.312 . . . . 0.0 112.177 -179.773 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -56.02 -15.25 3.28 Favored 'General case' 0 C--N 1.316 -0.863 0 O-C-N 126.828 2.58 . . . . 0.0 115.415 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.9 ttp 59.02 81.49 0.16 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -35.27 -43.95 0.25 Allowed 'General case' 0 N--CA 1.442 -0.851 0 O-C-N 128.879 3.862 . . . . 0.0 110.993 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.268 4.8 p -157.97 162.76 38.23 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 112.046 -2.343 . . . . 0.0 111.535 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -132.3 124.8 29.56 Favored 'General case' 0 CA--C 1.482 -1.664 1 CA-C-N 107.898 -4.228 . . . . 0.0 112.223 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.33 -149.42 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 128.173 3.42 . . . . 0.0 107.65 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -44.61 139.47 2.86 Favored 'General case' 0 C--O 1.2 -1.514 0 CA-C-N 119.551 1.069 . . . . 0.0 112.815 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -126.75 -44.27 1.67 Allowed 'General case' 0 C--O 1.197 -1.669 0 CA-C-O 125.695 2.664 . . . . 0.0 111.648 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.66 -22.17 47.2 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-N 111.348 -2.66 . . . . 0.0 115.542 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.81 -31.03 62.84 Favored Glycine 0 N--CA 1.474 1.21 0 O-C-N 128.129 3.393 . . . . 0.0 108.29 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.424 ' O ' HD23 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -70.12 -34.32 72.95 Favored 'General case' 0 C--O 1.211 -0.921 0 CA-C-O 124.7 2.191 . . . . 0.0 108.958 -179.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.596 ' O ' HG22 ' A' ' 26' ' ' ILE . 2.1 mtm -73.16 -24.09 60.52 Favored 'General case' 0 CA--C 1.484 -1.568 0 C-N-CA 114.749 -2.78 . . . . 0.0 113.765 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -78.33 -24.33 46.61 Favored 'General case' 0 CA--C 1.538 0.512 1 O-C-N 132.184 5.928 . . . . 0.0 110.585 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.38 -32.18 73.69 Favored 'General case' 0 C--O 1.202 -1.406 1 O-C-N 130.664 4.978 . . . . 0.0 112.857 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.424 HD23 ' O ' ' A' ' 20' ' ' TYR . 0.7 OUTLIER -118.56 19.93 13.13 Favored 'General case' 0 N--CA 1.472 0.634 1 O-C-N 129.411 4.194 . . . . 0.0 107.42 179.648 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.35 -64.03 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 128.37 3.544 . . . . 0.0 112.675 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.596 HG22 ' O ' ' A' ' 21' ' ' MET . 8.3 tt 36.65 34.42 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.828 1 CA-C-O 129.095 4.283 . . . . 0.0 113.768 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.88 175.08 0.13 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 109.415 -3.539 . . . . 0.0 111.786 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.439 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.9 m-85 -112.65 168.78 9.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 113.703 -1.589 . . . . 0.0 113.476 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 83.71 103.37 0.05 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.442 HG22 ' N ' ' A' ' 31' ' ' ARG . 0.8 OUTLIER 176.81 -45.63 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.394 2.934 . . . . 0.0 112.625 -179.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 30' ' ' THR . 0.0 OUTLIER -53.25 -9.37 0.16 Allowed 'General case' 0 CA--C 1.497 -1.074 0 C-N-CA 129.698 3.199 . . . . 0.0 114.458 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -31.47 27.36 Favored 'General case' 0 CA--C 1.482 -1.668 0 C-N-CA 117.212 -1.795 . . . . 0.0 114.365 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.714 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -135.11 15.26 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.357 0.913 1 O-C-N 129.45 4.219 . . . . 0.0 114.877 -179.925 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -114.94 12.47 16.82 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 118.919 -1.113 . . . . 0.0 112.469 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.4 t -52.7 -39.18 29.58 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.527 0 CA-C-O 122.888 1.328 . . . . 0.0 111.983 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.723 ' C ' HD23 ' A' ' 37' ' ' LEU . 1.0 OUTLIER 173.93 131.74 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 108.493 -3.958 . . . . 0.0 111.178 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.819 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -101.68 -60.56 1.51 Allowed 'General case' 0 N--CA 1.435 -1.194 1 O-C-N 129.676 4.36 . . . . 0.0 105.798 -179.523 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.52 ' O ' HG22 ' A' ' 38' ' ' THR . 22.1 m -153.23 36.63 0.47 Allowed 'General case' 0 CA--C 1.489 -1.399 1 O-C-N 131.102 5.251 . . . . 0.0 112.032 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.442 ' HB3' ' HD3' ' A' ' 36' ' ' ARG . 6.7 tt0 -63.59 118.22 7.9 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 116.355 1.983 . . . . 0.0 116.355 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.553 HG23 HG23 ' A' ' 8' ' ' THR . 1.4 m -121.99 132.61 54.62 Favored 'General case' 0 C--O 1.204 -1.306 1 O-C-N 129.246 4.091 . . . . 0.0 110.183 179.312 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 0.3 OUTLIER -107.87 141.4 39.52 Favored 'General case' 0 N--CA 1.475 0.811 1 O-C-N 129.372 4.17 . . . . 0.0 107.497 -179.84 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.659 HD13 ' CD ' ' A' ' 53' ' ' LYS . 2.9 mp -132.46 155.44 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 O-C-N 126.788 2.555 . . . . 0.0 110.776 179.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.515 ' N ' HG22 ' A' ' 42' ' ' ILE . 13.4 tt -132.94 129.02 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.543 0 CA-C-O 126.139 2.876 . . . . 0.0 109.46 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.427 ' O ' HG12 ' A' ' 44' ' ' VAL . 3.0 t -124.56 48.46 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.372 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -55.97 108.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.563 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -123.64 14.29 9.42 Favored 'General case' 0 CA--C 1.476 -1.877 1 O-C-N 129.532 4.27 . . . . 0.0 117.751 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.32 103.28 2.71 Favored Glycine 0 C--O 1.214 -1.156 0 C-N-CA 119.282 -1.437 . . . . 0.0 112.153 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 73.09 -65.47 0.35 Allowed 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 127.821 2.719 . . . . 0.0 112.072 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -96.81 86.72 4.11 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 129.054 3.971 . . . . 0.0 109.818 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.526 ' CD2' HD13 ' A' ' 94' ' ' LEU . 1.7 t80 -98.1 109.91 22.59 Favored 'General case' 0 N--CA 1.475 0.8 1 O-C-N 130.39 4.806 . . . . 0.0 110.999 -179.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -120.25 99.46 6.6 Favored 'General case' 0 CA--C 1.487 -1.477 1 O-C-N 129.885 4.49 . . . . 0.0 119.933 -179.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.539 HG22 ' CB ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -72.71 173.62 8.78 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 126.921 2.638 . . . . 0.0 106.506 178.224 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.659 ' CD ' HD13 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -172.53 145.64 1.62 Allowed 'General case' 0 CA--C 1.488 -1.423 0 C-N-CA 115.975 -2.29 . . . . 0.0 111.515 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.3 t -98.13 126.82 43.75 Favored 'General case' 0 CA--C 1.496 -1.104 0 O-C-N 128.209 3.443 . . . . 0.0 109.68 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -96.76 35.11 1.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.407 ' HB3' ' CE1' ' A' ' 58' ' ' PHE . 0.9 OUTLIER -79.88 110.11 14.94 Favored 'General case' 0 N--CA 1.473 0.687 1 O-C-N 130.187 4.68 . . . . 0.0 105.176 179.642 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.47 -36.97 46.58 Favored 'General case' 0 C--O 1.209 -1.027 1 O-C-N 129.759 4.412 . . . . 0.0 108.407 -179.638 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.515 ' HB3' ' CD1' ' A' ' 37' ' ' LEU . 1.2 p90 -74.63 -23.83 58.75 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -173.77 100.76 0.11 Allowed 'General case' 0 C--O 1.21 -0.993 1 O-C-N 131.417 5.448 . . . . 0.0 116.389 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -107.52 89.79 3.1 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 108.802 -3.817 . . . . 0.0 105.718 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -77.36 -29.08 53.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 111.846 -2.433 . . . . 0.0 108.37 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 t0 69.16 131.5 0.03 OUTLIER 'General case' 0 CA--C 1.499 -0.993 0 O-C-N 127.435 2.959 . . . . 0.0 112.902 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.539 ' CB ' HG22 ' A' ' 52' ' ' THR . 3.9 tp -100.32 58.93 0.98 Allowed 'General case' 0 C--O 1.214 -0.805 0 O-C-N 125.102 1.501 . . . . 0.0 109.868 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -99.43 98.66 9.55 Favored 'General case' 0 C--O 1.203 -1.388 0 O-C-N 126.911 2.632 . . . . 0.0 112.89 -178.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.527 ' CE2' ' CZ2' ' A' ' 107' ' ' TRP . 6.8 p90 -132.73 -179.16 5.29 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 124.031 1.872 . . . . 0.0 106.396 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.761 HG22 HG23 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -129.87 155.72 45.54 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 104.165 -2.532 . . . . 0.0 104.165 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 p -78.77 135.12 26.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.072 0 O-C-N 126.775 2.547 . . . . 0.0 114.344 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 23.59 75.97 Favored Glycine 0 N--CA 1.488 2.129 0 C-N-CA 116.372 -2.823 . . . . 0.0 116.103 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.761 HG23 HG22 ' A' ' 66' ' ' THR . 3.0 t -73.28 -25.16 21.11 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.89 74.59 0.4 Allowed 'General case' 0 C--N 1.364 1.203 1 O-C-N 130.458 4.848 . . . . 0.0 109.509 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.449 ' CB ' ' HB ' ' A' ' 85' ' ' THR . 4.4 m-85 -43.83 147.47 0.46 Allowed 'General case' 0 CA--C 1.503 -0.865 0 O-C-N 128.277 3.485 . . . . 0.0 118.324 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -107.63 56.31 0.64 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 115.995 -1.955 . . . . 0.0 112.491 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' CB ' ' CA ' ' A' ' 83' ' ' VAL . 0.6 OUTLIER 19.16 84.47 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.813 1 CA-C-O 129.267 4.365 . . . . 0.0 114.544 179.765 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.415 ' H ' ' HB2' ' A' ' 82' ' ' ASN . 47.1 t60 -169.7 125.69 0.85 Allowed 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 109.518 -3.492 . . . . 0.0 118.057 178.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.594 ' HB ' ' ND2' ' A' ' 82' ' ' ASN . 0.1 OUTLIER -161.64 168.82 22.73 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.143 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.46 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -152.91 161.89 41.98 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 125.652 2.644 . . . . 0.0 114.514 179.776 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.83 -7.1 82.33 Favored Glycine 0 C--O 1.217 -0.91 0 CA-C-N 111.155 -2.748 . . . . 0.0 113.475 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.627 HD23 HH22 ' A' ' 105' ' ' ARG . 2.8 tp -123.67 -63.88 1.19 Allowed 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -118.78 -58.15 1.98 Allowed 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 113.762 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.58 64.26 0.59 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 127.715 2.578 . . . . 0.0 110.949 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ttm105 151.64 146.38 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 O-C-N 128.556 3.151 . . . . 0.0 109.142 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.594 ' ND2' ' HB ' ' A' ' 75' ' ' THR . 1.1 t-20 -132.45 5.89 4.08 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.676 -178.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.604 ' CA ' ' CB ' ' A' ' 73' ' ' GLU 0.32 16.2 t 49.49 178.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 1 O-C-N 130.199 4.687 . . . . 0.0 116.177 -178.936 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.587 ' N ' HG12 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -76.85 82.2 3.43 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 124.193 1.949 . . . . 0.0 106.71 177.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.494 HG23 ' SG ' ' A' ' 96' ' ' CYS . 83.6 m -93.09 69.14 4.41 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-N 109.305 -3.589 . . . . 0.0 117.209 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 3.9 tt -63.6 150.89 43.1 Favored 'General case' 0 N--CA 1.432 -1.366 2 CA-C-N 106.631 -4.804 . . . . 0.0 110.338 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.7 t -130.58 143.02 42.19 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.108 0 C-N-CA 124.374 1.07 . . . . 0.0 109.308 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.1 173.47 14.3 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-O 125.854 2.74 . . . . 0.0 111.848 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.706 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 60.1 m95 -92.78 154.02 18.54 Favored 'General case' 0 CA--C 1.508 -0.672 0 C-N-CA 128.537 2.735 . . . . 0.0 106.473 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.51 ' HG3' ' CG2' ' A' ' 95' ' ' VAL . 0.3 OUTLIER -111.13 -52.23 2.8 Favored 'General case' 0 CA--C 1.485 -1.533 1 CA-C-O 129.735 4.588 . . . . 0.0 115.976 179.588 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 156.91 84.82 0.05 OUTLIER Glycine 0 C--O 1.196 -2.248 2 N-CA-C 101.829 -4.508 . . . . 0.0 101.829 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.4 p30 67.37 46.15 1.48 Allowed 'General case' 0 C--O 1.216 -0.67 1 O-C-N 136.371 7.748 . . . . 0.0 110.211 -179.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.459 HG23 ' N ' ' A' ' 94' ' ' LEU . 0.5 OUTLIER -179.19 157.36 0.82 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 179.379 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.526 HD13 ' CD2' ' A' ' 50' ' ' PHE . 1.6 tp -87.68 136.57 32.9 Favored 'General case' 0 CA--C 1.477 -1.863 1 O-C-N 130.898 5.124 . . . . 0.0 114.044 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.51 ' CG2' ' HG3' ' A' ' 90' ' ' GLU 0.361 54.8 t -144.64 134.49 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.114 0 CA-C-N 112.387 -2.188 . . . . 0.0 116.737 179.738 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.494 ' SG ' HG23 ' A' ' 85' ' ' THR . 0.0 OUTLIER -136.67 148.94 47.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 126.844 2.59 . . . . 0.0 104.394 179.622 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.3 t -125.93 83.23 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.937 0 N-CA-C 118.224 2.675 . . . . 0.0 118.224 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.434 ' HG3' ' C ' ' A' ' 105' ' ' ARG . 2.6 mt-30 -58.3 105.17 0.26 Allowed 'General case' 0 C--N 1.359 0.987 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -139.08 86.83 2.16 Favored 'General case' 0 C--O 1.203 -1.392 0 O-C-N 128.775 3.797 . . . . 0.0 114.669 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 83' ' ' VAL . . . -149.7 -66.63 0.01 OUTLIER Glycine 0 C--N 1.342 0.892 0 CA-C-O 125.827 2.904 . . . . 0.0 109.367 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.81 169.8 9.61 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 108.682 -3.759 . . . . 0.0 112.222 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.43 -63.84 0.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 O-C-N 127.551 3.032 . . . . 0.0 114.868 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -59.7 145.56 44.52 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 111.21 -2.723 . . . . 0.0 117.714 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -111.24 87.74 2.62 Favored 'General case' 0 N--CA 1.49 1.56 1 CA-C-N 107.869 -4.241 . . . . 0.0 101.756 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.627 HH22 HD23 ' A' ' 78' ' ' LEU . 1.3 mmm180 -104.91 3.72 31.15 Favored 'General case' 0 C--O 1.199 -1.591 1 O-C-N 132.227 5.955 . . . . 0.0 113.198 -179.117 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -55.13 107.91 0.86 Allowed Glycine 0 N--CA 1.426 -2.002 2 CA-C-N 106.192 -5.004 . . . . 0.0 114.896 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.527 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE 0.262 0.0 OUTLIER -96.56 148.55 22.72 Favored 'General case' 0 C--O 1.207 -1.172 0 O-C-N 128.266 2.98 . . . . 0.0 110.38 179.344 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.453 ' N ' ' CD1' ' A' ' 107' ' ' TRP . 0.1 OUTLIER -163.51 176.91 9.28 Favored 'General case' 0 C--O 1.2 -1.509 1 O-C-N 129.106 4.004 . . . . 0.0 113.423 -178.82 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.516 ' NE2' ' HE1' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -147.2 175.6 10.62 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.845 -2.434 . . . . 0.0 108.95 -179.48 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.462 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.1 OUTLIER -172.28 39.5 0.02 OUTLIER 'General case' 0 CA--C 1.499 -1.01 1 O-C-N 129.172 4.045 . . . . 0.0 117.816 179.863 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.401 HG22 HD12 ' A' ' 116' ' ' LEU 0.255 12.8 t 6.92 82.66 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.493 -1.227 0 C-N-CA 127.55 2.34 . . . . 0.0 115.009 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -84.03 32.14 0.49 Allowed 'General case' 0 CA--C 1.488 -1.419 0 N-CA-C 117.205 2.298 . . . . 0.0 117.205 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 93.56 105.52 1.77 Allowed Glycine 0 C--O 1.21 -1.399 0 N-CA-C 117.409 1.724 . . . . 0.0 117.409 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 1.4 m-20 58.04 15.93 3.48 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 118.66 2.837 . . . . 0.0 118.66 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.424 ' HD2' ' HB2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -167.58 156.35 9.66 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 129.04 3.963 . . . . 0.0 110.13 -179.634 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.401 HD12 HG22 ' A' ' 111' ' ' VAL . 0.4 OUTLIER -111.97 106.32 14.98 Favored 'General case' 0 CA--C 1.482 -1.646 0 O-C-N 128.254 3.471 . . . . 0.0 117.574 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.421 ' CD2' ' HE2' ' A' ' 115' ' ' LYS . 1.2 m-85 -66.34 99.54 0.56 Allowed 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 116.238 -2.185 . . . . 0.0 115.985 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.08 70.8 8.44 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 114.881 -2.727 . . . . 0.0 106.498 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -83.93 111.86 19.63 Favored 'General case' 0 CA--C 1.502 -0.901 0 O-C-N 127.488 2.993 . . . . 0.0 111.268 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.75 156.21 43.9 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 128.651 3.72 . . . . 0.0 110.952 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.403 HG22 ' H ' ' A' ' 123' ' ' GLY . 59.4 m -112.24 160.26 17.79 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 126.951 2.657 . . . . 0.0 105.438 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 1.9 m -146.18 25.52 1.25 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 120.411 1.46 . . . . 0.0 112.799 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.403 ' H ' HG22 ' A' ' 121' ' ' THR . . . 106.68 29.37 4.72 Favored Glycine 0 N--CA 1.437 -1.235 0 O-C-N 125.834 1.959 . . . . 0.0 114.49 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 126.39 -31.18 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 130.169 3.387 . . . . 0.0 110.996 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -79.15 81.97 5.36 Favored 'General case' 0 C--O 1.214 -0.811 0 O-C-N 128.132 3.395 . . . . 0.0 111.653 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.489 HG12 ' O ' ' A' ' 126' ' ' VAL . 39.1 t -68.34 94.13 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-N 110.068 -3.242 . . . . 0.0 111.489 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.1 m -72.75 106.12 4.6 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 116.289 -1.815 . . . . 0.0 109.884 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.9 75.98 4.19 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 128.309 3.505 . . . . 0.0 112.917 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -56.54 146.7 24.14 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 115.573 -2.156 . . . . 0.0 110.442 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.2 t -122.63 100.63 8.49 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.424 ' HB2' ' HD2' ' A' ' 115' ' ' LYS . 6.0 m-85 -75.93 176.18 8.11 Favored 'General case' 0 CA--C 1.48 -1.748 0 CA-C-N 109.753 -3.385 . . . . 0.0 116.878 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.423 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.411 0.0 OUTLIER -171.05 110.14 0.33 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 110.393 -3.094 . . . . 0.0 103.747 179.795 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.56 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 32.3 ttpt -49.58 127.78 16.28 Favored 'General case' 0 C--O 1.218 -0.576 1 O-C-N 130.149 4.655 . . . . 0.0 110.588 179.476 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 37.7 pttt . . . . . 0 CA--C 1.491 -1.322 0 O-C-N 126.903 2.627 . . . . 0.0 117.545 -179.561 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.4 mtp . . . . . 0 N--CA 1.506 2.36 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.6 -44.63 0.19 Allowed 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.029 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.489 ' HD3' ' CH2' ' A' ' 89' ' ' TRP . 1.1 ptpt -116.03 82.87 1.85 Allowed 'General case' 0 C--N 1.363 1.175 0 N-CA-C 117.84 2.533 . . . . 0.0 117.84 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.27 116.43 31.93 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 102.848 -3.019 . . . . 0.0 102.848 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -133.13 -102.41 0.26 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 115.229 -2.32 . . . . 0.0 109.331 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.3 m120 35.38 41.4 0.09 Allowed 'General case' 0 C--N 1.307 -1.272 0 O-C-N 127.957 3.286 . . . . 0.0 114.427 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -101.43 -120.09 4.61 Favored Glycine 0 C--O 1.204 -1.766 0 CA-C-O 115.524 -2.82 . . . . 0.0 112.174 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.445 ' OG1' HG23 ' A' ' 42' ' ' ILE . 2.2 m 170.13 147.93 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.664 1 O-C-N 131.14 4.67 . . . . 0.0 104.132 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.588 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -142.68 91.68 2.33 Favored 'General case' 0 C--N 1.323 -0.577 1 O-C-N 133.422 6.701 . . . . 0.0 116.937 179.935 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' A' ' 12' ' ' GLU . 10.6 mt-10 -61.66 111.87 2.01 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 116.321 -2.151 . . . . 0.0 107.945 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 37.0 ttp -61.4 74.24 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.715 0 O-C-N 127.096 2.748 . . . . 0.0 106.733 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.402 ' N ' ' O ' ' A' ' 10' ' ' GLU . 1.7 tt0 -23.67 -47.28 0.01 OUTLIER 'General case' 0 C--O 1.2 -1.502 0 O-C-N 128.285 3.491 . . . . 0.0 111.749 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.262 0.3 OUTLIER -145.08 152.2 39.72 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 109.013 -3.721 . . . . 0.0 111.573 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -116.31 104.46 11.51 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-N 109.716 -3.402 . . . . 0.0 112.976 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -50.85 31.82 Favored 'General case' 0 CA--C 1.503 -0.846 1 O-C-N 130.107 4.629 . . . . 0.0 112.364 179.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.465 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -161.05 150.34 16.78 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-O 125.239 2.447 . . . . 0.0 110.421 -179.797 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.51 ' CD1' ' N ' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -121.77 -58.15 1.76 Allowed 'General case' 0 CA--C 1.498 -1.046 0 CA-C-O 124.926 2.298 . . . . 0.0 110.02 179.706 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 19' ' ' GLY . 9.2 pt-20 -71.32 -28.55 64.17 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 113.756 -1.566 . . . . 0.0 114.537 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.465 ' N ' ' OD1' ' A' ' 16' ' ' ASN . . . -70.71 -23.27 77.95 Favored Glycine 0 N--CA 1.488 2.148 0 O-C-N 128.549 3.656 . . . . 0.0 109.374 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.422 ' CD2' HD11 ' A' ' 120' ' ' LEU . 2.7 t80 -75.38 -28.28 59.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 119.049 1.425 . . . . 0.0 108.751 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.547 ' HG2' HG21 ' A' ' 26' ' ' ILE . 21.9 mtt -76.95 -33.3 57.69 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-N 113.245 -1.798 . . . . 0.0 107.838 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.481 ' CE ' ' HA ' ' A' ' 22' ' ' LYS . 4.7 mmpt? -68.59 -30.04 68.7 Favored 'General case' 0 C--O 1.203 -1.363 0 O-C-N 128.558 3.661 . . . . 0.0 114.159 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.5 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -73.48 -39.17 65.1 Favored 'General case' 0 C--O 1.208 -1.114 2 O-C-N 130.994 5.184 . . . . 0.0 114.773 179.688 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.614 ' O ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -103.7 0.24 30.33 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 127.627 3.079 . . . . 0.0 108.314 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 40.06 98.53 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.251 1 CA-C-O 129.32 4.39 . . . . 0.0 109.804 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.547 HG21 ' HG2' ' A' ' 21' ' ' MET . 6.4 tp -127.09 -45.01 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.108 0 CA-C-N 109.637 -3.438 . . . . 0.0 113.137 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -151.07 142.91 23.83 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 119.119 -2.238 . . . . 0.0 108.849 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.515 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 7.6 m-85 -80.95 65.33 6.05 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 72.19 73.47 0.16 Allowed 'General case' 0 C--O 1.203 -1.35 0 O-C-N 127.331 2.894 . . . . 0.0 107.848 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.15 -40.96 64.44 Favored 'General case' 0 N--CA 1.479 1.023 1 CA-C-N 106.658 -4.792 . . . . 0.0 114.141 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.667 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -71.01 -120.55 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.019 1 O-C-N 130.317 4.76 . . . . 0.0 112.636 -179.827 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.23 9.5 2.14 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 129.021 3.951 . . . . 0.0 108.335 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 31' ' ' ARG . 2.7 mp -142.17 -49.51 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 111.415 -2.63 . . . . 0.0 108.175 -179.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -93.2 35.29 1.08 Allowed 'General case' 0 C--O 1.205 -1.264 0 CA-C-O 122.228 1.013 . . . . 0.0 111.877 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.504 HG13 ' CZ ' ' A' ' 17' ' ' PHE . 55.0 t -50.47 -34.95 12.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.705 0 C-N-CA 127.48 2.312 . . . . 0.0 115.897 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 153.74 122.82 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 1 O-C-N 129.394 4.184 . . . . 0.0 111.487 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.817 HD12 ' N ' ' A' ' 38' ' ' THR . 1.3 pp -106.27 -11.52 16.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 113.937 -2.935 . . . . 0.0 110.87 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.817 ' N ' HD12 ' A' ' 37' ' ' LEU . 6.3 m 145.96 98.85 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.082 1 O-C-N 134.132 7.145 . . . . 0.0 111.039 -179.694 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.96 114.78 26.99 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 127.089 2.743 . . . . 0.0 117.562 -179.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 m -106.43 112.14 25.02 Favored 'General case' 0 C--O 1.209 -1.061 1 O-C-N 130.522 4.889 . . . . 0.0 110.824 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.544 ' NZ ' HD12 ' A' ' 43' ' ' ILE . 2.4 tmtt? -105.55 119.94 40.38 Favored 'General case' 0 CA--C 1.503 -0.839 0 O-C-N 127.908 3.255 . . . . 0.0 107.593 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.572 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.7 mp -109.86 159.93 9.18 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 O-C-N 128.645 3.715 . . . . 0.0 111.625 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.572 ' N ' HG22 ' A' ' 42' ' ' ILE 0.307 1.0 OUTLIER -132.37 146.83 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-N 109.443 -3.526 . . . . 0.0 106.898 179.668 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 55.8 t -156.88 113.66 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.204 -1.34 0 O-C-N 126.389 2.305 . . . . 0.0 110.428 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.456 ' HG2' ' CD2' ' A' ' 50' ' ' PHE . 1.1 mt-30 -114.73 134.37 55.15 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-O 125.159 2.409 . . . . 0.0 112.88 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -130.04 40.84 3.5 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 108.445 -3.979 . . . . 0.0 110.741 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 69.0 114.76 0.02 OUTLIER Glycine 0 C--N 1.349 1.304 0 CA-C-N 112.525 -2.125 . . . . 0.0 110.646 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 73.5 -68.9 0.2 Allowed 'General case' 0 C--O 1.217 -0.612 0 O-C-N 126.796 2.115 . . . . 0.0 111.735 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -78.85 92.96 4.92 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.754 1.622 . . . . 0.0 109.934 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.697 ' CE1' HD22 ' A' ' 94' ' ' LEU . 44.8 t80 -98.18 117.59 32.89 Favored 'General case' 0 C--O 1.244 0.8 1 O-C-N 131.006 5.191 . . . . 0.0 111.259 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.6 mttm -130.35 86.76 2.42 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 128.236 3.46 . . . . 0.0 117.713 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.524 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -68.77 153.19 44.22 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 128.181 3.426 . . . . 0.0 106.725 179.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.467 ' HA ' ' CB ' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -156.33 147.1 21.89 Favored 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 128.007 3.317 . . . . 0.0 108.294 -179.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.404 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 1.0 OUTLIER -108.83 151.9 25.61 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 127.001 2.688 . . . . 0.0 107.756 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -134.79 52.51 2.04 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.62 -92.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 1 O-C-N 131.859 5.724 . . . . 0.0 110.315 179.845 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 m 148.15 -53.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.448 1 O-C-N 130.795 5.06 . . . . 0.0 102.288 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.495 ' CE2' ' HA ' ' A' ' 34' ' ' ALA . 3.0 m-85 -51.42 -58.77 5.34 Favored 'General case' 0 N--CA 1.474 0.771 1 O-C-N 130.725 5.016 . . . . 0.0 108.231 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -154.47 111.12 3.3 Favored 'General case' 0 C--N 1.364 1.232 1 CA-C-N 106.952 -4.658 . . . . 0.0 113.823 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.404 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 0.0 OUTLIER -105.39 97.84 7.62 Favored 'General case' 0 C--O 1.218 -0.566 1 O-C-N 130.565 4.916 . . . . 0.0 110.329 179.89 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.0 89.91 3.21 Favored 'General case' 0 C--N 1.318 -0.763 1 O-C-N 129.36 4.163 . . . . 0.0 105.899 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.467 ' CB ' ' HA ' ' A' ' 53' ' ' LYS . 21.8 p30 -84.11 165.19 18.7 Favored 'General case' 0 C--O 1.199 -1.579 1 O-C-N 130.688 4.993 . . . . 0.0 115.987 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.769 HD21 ' HZ2' ' A' ' 107' ' ' TRP . 10.8 tp -100.58 54.06 0.87 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 111.43 -2.623 . . . . 0.0 112.268 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -88.41 100.12 12.79 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 124.266 1.984 . . . . 0.0 112.771 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.556 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -151.0 -137.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 112.774 -2.012 . . . . 0.0 110.47 179.478 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.6 m -156.14 153.44 29.31 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.266 -1.753 . . . . 0.0 106.266 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.478 HG11 ' CD1' ' A' ' 89' ' ' TRP . 3.4 t -76.32 151.91 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.313 0 O-C-N 125.194 1.559 . . . . 0.0 113.81 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 43.64 30.21 1.44 Allowed Glycine 0 C--O 1.215 -1.08 1 O-C-N 130.663 4.977 . . . . 0.0 115.241 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.266 0.8 OUTLIER -102.54 -5.52 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 112.679 -1.761 . . . . 0.0 109.829 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 66.37 99.45 0.05 OUTLIER 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 127.138 2.774 . . . . 0.0 111.78 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.573 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 2.4 t80 -83.38 95.48 8.23 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 127.417 2.948 . . . . 0.0 118.591 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 72' ' ' ASP . 36.3 p-10 -74.21 76.33 1.8 Allowed 'General case' 0 C--O 1.202 -1.437 0 CA-C-O 123.991 1.853 . . . . 0.0 109.238 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -48.4 128.71 15.02 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 125.044 2.354 . . . . 0.0 113.747 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.32 49.66 2.28 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-O 127.067 3.318 . . . . 0.0 110.522 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.403 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 8.5 t -70.97 -172.99 0.74 Allowed 'General case' 0 C--O 1.203 -1.372 0 CA-C-N 111.161 -2.745 . . . . 0.0 110.893 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.403 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -165.77 -51.05 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 126.459 3.028 . . . . 0.0 114.262 179.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -90.72 61.56 3.09 Favored Glycine 0 N--CA 1.473 1.141 0 CA-C-N 109.352 -3.567 . . . . 0.0 112.792 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.514 ' O ' HD11 ' A' ' 24' ' ' LEU 0.268 8.4 tp 176.27 -32.43 0.0 OUTLIER 'General case' 0 C--O 1.241 0.612 0 CA-C-N 109.822 -3.189 . . . . 0.0 115.487 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.554 ' HA ' HD11 ' A' ' 24' ' ' LEU . 15.8 t0 -141.16 -53.68 0.47 Allowed 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.23 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 62.83 65.88 2.88 Favored Glycine 0 C--O 1.206 -1.623 0 CA-C-O 125.481 2.712 . . . . 0.0 111.519 -179.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -127.65 -86.82 0.58 Allowed 'General case' 0 C--N 1.364 1.211 1 CA-C-N 107.043 -4.578 . . . . 0.0 114.372 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 132.36 73.09 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.117 1 O-C-N 129.271 4.107 . . . . 0.0 108.646 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.67 178.17 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 128.281 3.488 . . . . 0.0 115.929 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -108.85 158.06 18.02 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 133.401 6.688 . . . . 0.0 107.817 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.573 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.7 m -156.1 75.47 0.89 Allowed 'General case' 0 C--O 1.199 -1.602 0 O-C-N 128.267 3.479 . . . . 0.0 111.547 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.06 146.05 44.31 Favored 'General case' 0 N--CA 1.429 -1.507 1 CA-C-N 107.243 -4.526 . . . . 0.0 109.644 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 t -131.28 148.98 32.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 C-N-CA 127.08 2.152 . . . . 0.0 107.648 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.44 ' CG2' ' N ' ' A' ' 89' ' ' TRP 0.345 0.9 OUTLIER -166.88 165.89 15.84 Favored 'General case' 0 CA--C 1.473 -2.007 0 CA-C-O 125.893 2.759 . . . . 0.0 112.414 -179.712 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.618 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 38.4 m95 -96.3 113.73 25.34 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-O 113.472 -3.156 . . . . 0.0 109.284 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.702 ' CB ' HG23 ' A' ' 93' ' ' THR . 4.9 tp10 -73.74 -45.87 49.37 Favored 'General case' 0 CA--C 1.477 -1.858 1 CA-C-O 131.861 5.601 . . . . 0.0 112.784 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.78 -46.36 0.15 Allowed Glycine 0 CA--C 1.542 1.775 0 CA-C-N 108.692 -3.867 . . . . 0.0 104.94 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -144.16 57.44 1.33 Allowed 'General case' 0 N--CA 1.427 -1.622 0 O-C-N 128.121 2.895 . . . . 0.0 111.268 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.702 HG23 ' CB ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER 170.83 151.93 0.05 OUTLIER 'General case' 0 C--O 1.202 -1.412 0 CA-C-N 108.537 -3.938 . . . . 0.0 117.688 179.475 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.697 HD22 ' CE1' ' A' ' 50' ' ' PHE . 0.4 OUTLIER -85.21 3.9 37.14 Favored 'General case' 0 CA--C 1.476 -1.873 1 O-C-N 131.548 5.53 . . . . 0.0 119.637 -178.941 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.481 HG12 ' O ' ' A' ' 95' ' ' VAL 0.435 27.4 t -3.45 117.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -131.14 149.11 52.74 Favored 'General case' 0 C--O 1.201 -1.494 0 CA-C-O 123.538 1.637 . . . . 0.0 109.019 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.6 122.35 54.96 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.597 0 CA-C-N 111.854 -2.43 . . . . 0.0 117.369 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.457 ' CG ' ' HB3' ' A' ' 105' ' ' ARG . 1.2 tt0 -90.22 117.54 29.04 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 120.821 -1.174 . . . . 0.0 108.295 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.0 tppt? -47.94 -36.19 12.01 Favored 'General case' 0 N--CA 1.486 1.341 1 O-C-N 129.476 4.235 . . . . 0.0 108.659 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 65.91 -83.22 0.09 OUTLIER Glycine 0 C--O 1.199 -2.063 0 CA-C-N 112.543 -2.117 . . . . 0.0 113.269 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 91.31 35.32 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.052 1 CA-C-N 107.177 -4.511 . . . . 0.0 110.477 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.574 ' CD ' ' HG2' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 169.69 -42.79 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 110.952 -2.84 . . . . 0.0 113.556 -179.881 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.574 ' HG2' ' CD ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -129.38 151.56 49.88 Favored 'General case' 0 N--CA 1.433 -1.321 0 O-C-N 127.096 2.747 . . . . 0.0 115.236 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -82.82 103.06 12.02 Favored 'General case' 0 N--CA 1.491 1.59 1 O-C-N 132.271 5.982 . . . . 0.0 101.888 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.616 ' NH2' HD13 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -118.96 28.02 8.53 Favored 'General case' 0 C--N 1.31 -1.126 1 O-C-N 130.57 4.919 . . . . 0.0 110.562 -178.88 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -93.7 131.05 10.58 Favored Glycine 0 N--CA 1.427 -1.936 1 CA-C-N 106.583 -4.826 . . . . 0.0 112.703 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.769 ' HZ2' HD21 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -111.78 147.01 36.58 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 129.133 3.49 . . . . 0.0 107.047 177.383 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.464 ' HB2' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -138.97 -176.16 4.4 Favored 'General case' 0 C--O 1.215 -0.721 1 O-C-N 129.724 4.39 . . . . 0.0 111.111 -179.102 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.678 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -156.18 115.61 3.54 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 115.308 -2.557 . . . . 0.0 111.119 -176.168 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.52 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -132.7 124.26 27.85 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 117.422 2.379 . . . . 0.0 117.422 179.506 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 42.3 t -59.5 103.98 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.819 0 CA-C-O 123.718 1.723 . . . . 0.0 112.497 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -101.21 40.34 1.3 Allowed 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 112.239 -2.255 . . . . 0.0 114.406 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.85 -112.7 3.7 Favored Glycine 0 N--CA 1.437 -1.271 0 CA-C-N 111.789 -2.46 . . . . 0.0 115.036 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -68.15 -49.51 60.51 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 116.403 2.001 . . . . 0.0 116.403 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.484 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.1 OUTLIER -98.27 -179.08 4.25 Favored 'General case' 0 C--O 1.22 -0.48 0 O-C-N 128.963 3.915 . . . . 0.0 107.568 -179.712 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.422 ' HG ' ' N ' ' A' ' 117' ' ' TYR . 0.1 OUTLIER -143.73 136.72 27.54 Favored 'General case' 0 C--O 1.202 -1.41 0 CA-C-N 113.22 -1.809 . . . . 0.0 111.503 179.722 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.52 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 10.1 m-85 -81.76 163.77 22.17 Favored 'General case' 0 C--O 1.208 -1.115 0 C-N-CA 115.538 -2.465 . . . . 0.0 114.133 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.564 ' O ' HD23 ' A' ' 118' ' ' LEU . 2.2 tt -130.34 21.0 5.23 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 128.264 3.477 . . . . 0.0 106.804 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -28.58 125.55 0.1 Allowed 'General case' 0 N--CA 1.48 1.053 1 O-C-N 131.372 5.42 . . . . 0.0 109.922 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.616 HD13 ' NH2' ' A' ' 105' ' ' ARG . 0.2 OUTLIER -143.78 155.8 44.28 Favored 'General case' 0 CA--C 1.488 -1.406 0 C-N-CA 116.012 -2.275 . . . . 0.0 110.518 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.546 ' O ' HD12 ' A' ' 120' ' ' LEU . 23.5 m -114.82 158.8 21.42 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.358 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.5 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -157.66 49.6 0.42 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 126.379 2.99 . . . . 0.0 113.612 -179.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.426 ' CA ' ' HB2' ' A' ' 103' ' ' GLU . . . 93.09 -100.95 2.72 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 112.968 -1.923 . . . . 0.0 108.699 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.92 -59.93 2.49 Favored 'General case' 0 CA--C 1.493 -1.232 0 CA-C-N 111.665 -2.267 . . . . 0.0 112.236 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -73.59 174.87 7.68 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 128.031 3.332 . . . . 0.0 108.963 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.1 t -150.35 71.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.821 2 O-C-N 131.307 5.38 . . . . 0.0 113.219 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 114.63 1.45 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 116.337 -1.792 . . . . 0.0 110.696 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.12 79.89 1.66 Allowed 'General case' 0 CA--C 1.497 -1.063 0 O-C-N 128.608 3.693 . . . . 0.0 114.171 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -56.13 129.59 40.7 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.277 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.25 0.4 OUTLIER -110.12 136.92 44.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 123.905 1.812 . . . . 0.0 108.753 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.497 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 67.4 m-85 -128.09 168.23 15.65 Favored 'General case' 0 CA--C 1.489 -1.393 0 CA-C-N 111.111 -2.768 . . . . 0.0 116.92 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.484 ' HA ' ' HB3' ' A' ' 115' ' ' LYS 0.354 0.0 OUTLIER -143.61 30.13 1.37 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 116.234 -1.841 . . . . 0.0 108.813 179.881 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.588 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 62.2 176.65 0.13 Allowed 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 117.449 -1.7 . . . . 0.0 111.42 -179.43 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.448 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.259 1.594 0 CA-C-O 116.224 -1.846 . . . . 0.0 114.963 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.201 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.503 ' CG2' ' HB3' ' A' ' 92' ' ' ASN . 0.7 OUTLIER -127.62 -60.29 1.18 Allowed 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 127.265 2.853 . . . . 0.0 106.108 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.34 166.9 11.16 Favored 'General case' 0 CA--C 1.497 -1.083 0 CA-C-N 113.29 -1.777 . . . . 0.0 113.237 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 63.5 t0 67.53 84.54 0.15 Allowed 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 102.709 -3.071 . . . . 0.0 102.709 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -116.31 46.36 1.6 Allowed 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 44' ' ' VAL . 5.1 t-20 -34.13 137.5 0.11 Allowed 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 126.172 2.17 . . . . 0.0 113.976 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 160.26 -163.53 33.94 Favored Glycine 0 C--O 1.218 -0.887 0 CA-C-O 115.271 -2.961 . . . . 0.0 112.463 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.477 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -136.91 144.47 43.5 Favored 'General case' 0 C--O 1.202 -1.434 1 O-C-N 132.725 5.603 . . . . 0.0 103.688 -179.828 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.554 ' CE3' ' HA ' ' A' ' 133' ' ' LYS 0.283 0.0 OUTLIER -141.56 137.16 31.77 Favored 'General case' 0 CA--C 1.496 -1.119 1 O-C-N 131.832 5.708 . . . . 0.0 112.891 -179.191 . . . . . . . . 5 4 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' O ' ' N ' ' A' ' 12' ' ' GLU . 9.5 mm-40 -81.5 5.12 18.82 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 125.52 1.763 . . . . 0.0 115.551 -179.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.0 ttp 58.61 -91.01 0.03 OUTLIER 'General case' 0 C--O 1.246 0.919 0 CA-C-O 111.955 -3.879 . . . . 0.0 104.134 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.416 ' N ' ' O ' ' A' ' 10' ' ' GLU . 26.8 tt0 119.54 -45.56 0.01 OUTLIER 'General case' 0 C--N 1.313 -0.985 1 O-C-N 129.495 4.247 . . . . 0.0 110.106 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.96 155.84 5.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.479 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.84 169.89 12.77 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 110.563 -3.017 . . . . 0.0 111.882 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.405 ' HB3' ' O ' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -121.93 124.96 45.3 Favored 'General case' 0 CA--C 1.507 -0.678 0 O-C-N 128.812 3.82 . . . . 0.0 113.118 179.923 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.9 t30 46.35 84.5 0.03 OUTLIER 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 124.051 1.881 . . . . 0.0 112.645 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -92.12 -30.56 15.91 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-N 112.769 -2.014 . . . . 0.0 112.871 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.468 ' HG3' ' CZ ' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -71.24 -56.78 5.35 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.064 -2.398 . . . . 0.0 112.608 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.448 ' HA2' ' HB2' ' A' ' 22' ' ' LYS . . . -53.87 -23.59 23.25 Favored Glycine 0 CA--C 1.489 -1.57 1 O-C-N 132.276 5.985 . . . . 0.0 113.252 -179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.87 -49.58 19.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 126.843 3.211 . . . . 0.0 108.128 179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.468 ' O ' HG22 ' A' ' 26' ' ' ILE . 19.7 mmm -68.77 -20.54 64.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 119.73 -1.856 . . . . 0.0 112.345 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.448 ' HB2' ' HA2' ' A' ' 19' ' ' GLY . 0.2 OUTLIER -79.8 -22.77 42.69 Favored 'General case' 0 C--O 1.207 -1.151 0 O-C-N 127.55 3.031 . . . . 0.0 110.341 179.754 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -37.33 63.71 Favored 'General case' 0 C--O 1.207 -1.177 1 O-C-N 131.745 5.653 . . . . 0.0 112.806 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.84 9.36 40.78 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 128.446 3.591 . . . . 0.0 108.802 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 32.53 66.94 0.17 Allowed 'General case' 0 CA--C 1.482 -1.647 0 CA-C-O 127.008 3.29 . . . . 0.0 113.348 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.666 HD12 ' O ' ' A' ' 78' ' ' LEU . 10.7 tt -87.5 -31.48 5.91 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-O 126.685 3.136 . . . . 0.0 112.355 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.05 -176.55 0.25 Allowed 'General case' 0 C--N 1.36 1.044 0 CA-C-N 112.72 -2.036 . . . . 0.0 112.832 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.445 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 26.4 m-85 -125.0 35.73 4.73 Favored 'General case' 0 CA--C 1.501 -0.915 0 O-C-N 126.517 2.386 . . . . 0.0 111.127 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -166.52 177.36 6.71 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 128.258 3.474 . . . . 0.0 106.736 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.602 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.8 OUTLIER 76.97 -62.46 0.4 Allowed 'General case' 0 C--O 1.214 -0.807 0 O-C-N 128.747 3.78 . . . . 0.0 111.423 -179.564 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.468 ' CZ ' ' HG3' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -38.4 -19.74 0.01 OUTLIER 'General case' 0 C--O 1.243 0.755 1 O-C-N 130.735 5.022 . . . . 0.0 113.079 -179.86 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -86.81 -32.4 20.34 Favored 'General case' 0 C--O 1.203 -1.378 0 O-C-N 127.668 3.105 . . . . 0.0 111.906 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 30' ' ' THR . 0.2 OUTLIER -111.42 36.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.102 0 O-C-N 128.665 3.728 . . . . 0.0 115.071 -179.586 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.26 23.25 11.95 Favored 'General case' 0 C--O 1.201 -1.491 0 CA-C-O 126.081 2.848 . . . . 0.0 108.568 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.431 ' O ' ' CE1' ' A' ' 58' ' ' PHE . 0.2 OUTLIER -62.96 178.74 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 108.785 -3.825 . . . . 0.0 106.65 176.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.412 ' HD2' ' HA ' ' A' ' 36' ' ' ARG . 4.2 mpt_? -49.04 -30.39 6.19 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 127.584 3.052 . . . . 0.0 112.254 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.863 HD21 ' HB3' ' A' ' 58' ' ' PHE . 3.8 pp 29.84 108.48 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.977 2 O-C-N 134.822 7.576 . . . . 0.0 113.479 177.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.6 m 57.17 42.95 24.77 Favored 'General case' 0 CA--C 1.479 -1.767 0 CA-C-N 110.793 -2.912 . . . . 0.0 118.333 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.512 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.3 OUTLIER -159.34 -97.59 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.517 ' CG2' ' N ' ' A' ' 41' ' ' LYS . 1.3 m 172.56 159.15 0.11 Allowed 'General case' 0 C--O 1.199 -1.566 0 O-C-N 128.842 3.839 . . . . 0.0 112.387 -175.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.517 ' N ' ' CG2' ' A' ' 40' ' ' THR . 0.0 OUTLIER -111.98 158.21 19.79 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 101.708 -3.441 . . . . 0.0 101.708 178.43 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.783 HD11 ' HB2' ' A' ' 55' ' ' ASN . 2.1 mp -134.32 156.85 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 119.912 1.233 . . . . 0.0 111.587 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.556 ' N ' HG22 ' A' ' 42' ' ' ILE . 5.3 tt -132.31 135.74 57.49 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.48 0 CA-C-N 111.248 -2.705 . . . . 0.0 107.828 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.693 HG12 ' N ' ' A' ' 45' ' ' GLN . 2.3 t -110.49 -64.97 1.57 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 N-CA-C 116.323 1.971 . . . . 0.0 116.323 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.693 ' N ' HG12 ' A' ' 44' ' ' VAL . 1.7 tm0? 65.32 140.24 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 125.851 2.739 . . . . 0.0 112.071 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -165.6 71.93 0.16 Allowed 'General case' 0 C--N 1.363 1.189 0 CA-C-N 110.244 -3.162 . . . . 0.0 114.007 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.06 -89.07 1.5 Allowed Glycine 0 C--O 1.216 -1.025 0 CA-C-O 122.893 1.274 . . . . 0.0 110.793 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -108.76 -44.47 4.02 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 109.586 -3.307 . . . . 0.0 110.788 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.16 95.49 0.13 Allowed 'General case' 0 C--N 1.357 0.904 0 O-C-N 127.269 2.856 . . . . 0.0 109.172 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.631 ' CD2' HD22 ' A' ' 94' ' ' LEU . 42.5 t80 -95.91 95.75 8.46 Favored 'General case' 0 CA--C 1.496 -1.134 1 O-C-N 129.539 4.274 . . . . 0.0 113.021 -179.933 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.442 ' HG2' ' HA ' ' A' ' 64' ' ' ASP . 43.7 mttt -105.65 165.63 11.03 Favored 'General case' 0 CA--C 1.491 -1.297 0 O-C-N 128.789 3.806 . . . . 0.0 113.84 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.54 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -148.61 111.35 4.79 Favored 'General case' 0 CA--C 1.499 -0.997 1 O-C-N 131.047 5.217 . . . . 0.0 107.797 179.713 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.57 153.17 42.55 Favored 'General case' 0 C--O 1.208 -1.128 0 C-N-CA 117.666 -1.614 . . . . 0.0 111.289 -179.468 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -104.6 157.67 17.02 Favored 'General case' 0 C--N 1.313 -0.979 0 O-C-N 125.878 1.986 . . . . 0.0 111.073 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.783 ' HB2' HD11 ' A' ' 42' ' ' ILE . 1.7 t-20 -107.82 -18.58 13.78 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-O 113.824 -2.989 . . . . 0.0 115.233 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.475 ' HA ' ' HB3' ' A' ' 39' ' ' GLN . 16.5 p -16.85 152.22 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.181 1 O-C-N 135.703 8.127 . . . . 0.0 113.566 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.84 -33.19 57.94 Favored 'General case' 0 CA--C 1.504 -0.819 1 CA-C-N 107.588 -4.369 . . . . 0.0 109.038 179.519 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.863 ' HB3' HD21 ' A' ' 37' ' ' LEU . 5.8 p90 -68.14 -53.31 26.1 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 126.938 2.648 . . . . 0.0 114.438 -179.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -172.47 130.81 0.57 Allowed 'General case' 0 N--CA 1.47 0.548 0 O-C-N 127.985 3.303 . . . . 0.0 110.183 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 90.64 5.81 Favored 'General case' 0 C--O 1.204 -1.318 0 O-C-N 127.604 3.065 . . . . 0.0 113.409 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.58 141.68 37.46 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 109.083 -3.689 . . . . 0.0 109.047 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.91 161.52 14.38 Favored 'General case' 0 C--O 1.212 -0.904 0 O-C-N 126.877 2.611 . . . . 0.0 116.095 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.54 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 11.1 tp -109.99 62.22 0.6 Allowed 'General case' 0 C--O 1.214 -0.781 0 O-C-N 129.096 3.997 . . . . 0.0 110.753 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.442 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 7.2 p-10 -71.11 93.99 1.09 Allowed 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 112.568 -2.106 . . . . 0.0 111.141 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.675 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -127.85 169.36 13.99 Favored 'General case' 0 CA--C 1.494 -1.181 0 CA-C-O 126.686 3.136 . . . . 0.0 109.31 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.63 HG22 ' HB ' ' A' ' 69' ' ' VAL . 0.6 OUTLIER -147.97 172.82 13.61 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 110.302 -3.135 . . . . 0.0 106.972 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.447 HG12 ' N ' ' A' ' 68' ' ' GLY . 21.3 t -87.59 142.82 12.44 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.463 0 O-C-N 126.459 2.35 . . . . 0.0 115.664 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 67' ' ' VAL . . . 37.78 33.55 0.14 Allowed Glycine 0 C--N 1.342 0.894 1 O-C-N 129.806 4.441 . . . . 0.0 116.721 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.63 ' HB ' HG22 ' A' ' 66' ' ' THR . 13.4 p -81.24 -14.22 12.6 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.941 0 C-N-CA 117.797 -1.561 . . . . 0.0 108.459 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 72' ' ' ASP . 24.6 tt0 58.31 75.77 0.37 Allowed 'General case' 0 C--N 1.355 0.815 0 O-C-N 128.692 3.745 . . . . 0.0 109.361 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.569 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.2 OUTLIER -62.11 81.13 0.02 OUTLIER 'General case' 0 C--N 1.345 0.409 1 O-C-N 131.983 5.802 . . . . 0.0 111.039 179.769 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 70' ' ' GLU . 24.3 t70 -60.27 76.74 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.427 ' HG2' ' CA ' ' A' ' 83' ' ' VAL 0.272 32.6 mt-10 57.45 111.48 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.207 0 O-C-N 125.823 1.952 . . . . 0.0 113.698 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.525 ' CE1' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER 176.2 69.17 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 108.667 -3.879 . . . . 0.0 111.923 179.558 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 82.4 p -99.26 -27.97 13.54 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 110.318 -3.128 . . . . 0.0 115.675 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.525 ' HE2' ' CE1' ' A' ' 74' ' ' HIS . 0.1 OUTLIER -35.92 153.94 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 1 O-C-N 130.049 4.593 . . . . 0.0 114.772 -179.819 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.6 24.12 Favored Glycine 0 C--O 1.218 -0.89 0 CA-C-N 111.218 -2.719 . . . . 0.0 110.664 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.666 ' O ' HD12 ' A' ' 26' ' ' ILE . 10.8 tp -163.73 -47.75 0.03 OUTLIER 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 126.963 3.268 . . . . 0.0 112.505 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.79 -67.04 1.03 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 110.562 -3.017 . . . . 0.0 113.24 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.98 69.93 1.16 Allowed Glycine 0 C--O 1.209 -1.44 0 CA-C-O 125.727 2.848 . . . . 0.0 110.842 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.521 ' NE ' ' HA ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -114.47 -156.04 0.59 Allowed 'General case' 0 N--CA 1.49 1.567 1 CA-C-N 107.399 -4.4 . . . . 0.0 107.944 -179.585 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.415 ' CG ' ' HB3' ' A' ' 73' ' ' GLU . 0.3 OUTLIER -174.52 82.21 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 127.544 3.027 . . . . 0.0 108.118 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.438 HG13 ' HA3' ' A' ' 100' ' ' GLY . 2.3 t -138.09 153.54 27.16 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 N-CA-C 118.17 2.655 . . . . 0.0 118.17 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -55.97 147.05 20.59 Favored 'General case' 0 C--O 1.239 0.524 1 O-C-N 129.592 4.307 . . . . 0.0 106.334 179.448 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.569 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 2.1 m -152.83 70.79 0.9 Allowed 'General case' 0 C--O 1.199 -1.553 1 O-C-N 130.589 4.931 . . . . 0.0 112.066 -179.161 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 70' ' ' GLU . 2.0 tp -70.65 140.88 51.67 Favored 'General case' 0 C--O 1.209 -1.039 1 CA-C-N 107.114 -4.585 . . . . 0.0 115.298 -179.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.532 HG12 HD11 ' A' ' 94' ' ' LEU . 2.2 t -116.79 142.31 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 111.728 -2.487 . . . . 0.0 107.012 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.253 16.4 m -159.1 161.82 36.45 Favored 'General case' 0 CA--C 1.48 -1.75 0 O-C-N 126.175 2.172 . . . . 0.0 111.499 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.663 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 33.5 m95 -98.87 143.97 28.6 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 128.309 2.644 . . . . 0.0 107.957 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.686 ' HB3' HG22 ' A' ' 93' ' ' THR . 9.7 tp10 -99.46 -30.78 11.98 Favored 'General case' 0 C--O 1.195 -1.794 1 CA-C-O 128.521 4.01 . . . . 0.0 112.09 179.845 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 158.44 -40.25 0.51 Allowed Glycine 0 C--O 1.21 -1.371 1 N-CA-C 102.751 -4.14 . . . . 0.0 102.751 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.503 ' HB3' ' CG2' ' A' ' 2' ' ' THR . 10.7 p-10 -149.54 31.04 0.74 Allowed 'General case' 0 C--O 1.211 -0.953 1 O-C-N 131.767 5.04 . . . . 0.0 111.579 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.686 HG22 ' HB3' ' A' ' 90' ' ' GLU . 5.5 t -167.74 149.67 5.59 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 117.672 2.471 . . . . 0.0 117.672 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.631 HD22 ' CD2' ' A' ' 50' ' ' PHE . 1.6 tp -85.81 87.24 7.38 Favored 'General case' 0 CA--C 1.495 -1.137 0 N-CA-C 118.036 2.606 . . . . 0.0 118.036 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.556 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.335 53.4 t -81.79 120.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.361 1.101 0 O-C-N 128.006 3.317 . . . . 0.0 112.451 179.712 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.524 ' HB2' ' CZ3' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -143.07 143.69 31.96 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 126.79 3.185 . . . . 0.0 108.916 -179.516 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.9 m -133.55 144.08 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 108.459 -3.973 . . . . 0.0 117.813 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.57 101.03 12.58 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 110.692 -2.958 . . . . 0.0 106.959 178.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -92.31 96.11 10.09 Favored 'General case' 0 CA--C 1.496 -1.101 0 C-N-CA 114.449 -2.9 . . . . 0.0 114.229 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.438 ' HA3' HG13 ' A' ' 83' ' ' VAL . . . 138.86 160.49 8.4 Favored Glycine 0 C--N 1.348 1.218 1 CA-C-O 128.055 4.142 . . . . 0.0 114.267 179.137 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.16 178.19 0.06 Allowed 'General case' 0 CA--C 1.499 -1.016 1 CA-C-N 106.631 -4.785 . . . . 0.0 108.553 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.86 -68.35 0.2 Allowed 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 117.218 2.303 . . . . 0.0 117.218 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -56.31 158.87 3.9 Favored 'General case' 0 C--O 1.2 -1.511 0 CA-C-N 111.253 -2.703 . . . . 0.0 116.671 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.82 105.98 11.23 Favored 'General case' 0 N--CA 1.492 1.637 2 O-C-N 130.094 4.621 . . . . 0.0 102.493 179.719 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 122' ' ' CYS . 19.5 mmm-85 -108.05 31.78 5.26 Favored 'General case' 0 C--N 1.32 -0.68 1 O-C-N 130.308 4.755 . . . . 0.0 112.272 -179.68 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -62.77 83.78 0.04 OUTLIER Glycine 0 N--CA 1.428 -1.848 2 O-C-N 131.209 5.318 . . . . 0.0 113.564 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.675 ' CH2' ' CE2' ' A' ' 65' ' ' PHE 0.283 0.0 OUTLIER -99.44 128.38 45.55 Favored 'General case' 0 C--N 1.319 -0.728 1 O-C-N 131.817 5.069 . . . . 0.0 109.962 179.721 . . . . . . . . 5 4 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.529 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 0.8 OUTLIER -160.92 150.13 16.83 Favored 'General case' 0 CA--C 1.508 -0.647 1 O-C-N 130.074 4.609 . . . . 0.0 117.052 -177.007 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.444 HE22 HD23 ' A' ' 118' ' ' LEU . 28.0 mm-40 -106.42 179.01 4.39 Favored 'General case' 0 C--N 1.359 0.984 0 CA-C-O 113.497 -3.144 . . . . 0.0 109.648 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.529 ' CH2' ' HG3' ' A' ' 108' ' ' LYS . 0.7 OUTLIER 173.37 82.69 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.279 1 O-C-N 131.726 5.641 . . . . 0.0 117.71 178.526 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 80.6 t -45.57 102.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.761 0 CA-C-O 127.973 3.749 . . . . 0.0 116.239 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -85.31 20.28 2.04 Favored 'General case' 0 N--CA 1.484 1.238 1 CA-C-N 108.345 -4.025 . . . . 0.0 116.042 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.49 -101.28 0.33 Allowed Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.148 1.219 . . . . 0.0 116.148 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.53 12.69 25.88 Favored 'General case' 0 C--O 1.207 -1.137 0 N-CA-C 118.302 2.705 . . . . 0.0 118.302 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.417 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 0.7 OUTLIER -143.7 172.89 12.2 Favored 'General case' 0 C--N 1.32 -0.705 2 O-C-N 132.192 5.933 . . . . 0.0 109.388 179.837 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.737 ' O ' HD23 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -138.78 121.05 15.88 Favored 'General case' 0 CA--C 1.48 -1.74 1 O-C-N 129.88 4.487 . . . . 0.0 111.713 179.942 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.484 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 4.7 m-85 -76.83 158.51 30.77 Favored 'General case' 0 C--O 1.213 -0.857 0 C-N-CA 115.888 -2.325 . . . . 0.0 116.097 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.511 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -137.95 46.49 2.07 Favored 'General case' 0 C--N 1.349 0.572 2 O-C-N 130.039 4.587 . . . . 0.0 108.261 179.789 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -62.03 157.32 19.07 Favored 'General case' 0 CA--C 1.506 -0.739 0 C-N-CA 127.067 2.147 . . . . 0.0 109.338 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.81 177.08 5.93 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 116.735 -1.986 . . . . 0.0 111.305 179.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 47.7 m -135.8 155.71 49.93 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 105' ' ' ARG . 0.2 OUTLIER -159.05 72.28 0.55 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 126.01 2.814 . . . . 0.0 114.155 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 66.27 58.15 9.24 Favored Glycine 0 CA--C 1.532 1.131 0 CA-C-N 112.039 -2.346 . . . . 0.0 111.273 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 62.98 52.6 2.55 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 126.523 1.929 . . . . 0.0 109.594 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -137.46 26.23 2.86 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-N 111.684 -2.507 . . . . 0.0 109.191 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 126' ' ' VAL . 89.6 t -18.63 86.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.963 1 O-C-N 129.688 4.367 . . . . 0.0 111.653 179.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.42 150.78 31.2 Favored 'General case' 0 CA--C 1.49 -1.357 0 CA-C-N 111.936 -2.393 . . . . 0.0 112.843 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 3.9 ttp85 -124.71 151.13 45.41 Favored 'General case' 0 C--N 1.353 0.749 0 CA-C-N 113.223 -1.808 . . . . 0.0 111.333 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -136.95 166.31 23.95 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 127.015 2.697 . . . . 0.0 114.862 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 3.3 t -150.94 143.26 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 CA-C-O 128.117 3.818 . . . . 0.0 105.99 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.511 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 29.6 m-85 -137.34 -175.83 4.19 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-N 108.988 -3.733 . . . . 0.0 114.48 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -168.77 122.74 0.85 Allowed 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 178.767 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.554 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 35.7 ttpt -50.54 95.55 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 112.467 -2.152 . . . . 0.0 116.013 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt . . . . . 0 C--O 1.259 1.556 0 O-C-N 126.789 2.556 . . . . 0.0 116.499 179.604 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 mtm . . . . . 0 N--CA 1.499 1.98 0 CA-C-O 121.32 0.581 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.62 141.82 2.98 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.457 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm 45.16 76.04 0.1 Allowed 'General case' 0 CA--C 1.493 -1.22 0 O-C-N 127.899 3.249 . . . . 0.0 118.654 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.405 ' HA ' ' CG2' ' A' ' 111' ' ' VAL . 22.9 m-20 53.1 -104.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -170.22 -146.96 0.05 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 114.96 -2.447 . . . . 0.0 105.888 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -170.77 104.94 0.25 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 130.513 3.525 . . . . 0.0 113.242 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -179.81 -117.43 0.55 Allowed Glycine 0 C--O 1.201 -1.953 0 CA-C-O 116.844 -2.087 . . . . 0.0 113.725 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 40' ' ' THR . 30.8 m -167.69 145.61 4.55 Favored 'General case' 0 C--O 1.216 -0.664 1 O-C-N 130.26 4.153 . . . . 0.0 108.439 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.778 ' CZ2' HD12 ' A' ' 116' ' ' LEU 0.287 0.0 OUTLIER -132.65 125.27 29.97 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 128.441 3.588 . . . . 0.0 112.489 -179.785 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -75.37 -4.06 37.2 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 127.16 2.787 . . . . 0.0 115.004 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.531 ' HG3' ' CE1' ' A' ' 131' ' ' PHE 0.27 16.0 ttm 57.86 62.0 2.22 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 116.209 -1.853 . . . . 0.0 107.266 179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -34.91 -34.7 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 127.766 3.166 . . . . 0.0 111.842 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.29 0.2 OUTLIER -151.39 154.67 37.11 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-O 124.889 2.281 . . . . 0.0 112.254 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -129.92 125.2 34.95 Favored 'General case' 0 CA--C 1.503 -0.864 1 CA-C-N 107.629 -4.351 . . . . 0.0 116.695 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.416 ' HB3' ' HB3' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -112.34 122.88 48.98 Favored 'General case' 0 CA--C 1.501 -0.918 1 O-C-N 132.042 5.839 . . . . 0.0 113.892 179.934 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 60.5 t30 49.99 84.64 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.191 0 CA-C-O 124.024 1.868 . . . . 0.0 114.323 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.62 -37.58 9.08 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-O 125.725 2.679 . . . . 0.0 111.88 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.255 28.9 tt0 -79.24 -36.25 40.25 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 110.708 -2.951 . . . . 0.0 113.032 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.05 -22.92 76.15 Favored Glycine 0 CA--C 1.486 -1.775 0 O-C-N 128.914 3.884 . . . . 0.0 112.286 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -29.75 65.94 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 123.274 1.511 . . . . 0.0 108.899 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.43 -29.99 57.23 Favored 'General case' 0 CA--C 1.49 -1.338 0 C-N-CA 116.616 -2.034 . . . . 0.0 110.648 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -75.6 -29.76 59.37 Favored 'General case' 0 C--N 1.313 -0.981 0 O-C-N 128.089 3.368 . . . . 0.0 111.25 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.502 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -58.19 -48.71 79.47 Favored 'General case' 0 C--N 1.315 -0.91 1 O-C-N 129.979 4.549 . . . . 0.0 114.485 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 79' ' ' ASP . 1.0 OUTLIER -90.15 -12.33 38.54 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 110.262 -3.154 . . . . 0.0 108.789 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.424 ' N ' ' HG ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER 53.27 104.83 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 O-C-N 128.279 3.487 . . . . 0.0 107.387 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 9.6 tt -112.17 -43.05 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 CA-C-N 110.656 -2.975 . . . . 0.0 109.18 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -170.09 33.69 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 O-C-N 118.489 -2.632 . . . . 0.0 112.844 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.463 ' CD1' ' N ' ' A' ' 28' ' ' PHE . 0.2 OUTLIER 36.16 76.44 0.05 OUTLIER 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 116.821 2.156 . . . . 0.0 116.821 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 76.83 63.06 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 124.96 2.314 . . . . 0.0 106.29 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -63.69 -43.28 97.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 108.531 -3.941 . . . . 0.0 109.763 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.503 ' HB3' ' HB3' ' A' ' 34' ' ' ALA 0.272 0.0 OUTLIER -74.69 -105.19 0.01 OUTLIER 'General case' 0 C--O 1.246 0.874 2 O-C-N 130.655 4.972 . . . . 0.0 110.527 179.88 . . . . . . . . 5 4 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 31' ' ' ARG . 29.9 tttm 86.77 -3.19 0.67 Allowed 'General case' 0 C--O 1.203 -1.376 0 O-C-N 128.223 3.452 . . . . 0.0 110.07 -178.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.602 ' N ' HD13 ' A' ' 33' ' ' ILE . 0.1 OUTLIER -155.42 31.16 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.698 0 O-C-N 127.059 2.725 . . . . 0.0 108.588 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.503 ' HB3' ' HB3' ' A' ' 31' ' ' ARG . . . -138.86 24.09 2.6 Favored 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 112.864 -1.971 . . . . 0.0 110.151 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 t -44.85 -37.37 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.168 0 CA-C-O 125.276 2.465 . . . . 0.0 109.497 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.967 ' C ' HD13 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 177.89 168.85 0.72 Allowed 'General case' 0 C--O 1.216 -0.702 1 CA-C-N 106.568 -4.833 . . . . 0.0 111.081 178.814 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.967 HD13 ' C ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -150.64 -103.98 0.06 Allowed 'General case' 0 C--N 1.316 -0.89 2 O-C-N 132.1 5.875 . . . . 0.0 107.662 -176.922 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.494 ' O ' HG22 ' A' ' 38' ' ' THR . 35.0 m -130.15 38.65 3.76 Favored 'General case' 0 CA--C 1.488 -1.429 0 O-C-N 127.633 3.083 . . . . 0.0 111.991 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -47.2 150.28 0.86 Allowed 'General case' 0 N--CA 1.481 1.076 0 O-C-N 120.236 -1.54 . . . . 0.0 115.066 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.513 ' CG2' ' CG2' ' A' ' 8' ' ' THR . 22.1 m -168.88 108.09 0.46 Allowed 'General case' 0 C--O 1.216 -0.702 1 O-C-N 130.904 5.128 . . . . 0.0 114.33 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.463 ' HD3' ' N ' ' A' ' 42' ' ' ILE . 3.7 tmtt? -94.13 144.34 25.58 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 127.482 2.989 . . . . 0.0 107.166 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.569 HD12 ' O ' ' A' ' 53' ' ' LYS . 4.2 mt -124.9 161.67 28.28 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.327 0 O-C-N 126.449 2.343 . . . . 0.0 110.622 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.528 ' N ' HG22 ' A' ' 42' ' ' ILE . 12.7 tt -139.26 130.61 34.37 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.508 0 CA-C-N 110.419 -3.082 . . . . 0.0 107.517 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.0 t -106.94 -61.14 2.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 CA-C-O 115.538 -2.172 . . . . 0.0 112.117 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 50.5 130.08 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.265 0 CA-C-O 126.64 3.114 . . . . 0.0 115.946 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -163.95 32.46 0.08 Allowed 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 109.434 -3.53 . . . . 0.0 112.913 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 114.92 -118.67 4.4 Favored Glycine 0 C--N 1.345 1.04 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -79.57 -31.01 41.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 118.073 -1.451 . . . . 0.0 112.69 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -105.45 91.51 3.8 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.729 2.811 . . . . 0.0 108.755 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.495 ' CD1' ' C ' ' A' ' 50' ' ' PHE . 14.7 t80 -103.55 137.6 41.4 Favored 'General case' 0 CA--C 1.48 -1.73 1 O-C-N 129.642 4.339 . . . . 0.0 114.766 -179.444 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.481 ' HG3' ' C ' ' A' ' 50' ' ' PHE . 0.3 OUTLIER -147.99 99.8 3.11 Favored 'General case' 0 C--O 1.203 -1.363 0 N-CA-C 118.317 2.71 . . . . 0.0 118.317 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.588 ' HB ' HD23 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -73.87 153.88 39.68 Favored 'General case' 0 C--O 1.245 0.822 0 O-C-N 128.629 3.706 . . . . 0.0 105.739 177.807 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.569 ' O ' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -159.69 134.76 8.08 Favored 'General case' 0 CA--C 1.483 -1.62 0 C-N-CA 115.197 -2.601 . . . . 0.0 111.876 -178.554 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -97.64 152.52 18.99 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.736 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -144.49 36.21 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 114.267 -1.333 . . . . 0.0 114.021 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.451 ' O ' HG22 ' A' ' 57' ' ' THR . 3.4 p -37.73 -46.48 0.9 Allowed 'General case' 0 C--N 1.317 -0.824 0 O-C-N 128.535 3.647 . . . . 0.0 106.171 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 57' ' ' THR . 0.6 OUTLIER 88.95 10.35 0.09 Allowed 'General case' 0 N--CA 1.481 1.101 1 O-C-N 130.959 5.162 . . . . 0.0 106.219 -179.941 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -110.4 -51.99 2.82 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 110.765 -2.925 . . . . 0.0 110.998 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.517 ' NH2' ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -164.73 90.56 0.54 Allowed 'General case' 0 C--N 1.359 1.019 0 CA-C-N 109.076 -3.693 . . . . 0.0 109.985 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.415 ' ND2' ' N ' ' A' ' 60' ' ' ASN . 0.0 OUTLIER -91.85 126.27 36.87 Favored 'General case' 0 N--CA 1.431 -1.418 1 CA-C-N 108.061 -4.154 . . . . 0.0 111.854 -179.708 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.517 ' CE1' ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -128.55 47.57 2.43 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 128.722 3.764 . . . . 0.0 107.184 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -28.86 133.54 0.04 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 O-C-N 128.937 3.898 . . . . 0.0 113.769 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.588 HD23 ' HB ' ' A' ' 52' ' ' THR . 11.7 tp -82.48 56.31 3.25 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -92.4 99.89 12.56 Favored 'General case' 0 C--O 1.205 -1.252 0 O-C-N 126.182 2.176 . . . . 0.0 112.823 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.513 ' HE2' HD11 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -147.89 -157.19 0.79 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 126.526 1.931 . . . . 0.0 107.386 179.134 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.44 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.5 OUTLIER -128.27 179.27 5.71 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 102.673 -3.084 . . . . 0.0 102.673 178.209 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.957 HG11 ' CD1' ' A' ' 89' ' ' TRP . 4.1 t -118.97 115.58 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.8 1 O-C-N 129.714 4.384 . . . . 0.0 109.96 -179.206 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.72 -24.34 22.06 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 116.448 -2.787 . . . . 0.0 111.561 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 69' ' ' VAL . 20.8 t -92.48 89.69 2.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 112.587 -1.806 . . . . 0.0 109.378 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.434 ' CG ' HD12 ' A' ' 86' ' ' LEU . 1.4 tm-20 -37.28 102.71 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.761 1 O-C-N 129.879 4.487 . . . . 0.0 113.137 179.472 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.404 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.1 OUTLIER -70.44 86.95 0.63 Allowed 'General case' 0 C--N 1.355 0.828 0 O-C-N 126.045 2.091 . . . . 0.0 111.432 -179.879 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -48.04 85.3 0.0 OUTLIER 'General case' 0 CA--C 1.486 -1.51 0 CA-C-N 112.153 -2.294 . . . . 0.0 116.193 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.403 ' CD ' ' HB2' ' A' ' 82' ' ' ASN . 9.8 mt-10 57.84 -165.76 0.16 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 120.827 1.649 . . . . 0.0 108.824 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 92.08 112.83 0.03 OUTLIER 'General case' 0 C--O 1.211 -0.963 0 CA-C-N 110.251 -3.159 . . . . 0.0 110.48 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.418 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 71.4 p -134.11 -105.81 0.23 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 110.921 -2.854 . . . . 0.0 113.462 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 58.56 162.89 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 126.235 2.922 . . . . 0.0 114.613 -179.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 64.23 19.95 64.6 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-N 108.582 -3.917 . . . . 0.0 107.713 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.541 ' O ' HD11 ' A' ' 24' ' ' LEU . 9.9 tp -159.15 -52.75 0.06 Allowed 'General case' 0 N--CA 1.475 0.796 0 O-C-N 127.485 2.52 . . . . 0.0 114.826 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.542 ' CB ' HD13 ' A' ' 24' ' ' LEU . 38.7 t0 -125.13 -66.23 0.97 Allowed 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 125.679 2.657 . . . . 0.0 110.421 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.35 74.07 1.21 Allowed Glycine 0 C--O 1.215 -1.081 0 C-N-CA 126.665 2.079 . . . . 0.0 116.608 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -150.65 -130.97 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 112.045 -2.078 . . . . 0.0 113.672 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.403 ' HB2' ' CD ' ' A' ' 73' ' ' GLU . 1.4 p-10 -169.4 115.67 0.58 Allowed 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.659 1.118 . . . . 0.0 108.843 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.571 HG11 ' OE1' ' A' ' 98' ' ' GLN . 75.6 t -138.09 149.61 24.74 Favored 'Isoleucine or valine' 0 C--N 1.365 1.254 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -179.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -63.39 103.86 0.56 Allowed 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 112.281 -2.236 . . . . 0.0 106.877 178.7 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.404 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 14.4 m -115.95 78.47 1.19 Allowed 'General case' 0 C--O 1.208 -1.131 0 O-C-N 126.994 2.684 . . . . 0.0 111.557 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 2.5 tp -86.6 148.95 25.26 Favored 'General case' 0 C--O 1.209 -1.072 1 CA-C-N 106.572 -4.831 . . . . 0.0 109.647 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.607 HG22 ' HB2' ' A' ' 96' ' ' CYS . 49.7 t -135.82 147.33 28.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 125.826 1.651 . . . . 0.0 107.602 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.487 ' O ' HG23 ' A' ' 88' ' ' THR . 8.7 t -167.71 126.96 1.31 Allowed 'General case' 0 CA--C 1.474 -1.979 0 CA-C-O 127.561 3.553 . . . . 0.0 111.934 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.957 ' CD1' HG11 ' A' ' 67' ' ' VAL . 21.2 m95 -64.09 144.38 57.15 Favored 'General case' 0 C--N 1.346 0.454 0 O-C-N 116.877 -3.639 . . . . 0.0 102.792 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.7 OUTLIER -104.33 -3.48 24.12 Favored 'General case' 0 CA--C 1.471 -2.087 1 CA-C-O 131.673 5.511 . . . . 0.0 118.689 -177.83 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 116.08 -13.51 16.7 Favored Glycine 0 C--O 1.198 -2.126 1 N-CA-C 102.883 -4.087 . . . . 0.0 102.883 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.473 ' O ' ' HB ' ' A' ' 93' ' ' THR . 1.1 p-10 179.33 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.609 1 O-C-N 131.325 4.78 . . . . 0.0 111.891 -179.979 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.645 HG23 ' CG2' ' A' ' 95' ' ' VAL 0.315 12.6 t 161.49 130.26 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.335 0 C-N-CA 128.093 2.557 . . . . 0.0 116.386 179.448 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.576 ' N ' ' CZ3' ' A' ' 89' ' ' TRP . 6.4 tp -52.48 -38.16 58.83 Favored 'General case' 0 CA--C 1.482 -1.66 0 N-CA-C 118.63 2.826 . . . . 0.0 118.63 -177.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.645 ' CG2' HG23 ' A' ' 93' ' ' THR . 18.1 t 28.7 120.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.492 -1.285 0 N-CA-C 120.63 3.567 . . . . 0.0 120.63 -178.082 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.607 ' HB2' HG22 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -139.52 137.79 35.77 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 103.416 -2.809 . . . . 0.0 103.416 179.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.41 ' O ' ' N ' ' A' ' 99' ' ' LYS . 3.5 t -119.93 96.57 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 119.439 3.125 . . . . 0.0 119.439 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.571 ' OE1' HG11 ' A' ' 83' ' ' VAL . 5.1 mm-40 -66.0 94.12 0.22 Allowed 'General case' 0 C--N 1.364 1.215 0 CA-C-O 123.992 1.853 . . . . 0.0 106.504 178.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' A' ' 97' ' ' VAL . 3.4 tttp -91.59 -56.19 3.21 Favored 'General case' 0 CA--C 1.492 -1.268 0 CA-C-N 110.036 -3.257 . . . . 0.0 114.404 -178.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.556 ' O ' HG22 ' A' ' 83' ' ' VAL . . . -49.58 146.13 7.56 Favored Glycine 0 C--O 1.206 -1.612 0 CA-C-O 124.426 2.125 . . . . 0.0 112.599 -179.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 69.98 165.79 0.28 Allowed 'General case' 0 CA--C 1.498 -1.046 1 CA-C-N 107.808 -4.196 . . . . 0.0 108.865 179.8 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.43 ' HD2' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -43.57 -48.68 7.56 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.468 2.307 . . . . 0.0 113.09 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.43 ' N ' ' HD2' ' A' ' 102' ' ' LYS . 3.3 mm-40 -42.27 147.72 0.24 Allowed 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 109.964 -3.289 . . . . 0.0 116.147 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.411 ' O ' ' HB ' ' A' ' 121' ' ' THR . 2.8 m120 -125.15 71.4 1.19 Allowed 'General case' 0 N--CA 1.492 1.632 1 CA-C-N 106.451 -4.886 . . . . 0.0 101.971 179.573 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 28.8 mmm-85 -88.65 1.85 54.3 Favored 'General case' 0 C--O 1.204 -1.326 1 O-C-N 131.749 5.656 . . . . 0.0 114.045 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.412 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -35.65 98.43 0.01 OUTLIER Glycine 0 N--CA 1.43 -1.764 2 O-C-N 134.256 7.222 . . . . 0.0 116.596 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.609 ' CD1' ' C ' ' A' ' 107' ' ' TRP 0.283 0.0 OUTLIER -108.89 126.92 53.58 Favored 'General case' 0 C--O 1.214 -0.764 1 O-C-N 131.074 4.632 . . . . 0.0 109.068 178.725 . . . . . . . . 5 4 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.543 ' HG3' ' CZ3' ' A' ' 110' ' ' TRP . 0.0 OUTLIER -162.48 178.57 8.49 Favored 'General case' 0 C--O 1.209 -1.055 1 O-C-N 130.877 5.111 . . . . 0.0 112.81 -179.074 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.474 ' CG ' ' HB3' ' A' ' 94' ' ' LEU 0.286 0.0 OUTLIER -133.28 -177.22 4.42 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 112.985 -3.388 . . . . 0.0 107.644 -179.825 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.543 ' CZ3' ' HG3' ' A' ' 108' ' ' LYS . 0.6 OUTLIER 174.93 92.66 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.416 1 O-C-N 131.445 5.466 . . . . 0.0 118.183 178.221 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.405 ' CG2' ' HA ' ' A' ' 4' ' ' ASP 0.277 77.5 t -31.64 100.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.783 0 O-C-N 119.134 -2.229 . . . . 0.0 115.774 179.714 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.546 ' HB2' ' CD1' ' A' ' 117' ' ' TYR . 1.0 OUTLIER -101.41 4.05 41.03 Favored 'General case' 0 CA--C 1.484 -1.575 0 CA-C-N 112.348 -2.205 . . . . 0.0 116.617 -179.595 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 151.0 -94.08 0.15 Allowed Glycine 0 N--CA 1.435 -1.368 0 O-C-N 120.767 -1.208 . . . . 0.0 113.789 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -118.62 24.66 10.76 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 117.692 2.479 . . . . 0.0 117.692 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.429 ' HB2' ' CB ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -172.79 153.38 2.68 Favored 'General case' 0 CA--C 1.508 -0.654 1 O-C-N 129.931 4.519 . . . . 0.0 110.477 -179.792 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.778 HD12 ' CZ2' ' A' ' 9' ' ' TRP . 2.3 mt -96.26 112.53 24.24 Favored 'General case' 0 C--O 1.199 -1.565 1 O-C-N 129.386 4.179 . . . . 0.0 114.667 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.546 ' CD1' ' HB2' ' A' ' 112' ' ' GLU . 17.6 m-85 -74.0 98.11 2.99 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 114.596 -2.842 . . . . 0.0 115.661 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.438 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -80.27 79.14 6.89 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 128.73 3.769 . . . . 0.0 108.047 179.786 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -93.88 122.34 36.28 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 125.373 1.671 . . . . 0.0 109.783 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.444 ' HB2' ' HB2' ' A' ' 107' ' ' TRP . 0.2 OUTLIER -134.03 150.47 51.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 126.363 2.29 . . . . 0.0 109.025 179.856 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.439 HG23 HG22 ' A' ' 126' ' ' VAL . 2.5 m -106.24 168.04 9.41 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.472 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -162.72 41.91 0.12 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 125.991 2.805 . . . . 0.0 115.618 -179.704 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 76.06 70.62 1.25 Allowed Glycine 0 C--O 1.218 -0.876 0 CA-C-N 109.547 -3.478 . . . . 0.0 111.731 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 102.72 -50.01 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.977 0 C-N-CA 129.088 2.955 . . . . 0.0 110.672 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.502 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 3.3 mm-40 -73.64 143.38 46.32 Favored 'General case' 0 C--O 1.217 -0.657 1 O-C-N 129.197 4.061 . . . . 0.0 108.562 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.439 HG22 HG23 ' A' ' 121' ' ' THR . 94.9 t -124.81 87.02 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 O-C-N 128.114 3.384 . . . . 0.0 112.523 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.9 t -56.83 143.46 37.05 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.416 ' HB3' ' HB3' ' A' ' 15' ' ' GLU . 4.8 ttp180 -127.51 135.68 50.7 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 128.495 3.622 . . . . 0.0 110.467 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -124.42 135.56 53.36 Favored 'General case' 0 N--CA 1.481 1.122 1 O-C-N 129.157 4.036 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 130' ' ' VAL . 54.1 t -127.99 74.74 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.202 -1.445 0 N-CA-C 102.996 -2.965 . . . . 0.0 102.996 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HG3' ' A' ' 11' ' ' MET . 2.5 m-85 -54.86 -176.34 0.01 OUTLIER 'General case' 0 CA--C 1.478 -1.807 2 CA-C-N 104.677 -5.692 . . . . 0.0 111.52 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -164.16 107.71 0.95 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 114.846 -2.502 . . . . 0.0 105.271 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.583 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -51.99 129.55 27.44 Favored 'General case' 0 N--CA 1.475 0.795 1 O-C-N 130.536 4.897 . . . . 0.0 108.682 178.521 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.423 ' HD3' ' HB ' ' A' ' 8' ' ' THR . 1.2 pttt . . . . . 0 CA--C 1.504 -0.819 0 N-CA-C 118.075 2.62 . . . . 0.0 118.075 -179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.424 ' HB2' ' HB2' ' A' ' 4' ' ' ASP . 0.5 OUTLIER . . . . . 0 N--CA 1.503 2.221 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -71.65 -42.79 67.11 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 117.291 -1.337 . . . . 0.0 111.559 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.486 ' HB2' ' CZ3' ' A' ' 89' ' ' TRP . 0.0 OUTLIER -92.9 -13.72 28.57 Favored 'General case' 0 CA--C 1.505 -0.761 0 O-C-N 127.184 2.802 . . . . 0.0 117.455 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.455 ' HA ' ' NE2' ' A' ' 45' ' ' GLN . 1.4 m-20 -77.09 132.19 38.75 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -154.3 66.4 0.7 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 116.938 -1.905 . . . . 0.0 107.62 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -44.31 146.3 0.69 Allowed 'General case' 0 N--CA 1.44 -0.959 1 O-C-N 129.96 4.538 . . . . 0.0 111.579 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 156.38 -169.81 33.87 Favored Glycine 0 C--O 1.207 -1.536 0 C-N-CA 117.546 -2.264 . . . . 0.0 111.993 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.474 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -127.64 147.98 50.37 Favored 'General case' 0 C--O 1.203 -1.381 1 O-C-N 131.954 5.149 . . . . 0.0 104.515 179.704 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.518 ' CZ3' ' HG3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -146.05 105.92 3.99 Favored 'General case' 0 C--N 1.32 -0.717 0 O-C-N 128.499 3.624 . . . . 0.0 116.705 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.406 ' O ' ' N ' ' A' ' 12' ' ' GLU . 3.1 mt-10 -78.75 107.96 11.83 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 127.258 2.849 . . . . 0.0 108.997 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.428 ' HB3' ' HG2' ' A' ' 39' ' ' GLN 0.273 5.8 ttp -64.08 85.4 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 103.507 -2.775 . . . . 0.0 103.507 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 10' ' ' GLU . 36.8 tt0 -45.24 -30.28 1.19 Allowed 'General case' 0 C--N 1.312 -1.042 1 O-C-N 130.988 5.18 . . . . 0.0 112.006 -179.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.1 m -144.7 149.53 35.78 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 113.377 -1.738 . . . . 0.0 111.447 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.421 ' ND2' ' CE ' ' A' ' 11' ' ' MET . 5.9 t-20 -128.59 110.18 12.02 Favored 'General case' 0 C--O 1.206 -1.236 1 O-C-N 129.503 4.252 . . . . 0.0 112.665 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -110.97 125.31 53.57 Favored 'General case' 0 CA--C 1.496 -1.103 1 O-C-N 131.348 5.405 . . . . 0.0 113.717 179.446 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 57.66 85.97 0.08 Allowed 'General case' 0 C--O 1.209 -1.07 0 CA-C-O 122.277 1.037 . . . . 0.0 109.393 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.678 ' CE2' HG22 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -105.4 -29.36 10.29 Favored 'General case' 0 CA--C 1.487 -1.449 0 CA-C-O 124.944 2.307 . . . . 0.0 109.148 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.451 ' HG3' ' HB3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -78.7 -48.68 14.5 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 114.982 -2.437 . . . . 0.0 110.601 179.154 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -59.58 -20.88 53.29 Favored Glycine 0 N--CA 1.475 1.241 0 O-C-N 128.43 3.581 . . . . 0.0 111.214 178.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -77.44 -38.69 48.95 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-O 127.434 3.492 . . . . 0.0 105.611 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.451 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -69.12 -36.3 77.35 Favored 'General case' 0 C--O 1.214 -0.789 0 CA-C-N 111.194 -2.73 . . . . 0.0 109.617 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.82 -22.57 60.78 Favored 'General case' 0 C--O 1.207 -1.164 1 O-C-N 134.03 7.081 . . . . 0.0 114.617 -179.328 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.14 -27.65 61.79 Favored 'General case' 0 N--CA 1.477 0.924 2 O-C-N 132.082 5.864 . . . . 0.0 109.11 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.729 HD12 ' HB ' ' A' ' 26' ' ' ILE . 0.6 OUTLIER -122.95 25.53 8.54 Favored 'General case' 0 CA--C 1.542 0.651 1 O-C-N 130.362 4.789 . . . . 0.0 105.484 179.775 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.402 ' C ' ' N ' ' A' ' 27' ' ' ASP . 1.6 m-20 57.72 -73.72 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.646 0 C-N-CA 130.826 3.65 . . . . 0.0 111.786 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.729 ' HB ' HD12 ' A' ' 24' ' ' LEU . 4.5 tt 28.54 49.8 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.046 3 CA-C-O 130.333 4.873 . . . . 0.0 106.84 179.557 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.402 ' N ' ' C ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -67.87 62.41 0.08 Allowed 'General case' 0 N--CA 1.49 1.552 1 CA-C-N 107.992 -4.186 . . . . 0.0 113.844 -177.454 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.488 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 2.8 m-30 -106.72 -43.14 4.77 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 118.153 2.649 . . . . 0.0 118.153 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' A' ' 28' ' ' PHE . . . 158.36 155.08 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 104.328 -2.471 . . . . 0.0 104.328 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.769 HG23 ' O ' ' A' ' 34' ' ' ALA . 2.4 m 154.04 -50.26 0.0 OUTLIER 'General case' 0 C--O 1.208 -1.099 1 O-C-N 131.148 5.28 . . . . 0.0 110.392 -178.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' HG2' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -50.36 -32.66 17.97 Favored 'General case' 0 N--CA 1.472 0.632 1 O-C-N 132.597 6.186 . . . . 0.0 106.288 179.234 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.48 ' N ' ' HG2' ' A' ' 31' ' ' ARG . 0.6 OUTLIER -82.89 -45.69 13.9 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 127.807 3.192 . . . . 0.0 106.493 178.366 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.547 HD13 ' HA ' ' A' ' 33' ' ' ILE . 0.1 OUTLIER -172.76 97.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.383 0 CA-C-O 128.245 3.878 . . . . 0.0 115.948 177.305 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.769 ' O ' HG23 ' A' ' 30' ' ' THR . . . 169.25 46.25 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.543 0 CA-C-O 127.697 3.618 . . . . 0.0 107.732 175.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.678 HG22 ' CE2' ' A' ' 17' ' ' PHE . 58.6 t -62.03 -25.93 38.68 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.622 1 CA-C-N 106.932 -4.667 . . . . 0.0 108.282 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.537 ' C ' HD12 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 174.84 -80.83 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.868 1 CA-C-N 107.917 -4.22 . . . . 0.0 108.421 177.133 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.75 HD23 ' CD1' ' A' ' 58' ' ' PHE . 0.0 OUTLIER 123.1 2.09 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.035 1 O-C-N 132.613 6.196 . . . . 0.0 110.977 178.3 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.462 ' N ' HD13 ' A' ' 37' ' ' LEU . 1.3 m 157.85 -70.34 0.0 OUTLIER 'General case' 0 CA--C 1.491 -1.309 1 O-C-N 129.871 4.482 . . . . 0.0 112.675 179.359 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.497 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 0.5 OUTLIER 57.56 101.14 0.02 OUTLIER 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -121.44 75.22 1.16 Allowed 'General case' 0 C--O 1.2 -1.539 1 O-C-N 131.44 5.462 . . . . 0.0 109.712 179.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.411 ' C ' ' HD3' ' A' ' 41' ' ' LYS . 0.1 OUTLIER -56.82 138.0 54.02 Favored 'General case' 0 N--CA 1.49 1.564 1 O-C-N 132.373 6.046 . . . . 0.0 106.823 -179.646 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.531 ' HB ' ' HD3' ' A' ' 53' ' ' LYS . 5.3 mt -136.46 109.1 8.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 O-C-N 127.509 3.005 . . . . 0.0 111.901 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.499 HD11 ' HB2' ' A' ' 45' ' ' GLN 0.262 0.3 OUTLIER -83.97 118.62 31.65 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.672 1 CA-C-N 106.922 -4.672 . . . . 0.0 110.157 -179.432 . . . . . . . . 5 4 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 45' ' ' GLN . 0.9 OUTLIER -95.84 -40.77 11.19 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.485 0 CA-C-N 112.047 -2.342 . . . . 0.0 112.939 -179.143 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.499 ' HB2' HD11 ' A' ' 43' ' ' ILE . 47.3 tt0 18.4 102.7 0.0 OUTLIER 'General case' 0 CA--C 1.485 -1.523 0 O-C-N 127.936 3.272 . . . . 0.0 117.617 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -118.86 23.95 11.13 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-N 111.124 -2.762 . . . . 0.0 117.017 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.31 106.01 2.24 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-O 116.601 -2.222 . . . . 0.0 109.904 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 68.37 -68.13 0.18 Allowed 'General case' 0 C--O 1.211 -0.962 0 O-C-N 128.509 3.123 . . . . 0.0 109.454 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.477 ' H ' ' ND2' ' A' ' 49' ' ' ASN . 0.1 OUTLIER -71.63 99.29 2.06 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 112.833 -3.461 . . . . 0.0 107.58 178.379 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 50' ' ' PHE . 2.3 t80 -122.55 102.88 8.33 Favored 'General case' 0 CA--C 1.484 -1.576 1 O-C-N 130.444 4.84 . . . . 0.0 113.509 -178.493 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 93.03 3.95 Favored 'General case' 0 C--O 1.194 -1.835 0 O-C-N 128.375 3.547 . . . . 0.0 115.198 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 62' ' ' ASP . 0.3 OUTLIER -69.21 155.19 40.81 Favored 'General case' 0 CA--C 1.499 -0.984 0 O-C-N 127.248 2.842 . . . . 0.0 107.322 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HD3' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -168.58 143.46 3.36 Favored 'General case' 0 CA--C 1.485 -1.52 0 C-N-CA 115.843 -2.343 . . . . 0.0 112.551 -179.712 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.7 t -90.1 175.06 7.3 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 112.905 -1.952 . . . . 0.0 108.218 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -138.85 23.58 2.62 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.657 ' CB ' HD11 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -36.48 -64.88 0.31 Allowed 'General case' 0 C--O 1.209 -1.033 1 O-C-N 131.572 5.545 . . . . 0.0 110.187 179.969 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.414 ' HB ' ' O ' ' A' ' 56' ' ' SER . 1.4 t 118.62 -36.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 O-C-N 130.076 4.61 . . . . 0.0 103.02 -179.747 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.75 ' CD1' HD23 ' A' ' 37' ' ' LEU . 2.2 m-85 -58.55 -64.83 0.79 Allowed 'General case' 0 C--O 1.241 0.632 0 O-C-N 126.849 2.593 . . . . 0.0 110.987 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.79 106.76 4.14 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 127.788 3.18 . . . . 0.0 110.291 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -99.4 64.92 1.36 Allowed 'General case' 0 C--O 1.21 -0.992 1 O-C-N 129.286 4.116 . . . . 0.0 107.508 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.76 77.89 1.74 Allowed 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 128.957 3.911 . . . . 0.0 108.692 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB3' HG22 ' A' ' 52' ' ' THR . 0.2 OUTLIER -101.83 -65.73 0.96 Allowed 'General case' 0 C--O 1.204 -1.331 0 O-C-N 126.632 2.457 . . . . 0.0 114.232 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.5 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 0.5 OUTLIER -149.41 103.86 3.33 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.916 -179.829 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.442 ' C ' ' CD1' ' A' ' 65' ' ' PHE . 8.2 p-10 -126.23 70.76 1.24 Allowed 'General case' 0 CA--C 1.499 -1.018 0 C-N-CA 118.158 -1.417 . . . . 0.0 110.597 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.5 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -134.84 160.83 36.97 Favored 'General case' 0 C--N 1.353 0.743 1 CA-C-O 129.205 4.336 . . . . 0.0 111.02 179.842 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.429 HG22 HG23 ' A' ' 69' ' ' VAL . 1.2 m -107.77 102.44 11.66 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 109.454 -3.521 . . . . 0.0 102.862 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.525 HG11 ' CD1' ' A' ' 89' ' ' TRP . 14.1 t -33.52 129.39 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.489 -1.379 1 O-C-N 129.568 4.293 . . . . 0.0 115.97 -179.258 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.61 -18.39 56.58 Favored Glycine 0 N--CA 1.481 1.638 0 CA-C-N 111.517 -2.583 . . . . 0.0 112.968 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 69' ' ' VAL . 97.2 t -88.38 79.03 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 119.136 -1.025 . . . . 0.0 109.486 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.777 ' HG3' HD12 ' A' ' 86' ' ' LEU . 4.8 tt0 -38.04 105.45 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.501 2 O-C-N 132.871 6.357 . . . . 0.0 110.611 179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.491 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -64.86 92.5 0.1 Allowed 'General case' 0 CA--C 1.51 -0.569 0 O-C-N 129.043 3.964 . . . . 0.0 114.314 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -58.22 70.77 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.032 0 O-C-N 126.656 2.473 . . . . 0.0 113.125 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.598 ' HB3' ' HA ' ' A' ' 82' ' ' ASN . 13.9 mt-10 54.51 -165.79 0.09 Allowed 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 123.274 1.511 . . . . 0.0 110.688 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 72.84 86.31 0.11 Allowed 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 110.307 -3.133 . . . . 0.0 114.513 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.455 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 14.4 p -94.98 -70.88 0.69 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.4 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.455 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER 43.54 140.62 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.954 2 O-C-N 130.218 4.699 . . . . 0.0 116.781 179.666 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.02 -15.77 61.1 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 110.743 -2.935 . . . . 0.0 111.644 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.497 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 8.2 tp -153.1 53.24 0.75 Allowed 'General case' 0 C--N 1.347 0.459 0 O-C-N 128.994 3.408 . . . . 0.0 116.028 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.5 t0 141.63 -67.97 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 O-C-N 128.568 3.667 . . . . 0.0 110.22 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.05 82.6 0.32 Allowed Glycine 0 C--O 1.213 -1.185 0 CA-C-N 110.073 -3.239 . . . . 0.0 110.557 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.97 -125.36 0.14 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 108.512 -3.844 . . . . 0.0 113.803 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER 178.68 93.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 120.455 1.48 . . . . 0.0 107.476 -179.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.46 HG13 ' N ' ' A' ' 99' ' ' LYS . 68.0 t -128.88 151.6 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 O-C-N 127.8 3.187 . . . . 0.0 118.445 -178.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.492 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.3 OUTLIER -78.24 95.65 5.04 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 112.571 -2.104 . . . . 0.0 107.064 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.491 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 76.7 m -99.84 81.74 2.49 Favored 'General case' 0 C--O 1.202 -1.439 0 CA-C-N 109.41 -3.541 . . . . 0.0 116.566 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.777 HD12 ' HG3' ' A' ' 70' ' ' GLU . 0.6 OUTLIER -82.12 141.93 32.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 108.684 -3.871 . . . . 0.0 113.437 179.853 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.426 HG21 ' CD2' ' A' ' 65' ' ' PHE . 39.1 t -131.02 131.37 64.07 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 125.699 1.6 . . . . 0.0 108.673 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.441 HG22 ' N ' ' A' ' 89' ' ' TRP 0.261 99.2 m -156.42 170.73 21.64 Favored 'General case' 0 CA--C 1.476 -1.89 0 CA-C-N 113.02 -1.9 . . . . 0.0 111.412 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.68 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 31.1 m95 -100.37 143.54 30.43 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 129.134 2.973 . . . . 0.0 106.61 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.538 ' CG ' HG21 ' A' ' 95' ' ' VAL . 0.9 OUTLIER -99.07 -12.49 20.49 Favored 'General case' 0 CA--C 1.477 -1.852 0 CA-C-O 127.237 3.399 . . . . 0.0 113.286 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 128.31 -29.61 4.04 Favored Glycine 0 C--O 1.196 -2.264 0 CA-C-N 109.961 -3.29 . . . . 0.0 105.226 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -150.11 24.15 0.83 Allowed 'General case' 0 N--CA 1.434 -1.257 1 O-C-N 130.041 4.024 . . . . 0.0 111.841 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.507 HG22 ' CB ' ' A' ' 90' ' ' GLU . 5.3 t -174.01 163.48 4.01 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 117.562 2.43 . . . . 0.0 117.562 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.436 ' N ' ' OG1' ' A' ' 93' ' ' THR . 1.1 tp -92.99 98.41 11.33 Favored 'General case' 0 C--O 1.209 -1.046 0 CA-C-O 125.332 2.491 . . . . 0.0 114.343 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.538 HG21 ' CG ' ' A' ' 90' ' ' GLU 0.271 90.6 t -100.0 112.2 31.83 Favored 'Isoleucine or valine' 0 C--N 1.363 1.159 0 CA-C-N 110.406 -3.088 . . . . 0.0 112.623 179.672 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.416 ' SG ' ' CZ2' ' A' ' 107' ' ' TRP . 0.0 OUTLIER -139.42 150.04 44.78 Favored 'General case' 0 C--O 1.196 -1.726 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -137.36 139.48 43.66 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 128.102 3.376 . . . . 0.0 114.489 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.524 ' CD ' ' HB3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -111.07 107.69 17.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.328 1.851 . . . . 0.0 107.266 179.065 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.46 ' N ' HG13 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -140.69 98.92 3.5 Favored 'General case' 0 C--O 1.201 -1.464 0 C-N-CA 115.203 -2.599 . . . . 0.0 112.797 -179.329 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -165.92 57.36 0.25 Allowed Glycine 0 C--O 1.212 -1.239 0 CA-C-O 124.428 2.127 . . . . 0.0 111.95 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 62.3 145.65 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.188 1 CA-C-N 106.365 -4.918 . . . . 0.0 113.916 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.406 ' C ' ' HD3' ' A' ' 102' ' ' LYS . 0.3 OUTLIER 99.17 -49.71 0.0 OUTLIER 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 110.94 -2.846 . . . . 0.0 116.348 179.357 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -156.11 -177.87 6.9 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-N 108.46 -3.973 . . . . 0.0 114.899 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -128.22 88.63 2.78 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 113.633 -3.079 . . . . 0.0 104.107 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.651 ' NH1' HD22 ' A' ' 24' ' ' LEU . 10.3 mmm-85 -68.59 -9.27 48.6 Favored 'General case' 0 C--O 1.201 -1.468 1 O-C-N 130.508 4.88 . . . . 0.0 113.345 179.419 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.435 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -33.43 114.85 0.11 Allowed Glycine 0 C--N 1.352 1.441 1 O-C-N 130.483 4.864 . . . . 0.0 116.983 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.416 ' CZ2' ' SG ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -123.1 142.34 50.99 Favored 'General case' 0 C--N 1.32 -0.693 1 O-C-N 132.051 5.207 . . . . 0.0 109.878 178.738 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -165.27 170.85 14.29 Favored 'General case' 0 CA--C 1.505 -0.786 1 O-C-N 129.442 4.214 . . . . 0.0 112.697 -179.292 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.453 ' C ' ' CG ' ' A' ' 110' ' ' TRP . 3.9 mp0 -132.71 -178.35 4.9 Favored 'General case' 0 C--N 1.365 1.265 0 C-N-CA 115.989 -2.284 . . . . 0.0 108.616 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.453 ' CG ' ' C ' ' A' ' 109' ' ' GLN . 0.0 OUTLIER -159.67 15.75 0.15 Allowed 'General case' 0 CA--C 1.501 -0.925 1 O-C-N 129.279 4.112 . . . . 0.0 118.063 -179.823 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.3 t 39.87 71.13 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.483 -1.628 0 CA-C-O 125.821 2.724 . . . . 0.0 115.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.439 ' HB2' ' CD2' ' A' ' 117' ' ' TYR . 2.8 mm-40 -97.02 84.8 3.6 Favored 'General case' 0 CA--C 1.483 -1.621 0 CA-C-O 125.924 2.773 . . . . 0.0 117.308 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 52.58 87.79 0.01 OUTLIER Glycine 0 C--O 1.197 -2.206 0 O-C-N 119.048 -2.283 . . . . 0.0 117.347 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 41.16 51.79 3.44 Favored 'General case' 0 CA--C 1.501 -0.936 0 C-N-CA 128.576 2.75 . . . . 0.0 118.39 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 6.4 pttt 177.14 146.12 0.1 Allowed 'General case' 0 C--N 1.32 -0.713 0 O-C-N 129.057 3.973 . . . . 0.0 109.982 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.406 HD13 ' CH2' ' A' ' 9' ' ' TRP . 4.9 mp -105.3 104.56 14.32 Favored 'General case' 0 C--O 1.199 -1.563 0 O-C-N 128.308 3.505 . . . . 0.0 118.605 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.479 ' HE1' HG13 ' A' ' 130' ' ' VAL . 6.8 m-30 -70.2 93.27 0.82 Allowed 'General case' 0 C--O 1.203 -1.369 0 O-C-N 127.988 3.305 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.811 HD12 ' CZ ' ' A' ' 131' ' ' PHE . 1.2 mt -82.73 69.4 9.51 Favored 'General case' 0 C--N 1.346 0.449 1 CA-C-N 108.356 -4.02 . . . . 0.0 107.338 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -73.88 111.01 8.62 Favored 'General case' 0 CA--C 1.501 -0.938 1 O-C-N 129.316 4.135 . . . . 0.0 110.26 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.44 160.13 23.73 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 126.821 2.576 . . . . 0.0 113.46 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.23 160.4 36.25 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 127.006 2.691 . . . . 0.0 105.175 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.429 ' HB3' ' CD ' ' A' ' 105' ' ' ARG . 0.5 OUTLIER -163.95 70.57 0.21 Allowed 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 125.197 2.427 . . . . 0.0 110.952 -179.647 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 107.2 -57.59 0.44 Allowed Glycine 0 CA--C 1.525 0.708 0 CA-C-N 111.76 -2.473 . . . . 0.0 108.769 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.8 t0 166.8 53.05 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 125.933 1.693 . . . . 0.0 106.549 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -119.8 10.23 11.57 Favored 'General case' 0 N--CA 1.475 0.776 1 O-C-N 129.259 4.099 . . . . 0.0 109.06 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 126' ' ' VAL . 12.6 p 4.39 72.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.5 -0.967 1 O-C-N 130.082 4.614 . . . . 0.0 116.761 179.914 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 64.1 m -64.33 133.44 52.67 Favored 'General case' 0 CA--C 1.488 -1.406 0 O-C-N 119.744 -1.847 . . . . 0.0 112.019 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.28 93.32 4.43 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 128.241 3.463 . . . . 0.0 113.701 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -84.54 157.07 21.38 Favored 'General case' 0 CA--C 1.499 -1.001 0 C-N-CA 116.12 -2.232 . . . . 0.0 115.311 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.479 HG13 ' HE1' ' A' ' 117' ' ' TYR . 74.3 t -140.43 123.54 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-O 126.482 3.039 . . . . 0.0 106.958 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.811 ' CZ ' HD12 ' A' ' 118' ' ' LEU . 4.3 m-85 -100.74 -177.75 3.57 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 110.226 -3.17 . . . . 0.0 115.82 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.464 ' C ' ' CD ' ' A' ' 132' ' ' LYS 0.257 0.0 OUTLIER -157.89 124.29 4.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 110.751 -2.931 . . . . 0.0 103.885 179.895 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.518 ' HG3' ' CZ3' ' A' ' 9' ' ' TRP . 30.6 tttt -75.66 113.77 13.48 Favored 'General case' 0 C--O 1.198 -1.643 1 O-C-N 129.147 4.029 . . . . 0.0 112.406 179.609 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt . . . . . 0 CA--C 1.498 -1.039 0 N-CA-C 116.547 2.055 . . . . 0.0 116.547 -179.968 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.5 mmm . . . . . 0 N--CA 1.498 1.928 0 N-CA-C 105.844 -1.91 . . . . 0.0 105.844 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.69 -50.84 3.45 Favored 'General case' 0 C--O 1.202 -1.433 0 O-C-N 125.303 1.627 . . . . 0.0 109.453 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 89' ' ' TRP . 9.4 mttm -93.37 -137.17 0.19 Allowed 'General case' 0 CA--C 1.504 -0.822 0 C-N-CA 118.331 -1.348 . . . . 0.0 113.96 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.752 ' HA ' HG21 ' A' ' 111' ' ' VAL . 83.8 m-20 -80.52 -97.32 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 102.704 -3.073 . . . . 0.0 102.704 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -175.28 -94.18 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 113.506 -3.14 . . . . 0.0 107.692 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 158.25 112.83 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.018 1 O-C-N 130.116 4.635 . . . . 0.0 111.771 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 177.65 -141.17 5.1 Favored Glycine 0 C--O 1.209 -1.456 0 CA-C-O 117.057 -1.968 . . . . 0.0 114.967 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.728 HG23 ' CG1' ' A' ' 42' ' ' ILE . 63.2 m -147.31 148.86 31.83 Favored 'General case' 0 C--O 1.215 -0.715 1 O-C-N 130.193 4.114 . . . . 0.0 104.003 -179.472 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.536 ' CD1' ' N ' ' A' ' 9' ' ' TRP 0.258 0.0 OUTLIER -139.26 118.06 12.38 Favored 'General case' 0 CA--C 1.508 -0.65 1 O-C-N 130.128 4.642 . . . . 0.0 111.594 -179.112 . . . . . . . . 5 4 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.94 -6.29 32.0 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 126.891 2.62 . . . . 0.0 115.581 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.421 ' O ' ' HA ' ' A' ' 131' ' ' PHE . 1.9 ttm 83.56 -79.91 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 112.857 -3.449 . . . . 0.0 107.219 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 11' ' ' MET . 0.5 OUTLIER 123.8 -28.23 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.069 0 O-C-N 128.875 3.859 . . . . 0.0 106.62 -179.236 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.288 3.1 p 164.18 160.97 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 110.872 -2.876 . . . . 0.0 110.182 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -121.67 136.23 54.95 Favored 'General case' 0 CA--C 1.486 -1.514 0 O-C-N 128.55 3.656 . . . . 0.0 115.96 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -87.45 -137.38 0.09 Allowed 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 110.902 -2.863 . . . . 0.0 111.279 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -41.34 95.81 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.186 0 C-N-CA 124.37 1.068 . . . . 0.0 113.077 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -111.07 -36.92 5.5 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-O 126.646 3.117 . . . . 0.0 110.454 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.47 ' HG3' ' N ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.04 -29.39 60.77 Favored 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 119.758 -1.838 . . . . 0.0 115.455 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.47 ' N ' ' HG3' ' A' ' 18' ' ' GLU . . . -78.29 -23.78 64.89 Favored Glycine 0 N--CA 1.485 1.909 0 O-C-N 127.723 3.14 . . . . 0.0 109.194 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -71.79 -20.37 61.87 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 123.747 1.737 . . . . 0.0 107.966 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.503 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -78.52 -34.68 47.08 Favored 'General case' 0 CA--C 1.488 -1.417 0 C-N-CA 116.705 -1.998 . . . . 0.0 109.237 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' HD3' ' HB3' ' A' ' 28' ' ' PHE . 2.7 mtmt -71.61 -27.74 63.32 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-N 109.668 -3.424 . . . . 0.0 115.977 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.661 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -66.87 -31.64 72.38 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 108.764 -3.835 . . . . 0.0 111.369 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.746 HD23 ' N ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -93.36 -24.61 18.04 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 128.462 3.601 . . . . 0.0 107.579 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.0 t0 65.7 74.88 0.36 Allowed 'General case' 0 C--O 1.2 -1.534 1 O-C-N 129.4 4.188 . . . . 0.0 105.38 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.722 HD12 HD12 ' A' ' 78' ' ' LEU . 2.1 tt -104.64 -54.88 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.548 0 CA-C-N 109.426 -3.534 . . . . 0.0 115.316 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.432 ' N ' HG23 ' A' ' 26' ' ' ILE . 1.4 t0 -167.2 32.44 0.03 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 115.138 -2.363 . . . . 0.0 113.874 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.418 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -16.99 129.35 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 O-C-N 127.975 3.297 . . . . 0.0 117.916 179.568 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 92.91 66.53 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 127.66 3.1 . . . . 0.0 107.745 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -119.69 -47.5 2.42 Favored 'General case' 0 C--O 1.218 -0.598 2 CA-C-N 105.576 -5.284 . . . . 0.0 112.949 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.51 113.51 0.46 Allowed 'General case' 0 CA--C 1.507 -0.695 1 O-C-N 129.691 4.369 . . . . 0.0 107.805 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 tttt 179.62 -47.76 0.01 OUTLIER 'General case' 0 CA--C 1.491 -1.319 0 O-C-N 127.892 3.245 . . . . 0.0 110.23 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.702 ' H ' HD12 ' A' ' 33' ' ' ILE . 0.2 OUTLIER -124.11 -11.18 6.54 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.241 0 O-C-N 126.987 2.68 . . . . 0.0 112.894 -179.831 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -101.61 19.09 18.69 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-O 124.071 1.891 . . . . 0.0 112.091 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.4 t -49.27 -37.34 10.36 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.374 0 CA-C-N 109.519 -3.491 . . . . 0.0 109.386 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.766 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -171.38 151.01 2.97 Favored 'General case' 0 C--O 1.21 -0.991 1 CA-C-N 106.42 -4.9 . . . . 0.0 112.123 179.833 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.112 HD11 ' CE1' ' A' ' 58' ' ' PHE . 2.5 pt? 153.99 -19.12 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.991 2 O-C-N 134.88 7.613 . . . . 0.0 106.282 177.026 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.51 ' HA ' ' HB2' ' A' ' 56' ' ' SER . 16.1 m -46.36 -29.46 1.69 Allowed 'General case' 0 N--CA 1.485 1.281 1 O-C-N 132.269 5.981 . . . . 0.0 109.455 175.231 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.557 ' CG ' ' N ' ' A' ' 40' ' ' THR . 0.0 OUTLIER 42.57 -171.66 0.0 OUTLIER 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 118.556 2.798 . . . . 0.0 118.556 179.313 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.557 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 57.5 m -20.13 90.99 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 131.575 3.95 . . . . 0.0 115.522 178.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.534 ' HE3' ' CD1' ' A' ' 9' ' ' TRP 0.262 0.0 OUTLIER -75.33 161.28 29.42 Favored 'General case' 0 N--CA 1.492 1.631 1 O-C-N 129.414 4.196 . . . . 0.0 101.889 178.94 . . . . . . . . 5 4 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.728 ' CG1' HG23 ' A' ' 8' ' ' THR . 11.6 mt -137.72 164.34 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.282 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.482 ' N ' HG22 ' A' ' 42' ' ' ILE . 5.8 tt -140.02 150.02 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.485 0 O-C-N 127.489 2.993 . . . . 0.0 108.932 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.3 t -130.62 -46.67 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 C-N-CA 115.014 -2.674 . . . . 0.0 115.973 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.428 ' HB3' ' CD2' ' A' ' 50' ' ' PHE . 2.5 pp0? 32.47 101.53 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 126.052 2.834 . . . . 0.0 115.205 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.18 51.88 1.75 Allowed 'General case' 0 CA--C 1.494 -1.179 0 CA-C-N 110.465 -3.061 . . . . 0.0 114.021 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 60.06 98.28 0.01 OUTLIER Glycine 0 N--CA 1.475 1.267 0 CA-C-N 115.349 -0.841 . . . . 0.0 115.028 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.518 ' O ' HG23 ' A' ' 67' ' ' VAL . 0.2 OUTLIER 84.16 -60.49 0.11 Allowed 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 127.645 2.615 . . . . 0.0 110.935 -179.649 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.37 124.45 33.4 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 128.541 3.651 . . . . 0.0 107.755 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.654 ' CD1' ' CZ ' ' A' ' 65' ' ' PHE . 3.3 t80 -125.12 138.37 54.17 Favored 'General case' 0 CA--C 1.484 -1.583 1 O-C-N 131.059 5.224 . . . . 0.0 117.796 -178.56 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.408 ' HD3' ' HB3' ' A' ' 64' ' ' ASP . 54.0 mttt -145.15 100.32 3.45 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 178.137 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.577 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -84.52 160.66 20.46 Favored 'General case' 0 N--CA 1.473 0.694 1 O-C-N 129.568 4.292 . . . . 0.0 106.251 177.176 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.551 ' HG2' HD12 ' A' ' 42' ' ' ILE . 20.1 tttt -158.91 137.72 11.1 Favored 'General case' 0 CA--C 1.481 -1.696 0 C-N-CA 114.119 -3.032 . . . . 0.0 112.327 -177.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.569 HG22 ' HB3' ' A' ' 56' ' ' SER . 0.9 OUTLIER -86.94 123.39 32.0 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 110.343 -3.117 . . . . 0.0 108.877 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.436 ' O ' ' NE2' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -102.41 11.59 37.79 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 113.849 -2.977 . . . . 0.0 114.883 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.569 ' HB3' HG22 ' A' ' 54' ' ' THR . 5.6 p -39.6 173.31 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.695 1 O-C-N 133.288 6.617 . . . . 0.0 112.385 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.72 6.08 25.37 Favored 'General case' 0 N--CA 1.48 1.031 1 CA-C-N 107.16 -4.564 . . . . 0.0 102.801 178.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 1.112 ' CE1' HD11 ' A' ' 37' ' ' LEU . 2.6 m-30 -121.57 -78.81 0.6 Allowed 'General case' 0 C--N 1.357 0.905 0 O-C-N 126.831 2.582 . . . . 0.0 116.659 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.459 ' NH1' HD22 ' A' ' 78' ' ' LEU . 5.2 mtt180 -106.85 123.55 48.32 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 109.073 -3.694 . . . . 0.0 116.143 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.37 62.35 1.52 Allowed 'General case' 0 C--O 1.198 -1.62 1 O-C-N 129.76 4.412 . . . . 0.0 105.792 -179.993 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -95.75 16.29 17.87 Favored 'General case' 0 N--CA 1.448 -0.553 2 O-C-N 131.458 5.474 . . . . 0.0 111.271 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 1.89 126.42 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.131 1 O-C-N 133.076 6.485 . . . . 0.0 117.156 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.806 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 4.2 tp -78.17 61.81 2.76 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 114.78 -1.1 . . . . 0.0 112.751 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.408 ' HB3' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -101.37 101.12 11.7 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 126.354 2.284 . . . . 0.0 111.112 -179.788 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.785 ' CD2' HG21 ' A' ' 87' ' ' VAL . 17.2 p90 -133.29 -152.38 0.49 Allowed 'General case' 0 CA--C 1.486 -1.5 0 CA-C-O 124.991 2.329 . . . . 0.0 107.527 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.625 HG22 ' HB ' ' A' ' 69' ' ' VAL . 0.9 OUTLIER -159.08 141.47 13.95 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 118.408 -2.683 . . . . 0.0 104.582 -179.759 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.838 HG11 ' CD1' ' A' ' 89' ' ' TRP . 2.5 t -65.25 131.24 31.05 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.836 0 O-C-N 128.771 3.794 . . . . 0.0 115.823 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 61.92 24.73 65.09 Favored Glycine 0 N--CA 1.474 1.18 0 CA-C-N 112.188 -2.278 . . . . 0.0 116.398 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.625 ' HB ' HG22 ' A' ' 66' ' ' THR 0.316 1.8 p -93.77 -16.5 7.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 O-C-N 126.013 1.655 . . . . 0.0 110.918 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 72.88 107.37 0.07 Allowed 'General case' 0 C--N 1.355 0.814 1 O-C-N 129.405 4.19 . . . . 0.0 108.195 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.595 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 1.7 t80 -97.71 31.63 2.56 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 128.11 3.382 . . . . 0.0 113.649 -178.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -16.8 103.08 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.3 0 C-N-CA 127.245 2.218 . . . . 0.0 116.416 -178.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.409 ' HG3' ' CB ' ' A' ' 82' ' ' ASN . 2.7 tt0 69.92 -168.58 0.17 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-O 124.533 2.111 . . . . 0.0 112.254 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 82.39 85.83 0.04 OUTLIER 'General case' 0 C--O 1.21 -1.002 0 CA-C-O 125.6 2.619 . . . . 0.0 116.798 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.252 0.6 OUTLIER -114.96 -52.11 2.71 Favored 'General case' 0 C--O 1.2 -1.547 0 CA-C-N 110.525 -3.034 . . . . 0.0 111.99 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.8 pttt -27.18 111.72 0.05 OUTLIER 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 128.633 3.708 . . . . 0.0 115.302 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 155.41 -33.97 0.64 Allowed Glycine 0 C--O 1.212 -1.223 0 CA-C-N 110.993 -2.821 . . . . 0.0 112.624 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.722 HD12 HD12 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -115.02 -52.04 2.7 Favored 'General case' 0 N--CA 1.474 0.747 1 CA-C-N 106.896 -4.652 . . . . 0.0 115.587 -179.866 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.601 ' HB2' HD13 ' A' ' 24' ' ' LEU . 58.6 t0 -109.84 -60.33 1.8 Allowed 'General case' 0 C--O 1.215 -0.756 0 O-C-N 120.035 -1.666 . . . . 0.0 112.85 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.02 75.05 1.22 Allowed Glycine 0 N--CA 1.477 1.403 0 CA-C-O 126.336 3.187 . . . . 0.0 110.7 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -142.0 -130.2 0.1 Allowed 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 108.807 -3.697 . . . . 0.0 113.2 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.409 ' CB ' ' HG3' ' A' ' 73' ' ' GLU . 0.7 OUTLIER -176.3 111.39 0.1 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 120.006 1.276 . . . . 0.0 110.931 -179.865 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.492 HG22 ' HA3' ' A' ' 100' ' ' GLY . 58.8 t -137.59 144.58 31.01 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.174 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -35.77 -75.94 0.03 OUTLIER 'General case' 0 CA--C 1.507 -0.703 1 O-C-N 130.108 4.63 . . . . 0.0 110.69 -179.589 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.595 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 7.7 m 71.23 61.56 0.17 Allowed 'General case' 0 CA--C 1.497 -1.067 0 C-N-CA 128.758 2.823 . . . . 0.0 112.878 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 1.4 tp -82.23 136.38 35.1 Favored 'General case' 0 N--CA 1.43 -1.459 1 CA-C-N 107.723 -4.308 . . . . 0.0 110.44 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.785 HG21 ' CD2' ' A' ' 65' ' ' PHE . 47.8 t -108.83 147.63 13.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 125.244 1.418 . . . . 0.0 108.449 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.259 53.3 m -161.12 152.35 18.85 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 111.419 -2.628 . . . . 0.0 112.07 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.838 ' CD1' HG11 ' A' ' 67' ' ' VAL 0.268 19.1 m95 -92.47 121.97 34.45 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 127.341 2.256 . . . . 0.0 105.043 179.738 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HB2' HG23 ' A' ' 95' ' ' VAL . 3.4 tt0 -88.22 -148.75 0.16 Allowed 'General case' 0 CA--C 1.477 -1.864 0 CA-C-O 126.381 2.991 . . . . 0.0 112.189 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -42.22 95.86 Favored Glycine 0 N--CA 1.488 2.119 0 N-CA-C 103.342 -3.903 . . . . 0.0 103.342 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -169.8 67.35 0.05 Allowed 'General case' 0 C--O 1.21 -1.008 1 O-C-N 130.04 4.023 . . . . 0.0 110.809 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.42 ' O ' ' CE3' ' A' ' 89' ' ' TRP . 1.7 t 176.15 169.9 0.42 Allowed 'General case' 0 C--O 1.2 -1.549 0 N-CA-C 117.19 2.293 . . . . 0.0 117.19 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.589 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -96.8 94.22 7.14 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 129.103 2.961 . . . . 0.0 113.921 179.364 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.408 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.319 50.5 t -103.75 141.28 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.898 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 179.776 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.1 OUTLIER -143.81 127.77 17.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 125.433 1.708 . . . . 0.0 107.705 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.425 HG22 ' H ' ' A' ' 97' ' ' VAL . 35.4 m -104.63 98.8 7.29 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.442 0 CA-C-O 127.234 3.397 . . . . 0.0 118.437 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.47 ' CB ' HG11 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -73.75 92.24 1.99 Allowed 'General case' 0 C--N 1.355 0.826 0 O-C-N 117.594 -3.191 . . . . 0.0 109.045 179.683 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.424 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.5 OUTLIER -97.41 87.29 4.09 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 108.649 -3.887 . . . . 0.0 111.403 -179.761 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.492 ' HA3' HG22 ' A' ' 83' ' ' VAL . . . -145.59 91.83 0.16 Allowed Glycine 0 C--O 1.211 -1.306 0 C-N-CA 117.16 -2.448 . . . . 0.0 113.571 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 49.63 -70.78 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.228 0 CA-C-N 110.712 -2.744 . . . . 0.0 115.401 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.431 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -100.45 -73.44 0.64 Allowed 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -179.004 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -48.78 160.21 0.2 Allowed 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 -179.445 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 63.0 m-80 -128.84 76.91 1.75 Allowed 'General case' 0 N--CA 1.491 1.599 2 O-C-N 131.759 5.662 . . . . 0.0 102.344 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.406 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 13.7 mmm-85 -87.13 -3.7 59.08 Favored 'General case' 0 C--O 1.212 -0.901 0 O-C-N 127.637 3.086 . . . . 0.0 114.383 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -34.86 86.21 0.01 OUTLIER Glycine 0 CA--C 1.535 1.322 2 CA-C-N 105.796 -5.184 . . . . 0.0 117.24 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.806 ' CZ2' HD21 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -84.66 132.44 34.47 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 127.275 2.397 . . . . 0.0 110.289 178.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.422 ' C ' ' NE2' ' A' ' 109' ' ' GLN . 0.3 OUTLIER -159.78 168.87 24.87 Favored 'General case' 0 C--O 1.2 -1.511 1 O-C-N 129.403 4.189 . . . . 0.0 118.458 -179.558 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.55 ' HB3' HD21 ' A' ' 116' ' ' LEU . 8.8 mm-40 -128.78 169.61 14.33 Favored 'General case' 0 C--N 1.365 1.267 0 CA-C-N 110.152 -3.204 . . . . 0.0 110.125 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.445 ' CZ2' ' HB2' ' A' ' 119' ' ' GLU . 0.2 OUTLIER -166.46 14.39 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.074 1 O-C-N 129.351 4.157 . . . . 0.0 118.565 179.263 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.752 HG21 ' HA ' ' A' ' 4' ' ' ASP . 25.4 t 29.86 105.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.475 -1.912 0 CA-C-O 127.72 3.628 . . . . 0.0 119.673 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -123.05 49.64 1.63 Allowed 'General case' 0 N--CA 1.484 1.271 0 O-C-N 118.479 -2.638 . . . . 0.0 114.033 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.33 -132.82 6.38 Favored Glycine 0 C--O 1.202 -1.854 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.429 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.94 38.59 1.61 Allowed 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 127.677 2.391 . . . . 0.0 114.113 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.451 ' HB3' ' HA ' ' A' ' 132' ' ' LYS . 54.9 pttt -168.2 162.17 12.7 Favored 'General case' 0 CA--C 1.515 -0.384 1 O-C-N 130.747 5.029 . . . . 0.0 110.129 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.59 HD12 HG22 ' A' ' 111' ' ' VAL . 1.4 tt -118.8 104.59 10.71 Favored 'General case' 0 C--O 1.207 -1.165 0 O-C-N 126.285 2.241 . . . . 0.0 114.371 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -57.94 110.35 0.9 Allowed 'General case' 0 C--O 1.201 -1.491 1 O-C-N 129.554 4.283 . . . . 0.0 115.343 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -98.37 71.52 2.05 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 127.803 3.19 . . . . 0.0 106.533 179.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.445 ' HB2' ' CZ2' ' A' ' 110' ' ' TRP . 20.3 mt-10 -83.5 105.58 14.55 Favored 'General case' 0 CA--C 1.484 -1.564 1 O-C-N 130.294 4.746 . . . . 0.0 112.277 -179.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.772 HD12 ' O ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -109.15 155.57 20.87 Favored 'General case' 0 CA--C 1.486 -1.493 0 CA-C-N 114.151 -1.386 . . . . 0.0 108.376 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.772 ' O ' HD12 ' A' ' 120' ' ' LEU . 1.9 m -109.9 161.48 15.44 Favored 'General case' 0 CA--C 1.489 -1.391 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.661 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -161.45 72.39 0.41 Allowed 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 121.259 1.845 . . . . 0.0 115.008 -179.957 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 34.6 67.1 0.28 Allowed Glycine 0 N--CA 1.435 -1.374 0 C-N-CA 126.397 1.951 . . . . 0.0 114.557 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 119.43 -56.15 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.342 0 O-C-N 128.888 3.346 . . . . 0.0 109.85 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.429 ' C ' HG23 ' A' ' 126' ' ' VAL . 32.2 mm-40 -75.44 162.13 28.61 Favored 'General case' 0 C--N 1.352 0.683 0 O-C-N 127.972 3.295 . . . . 0.0 107.627 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.429 HG23 ' C ' ' A' ' 125' ' ' GLN . 7.7 t -146.18 82.7 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.497 -1.074 0 CA-C-N 109.214 -3.63 . . . . 0.0 113.335 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 38.8 t -51.26 144.53 9.46 Favored 'General case' 0 CA--C 1.504 -0.805 0 O-C-N 124.644 1.215 . . . . 0.0 109.614 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 1.2 ttm180 -135.39 63.79 1.6 Allowed 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 116.953 -1.498 . . . . 0.0 113.215 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -48.18 168.07 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.727 1 O-C-N 129.767 4.417 . . . . 0.0 115.484 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 21.2 t -135.35 120.73 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 102.71 -3.071 . . . . 0.0 102.71 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 30.8 m-85 -102.12 178.87 4.48 Favored 'General case' 0 CA--C 1.475 -1.934 0 CA-C-O 127.098 3.332 . . . . 0.0 118.538 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.451 ' HA ' ' HB3' ' A' ' 115' ' ' LYS . 0.1 OUTLIER -168.85 117.78 0.69 Allowed 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 110.593 -3.003 . . . . 0.0 108.947 -179.55 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.465 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 28.2 ttpt -59.38 108.07 0.66 Allowed 'General case' 0 CA--C 1.488 -1.421 0 O-C-N 128.104 3.377 . . . . 0.0 116.156 -179.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.501 -0.91 0 CA-C-O 114.786 -2.53 . . . . 0.0 113.489 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.885 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.667 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.8 m 66.21 -62.91 0.25 Allowed 'General case' 0 C--O 1.202 -1.417 0 O-C-N 125.712 1.882 . . . . 0.0 110.82 179.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.551 ' HG2' ' CZ3' ' A' ' 89' ' ' TRP . 0.5 OUTLIER -78.61 -52.43 8.47 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 119.32 3.081 . . . . 0.0 119.32 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.32 122.2 27.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -134.05 31.38 3.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 113.744 -3.026 . . . . 0.0 108.621 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.438 ' HA ' HG23 ' A' ' 43' ' ' ILE . 2.4 m120 -24.41 128.16 0.03 OUTLIER 'General case' 0 C--O 1.236 0.381 1 O-C-N 130.136 4.648 . . . . 0.0 110.63 179.568 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 42' ' ' ILE . . . -175.37 -118.15 0.51 Allowed Glycine 0 C--O 1.221 -0.693 0 C-N-CA 115.746 -3.121 . . . . 0.0 114.511 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.565 ' CG2' HG23 ' A' ' 40' ' ' THR . 98.4 m 177.67 144.54 0.11 Allowed 'General case' 0 N--CA 1.476 0.85 1 O-C-N 132.504 5.473 . . . . 0.0 106.018 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.56 ' CD1' ' C ' ' A' ' 8' ' ' THR . 0.0 OUTLIER -144.5 90.07 2.06 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -179.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -57.69 100.75 0.06 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 128.493 3.621 . . . . 0.0 106.779 179.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.403 ' O ' ' CB ' ' A' ' 12' ' ' GLU . 32.2 ttm -32.61 -59.89 0.31 Allowed 'General case' 0 N--CA 1.479 0.99 0 O-C-N 129.099 4.0 . . . . 0.0 109.611 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.403 ' CB ' ' O ' ' A' ' 11' ' ' MET . 1.9 tt0 98.58 -44.54 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.012 0 O-C-N 125.946 2.029 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.25 15.7 m -174.62 149.41 1.25 Allowed 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 110.015 -3.266 . . . . 0.0 113.711 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -125.38 139.62 53.51 Favored 'General case' 0 C--O 1.213 -0.867 2 O-C-N 129.816 4.447 . . . . 0.0 110.495 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -71.08 -95.53 0.01 OUTLIER 'General case' 0 CA--C 1.485 -1.531 0 CA-C-N 109.375 -3.557 . . . . 0.0 111.31 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.401 ' OD1' ' N ' ' A' ' 16' ' ' ASN . 5.1 p30 -83.94 147.18 27.62 Favored 'General case' 0 C--O 1.204 -1.297 0 O-C-N 119.225 -2.172 . . . . 0.0 109.004 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -116.8 -68.39 0.92 Allowed 'General case' 0 C--O 1.204 -1.316 0 O-C-N 127.041 2.713 . . . . 0.0 111.263 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 -46.73 87.01 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 117.747 2.499 . . . . 0.0 117.747 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.495 ' HA2' ' CB ' ' A' ' 22' ' ' LYS . . . -53.18 -25.36 25.11 Favored Glycine 0 CA--C 1.491 -1.415 0 O-C-N 128.786 3.804 . . . . 0.0 113.308 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.506 ' CD1' ' C ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -75.14 -43.18 54.05 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 104.734 -2.321 . . . . 0.0 104.734 179.399 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.407 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -72.12 -21.54 61.46 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 116.487 -2.085 . . . . 0.0 112.302 -179.728 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.495 ' CB ' ' HA2' ' A' ' 19' ' ' GLY . 1.3 ttmt -76.87 -40.92 45.86 Favored 'General case' 0 C--O 1.207 -1.135 0 O-C-N 129.023 3.952 . . . . 0.0 113.084 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.405 ' CB ' ' HB2' ' A' ' 122' ' ' CYS . . . -56.3 -44.38 79.83 Favored 'General case' 0 C--O 1.214 -0.815 0 O-C-N 128.905 3.878 . . . . 0.0 115.222 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.064 HD11 ' HB2' ' A' ' 79' ' ' ASP . 0.1 OUTLIER -88.96 1.6 55.21 Favored 'General case' 0 N--CA 1.491 1.576 2 O-C-N 130.76 5.038 . . . . 0.0 109.177 -178.661 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 50.22 82.92 0.05 OUTLIER 'General case' 0 CA--C 1.48 -1.726 0 CA-C-O 127.83 3.681 . . . . 0.0 114.447 178.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.413 HG21 HD13 ' A' ' 26' ' ' ILE . 2.2 tt -110.8 -33.56 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.632 0 CA-C-N 110.946 -2.843 . . . . 0.0 111.873 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 179.82 127.59 0.08 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.539 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -79.18 12.88 2.08 Favored 'General case' 0 CA--C 1.5 -0.946 0 C-N-CA 116.162 -2.215 . . . . 0.0 116.485 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -172.61 75.05 0.04 OUTLIER 'General case' 0 C--O 1.208 -1.102 0 CA-C-O 123.09 1.424 . . . . 0.0 110.712 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.66 -31.67 6.1 Favored 'General case' 0 C--N 1.353 0.724 2 CA-C-N 106.348 -4.933 . . . . 0.0 115.872 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.418 ' CG ' ' N ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -57.04 -164.57 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.963 1 O-C-N 129.654 4.346 . . . . 0.0 112.514 -179.775 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' A' ' 31' ' ' ARG . 14.5 tttm 67.76 39.61 2.63 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 125.658 1.849 . . . . 0.0 108.58 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.502 HG22 ' N ' ' A' ' 34' ' ' ALA . 0.4 OUTLIER -166.0 -49.78 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.93 2 O-C-N 130.095 4.622 . . . . 0.0 111.534 179.934 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.502 ' N ' HG22 ' A' ' 33' ' ' ILE . . . -93.14 18.55 9.2 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 119.657 -1.902 . . . . 0.0 113.912 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.6 t -40.31 -36.35 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.278 0 CA-C-O 124.231 1.967 . . . . 0.0 110.372 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.684 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -154.69 153.86 31.99 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 109.831 -3.349 . . . . 0.0 107.687 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.701 HD13 ' CZ ' ' A' ' 58' ' ' PHE . 2.1 pt? 148.79 -18.21 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.894 2 O-C-N 135.608 8.068 . . . . 0.0 110.811 178.755 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.695 ' HA ' ' HB3' ' A' ' 56' ' ' SER 0.265 0.5 OUTLIER -77.13 51.32 0.81 Allowed 'General case' 0 CA--C 1.48 -1.728 0 C-N-CA 130.547 3.539 . . . . 0.0 119.063 -176.837 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.431 ' HG2' ' N ' ' A' ' 40' ' ' THR . 38.9 tt0 -122.42 144.25 49.16 Favored 'General case' 0 CA--C 1.493 -1.224 0 O-C-N 119.106 -2.246 . . . . 0.0 116.69 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.566 HG22 ' O ' ' A' ' 40' ' ' THR . 99.6 m 97.85 64.5 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.327 0 C-N-CA 130.352 3.461 . . . . 0.0 111.072 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.499 ' C ' ' HD3' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -76.46 150.07 36.73 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 108.406 -3.997 . . . . 0.0 101.93 179.752 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.551 HG22 ' N ' ' A' ' 43' ' ' ILE . 2.3 mt -143.0 158.5 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 125.65 1.844 . . . . 0.0 109.246 179.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.551 ' N ' HG22 ' A' ' 42' ' ' ILE 0.292 18.2 tt -132.95 148.17 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.498 1 O-C-N 129.399 4.187 . . . . 0.0 111.428 -179.685 . . . . . . . . 4 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 44' ' ' VAL . 77.7 t -154.95 85.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.197 -1.658 0 CA-C-N 111.93 -2.395 . . . . 0.0 110.066 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.74 84.72 6.3 Favored 'General case' 0 CA--C 1.485 -1.519 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -77.07 -13.7 59.92 Favored 'General case' 0 C--N 1.364 1.198 0 O-C-N 126.933 2.646 . . . . 0.0 117.985 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 146.33 -103.3 0.27 Allowed Glycine 0 C--O 1.212 -1.273 0 N-CA-C 111.432 -0.667 . . . . 0.0 111.432 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -102.07 40.24 1.36 Allowed 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 124.58 0.812 . . . . 0.0 110.776 179.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -176.29 86.39 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 O-C-N 127.048 2.717 . . . . 0.0 109.318 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.515 ' CD1' ' C ' ' A' ' 50' ' ' PHE . 1.8 t80 -99.19 135.12 41.06 Favored 'General case' 0 CA--C 1.486 -1.499 1 O-C-N 131.187 5.304 . . . . 0.0 112.105 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.5 mttt -144.48 90.53 2.1 Favored 'General case' 0 CA--C 1.481 -1.71 0 O-C-N 128.63 3.706 . . . . 0.0 117.421 -179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.584 ' HB ' HD23 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -70.75 120.06 15.8 Favored 'General case' 0 CA--C 1.501 -0.917 0 O-C-N 128.276 3.485 . . . . 0.0 106.907 179.728 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.53 ' HD2' HD12 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -124.83 146.17 49.4 Favored 'General case' 0 CA--C 1.49 -1.344 0 C-N-CA 117.407 -1.717 . . . . 0.0 107.967 -178.605 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.468 ' CG2' ' HA ' ' A' ' 60' ' ' ASN . 5.7 t -105.95 175.18 5.58 Favored 'General case' 0 CA--C 1.493 -1.216 0 O-C-N 125.147 1.529 . . . . 0.0 113.22 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -148.96 37.53 0.79 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.695 ' HB3' ' HA ' ' A' ' 38' ' ' THR . 1.1 p -62.54 142.15 58.11 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 128.513 2.725 . . . . 0.0 108.314 179.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 37' ' ' LEU 0.254 0.1 OUTLIER -39.45 -50.56 2.13 Favored 'General case' 0 N--CA 1.489 1.518 1 O-C-N 130.608 4.942 . . . . 0.0 106.669 -179.952 . . . . . . . . 5 4 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.701 ' CZ ' HD13 ' A' ' 37' ' ' LEU . 12.2 p90 -166.57 76.38 0.19 Allowed 'General case' 0 C--N 1.366 1.318 0 O-C-N 126.967 2.667 . . . . 0.0 115.203 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.62 51.29 0.0 OUTLIER 'General case' 0 C--N 1.363 1.186 1 CA-C-N 107.298 -4.501 . . . . 0.0 111.235 179.788 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.468 ' HA ' ' CG2' ' A' ' 54' ' ' THR . 15.6 m-80 -86.59 107.17 18.03 Favored 'General case' 0 C--O 1.219 -0.543 2 CA-C-N 107.799 -4.273 . . . . 0.0 112.777 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -124.94 98.3 5.63 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 127.943 3.277 . . . . 0.0 106.816 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.63 152.68 41.56 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 127.495 2.997 . . . . 0.0 115.552 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.584 HD23 ' HB ' ' A' ' 52' ' ' THR . 11.9 tp -117.8 47.17 1.6 Allowed 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 112.95 -1.932 . . . . 0.0 111.456 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.7 p-10 -87.1 94.37 9.62 Favored 'General case' 0 CA--C 1.492 -1.259 0 CA-C-O 124.479 2.085 . . . . 0.0 112.544 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -140.05 -153.01 0.44 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 126.103 1.761 . . . . 0.0 106.528 179.447 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.417 ' OG1' ' N ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -151.03 -178.63 6.72 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-O 116.873 -1.537 . . . . 0.0 108.017 179.398 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.417 ' N ' ' OG1' ' A' ' 66' ' ' THR . 63.4 t -80.64 119.24 29.81 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.642 1 O-C-N 133.74 6.9 . . . . 0.0 112.597 179.697 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.52 9.48 55.42 Favored Glycine 0 N--CA 1.484 1.885 0 CA-C-N 109.451 -3.522 . . . . 0.0 117.447 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.608 HG13 ' N ' ' A' ' 71' ' ' PHE 0.285 14.0 p -59.78 -17.79 13.91 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 O-C-N 124.902 1.001 . . . . 0.0 111.312 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.445 ' HG2' HD12 ' A' ' 86' ' ' LEU . 0.0 OUTLIER 61.61 63.17 1.2 Allowed 'General case' 0 CA--C 1.543 0.681 0 O-C-N 128.546 3.654 . . . . 0.0 107.433 -179.013 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.608 ' N ' HG13 ' A' ' 69' ' ' VAL . 12.0 t80 -64.85 141.46 58.77 Favored 'General case' 0 CA--C 1.494 -1.211 2 CA-C-N 106.33 -4.941 . . . . 0.0 118.954 -178.164 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -100.32 104.15 15.59 Favored 'General case' 0 C--O 1.21 -1.026 0 O-C-N 119.347 -2.096 . . . . 0.0 110.225 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -72.11 74.32 0.93 Allowed 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 125.336 2.493 . . . . 0.0 109.642 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -80.24 116.59 20.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 109.509 -3.496 . . . . 0.0 112.008 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.469 ' OG1' ' N ' ' A' ' 76' ' ' LYS . 0.2 OUTLIER -157.66 -179.47 8.19 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 114.013 -1.449 . . . . 0.0 113.04 -179.62 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.469 ' N ' ' OG1' ' A' ' 75' ' ' THR . 0.0 OUTLIER -150.54 -52.2 0.14 Allowed 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 127.185 3.374 . . . . 0.0 110.43 179.51 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -44.65 -32.88 3.1 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 108.793 -3.821 . . . . 0.0 108.261 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.0 tp -124.05 79.89 1.77 Allowed 'General case' 0 CA--C 1.529 0.165 0 O-C-N 129.22 3.541 . . . . 0.0 115.536 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 1.064 ' HB2' HD11 ' A' ' 24' ' ' LEU . 17.7 t70 85.82 -63.81 0.05 OUTLIER 'General case' 0 C--O 1.208 -1.125 0 O-C-N 127.807 3.192 . . . . 0.0 110.333 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 91.83 119.58 2.46 Favored Glycine 0 C--O 1.213 -1.177 0 CA-C-N 109.02 -3.718 . . . . 0.0 115.868 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.02 -123.55 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 O-C-N 126.818 2.128 . . . . 0.0 113.413 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.0 p30 168.8 63.44 0.0 OUTLIER 'General case' 0 C--O 1.197 -1.698 0 CA-C-N 119.923 1.238 . . . . 0.0 112.417 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.782 HG12 ' O ' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -90.84 158.93 2.86 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.027 0 CA-C-O 116.418 -1.753 . . . . 0.0 112.717 179.948 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 99' ' ' LYS . 7.8 mmpt? -68.28 169.0 11.29 Favored 'General case' 0 C--N 1.326 -0.44 1 O-C-N 129.392 4.183 . . . . 0.0 107.053 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 85' ' ' THR . 1.2 m -171.32 77.3 0.06 Allowed 'General case' 0 C--O 1.194 -1.823 1 O-C-N 131.11 5.256 . . . . 0.0 111.107 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.445 HD12 ' HG2' ' A' ' 70' ' ' GLU . 2.1 tt -68.38 141.52 55.7 Favored 'General case' 0 N--CA 1.431 -1.398 1 CA-C-N 105.975 -5.102 . . . . 0.0 109.886 179.647 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.1 t -129.91 144.43 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.069 1.347 . . . . 0.0 108.446 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.674 HG23 ' HB ' ' A' ' 95' ' ' VAL . 2.9 t -163.49 177.26 9.0 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-O 126.378 2.99 . . . . 0.0 110.482 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.658 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 65.3 m95 -102.12 133.99 46.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 C-N-CA 128.484 2.714 . . . . 0.0 110.236 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.435 ' HG2' HG21 ' A' ' 95' ' ' VAL . 1.0 OUTLIER -88.1 -37.82 15.91 Favored 'General case' 0 CA--C 1.496 -1.112 1 CA-C-O 131.651 5.501 . . . . 0.0 111.605 179.871 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.08 65.32 0.32 Allowed Glycine 0 N--CA 1.481 1.655 2 CA-C-N 106.429 -4.896 . . . . 0.0 102.226 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.44 ' ND2' ' HB ' ' A' ' 93' ' ' THR . 1.0 OUTLIER 149.26 -36.2 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.145 1 O-C-N 132.888 5.699 . . . . 0.0 111.007 -179.87 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.44 ' HB ' ' ND2' ' A' ' 92' ' ' ASN . 0.7 OUTLIER -136.46 174.55 10.5 Favored 'General case' 0 N--CA 1.431 -1.388 0 N-CA-C 119.19 3.033 . . . . 0.0 119.19 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.87 82.6 2.27 Favored 'General case' 0 CA--C 1.485 -1.548 0 C-N-CA 129.596 3.159 . . . . 0.0 115.766 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.674 ' HB ' HG23 ' A' ' 88' ' ' THR 0.339 97.9 t -77.19 131.53 34.6 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-N 108.888 -3.778 . . . . 0.0 113.188 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.546 ' CB ' ' CZ2' ' A' ' 107' ' ' TRP . 0.5 OUTLIER -141.39 134.17 28.77 Favored 'General case' 0 C--O 1.201 -1.449 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -131.63 123.2 51.7 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.107 0 CA-C-N 109.58 -3.463 . . . . 0.0 116.035 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.582 ' CB ' ' HB2' ' A' ' 105' ' ' ARG . 1.4 tt0 -85.37 98.67 10.69 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-O 126.747 3.165 . . . . 0.0 110.382 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.782 ' O ' HG12 ' A' ' 83' ' ' VAL . 7.4 mttm -81.65 158.79 24.17 Favored 'General case' 0 C--O 1.205 -1.251 1 CA-C-N 108.11 -4.132 . . . . 0.0 106.846 -179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.4 138.93 5.85 Favored Glycine 0 C--O 1.211 -1.306 0 O-C-N 126.947 2.654 . . . . 0.0 107.212 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.471 ' HG2' ' N ' ' A' ' 102' ' ' LYS . 71.2 tt0 63.24 163.26 0.11 Allowed 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 109.48 -3.36 . . . . 0.0 108.718 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.471 ' N ' ' HG2' ' A' ' 101' ' ' GLU . 0.1 OUTLIER -39.96 -58.48 1.4 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 112.114 -2.312 . . . . 0.0 111.548 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.17 146.22 0.93 Allowed 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 111.128 -2.76 . . . . 0.0 113.192 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -127.17 64.55 1.32 Allowed 'General case' 0 N--CA 1.483 1.22 2 O-C-N 130.141 4.65 . . . . 0.0 103.576 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.582 ' HB2' ' CB ' ' A' ' 98' ' ' GLN . 3.6 mmm180 -67.33 69.73 0.1 Allowed 'General case' 0 N--CA 1.478 0.972 0 O-C-N 128.127 3.392 . . . . 0.0 113.853 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -114.08 95.92 0.76 Allowed Glycine 0 C--O 1.205 -1.67 0 CA-C-O 113.689 -3.84 . . . . 0.0 111.769 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.546 ' CZ2' ' CB ' ' A' ' 96' ' ' CYS . 9.3 p90 -88.71 1.8 54.48 Favored 'General case' 0 C--O 1.195 -1.791 2 O-C-N 134.226 6.486 . . . . 0.0 115.656 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.47 ' HG3' ' CH2' ' A' ' 110' ' ' TRP . 7.0 ptpt -24.5 141.63 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.359 2 O-C-N 130.482 4.864 . . . . 0.0 113.819 -179.338 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.592 HE21 ' N ' ' A' ' 109' ' ' GLN 0.287 0.3 OUTLIER -102.96 169.98 8.25 Favored 'General case' 0 C--N 1.362 1.147 0 CA-C-N 112.539 -2.119 . . . . 0.0 109.793 -179.786 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.489 ' C ' HG23 ' A' ' 111' ' ' VAL . 19.0 m95 -127.11 -57.93 1.3 Allowed 'General case' 0 C--O 1.208 -1.11 1 O-C-N 129.587 4.304 . . . . 0.0 116.968 179.47 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.489 HG23 ' C ' ' A' ' 110' ' ' TRP . 21.2 t 93.05 68.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-O 127.635 3.588 . . . . 0.0 108.654 -175.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -102.21 120.27 40.19 Favored 'General case' 0 CA--C 1.478 -1.818 1 CA-C-N 108.069 -4.15 . . . . 0.0 118.302 -176.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 14.79 83.73 0.01 OUTLIER Glycine 0 C--O 1.215 -1.073 0 C-N-CA 127.289 2.376 . . . . 0.0 116.183 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.2 m-20 49.38 81.11 0.06 Allowed 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 115.81 -2.043 . . . . 0.0 116.239 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.467 ' HB2' ' HB3' ' A' ' 131' ' ' PHE . 0.4 OUTLIER 148.13 -167.77 0.0 OUTLIER 'General case' 0 CA--C 1.496 -1.132 1 O-C-N 133.79 6.931 . . . . 0.0 110.46 -179.855 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.472 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -145.99 71.26 1.26 Allowed 'General case' 0 CA--C 1.493 -1.245 0 O-C-N 128.938 3.899 . . . . 0.0 115.589 -179.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -44.67 126.23 5.42 Favored 'General case' 0 N--CA 1.448 -0.564 0 O-C-N 126.727 2.517 . . . . 0.0 116.255 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.511 ' CD2' ' HG3' ' A' ' 109' ' ' GLN . 28.4 mt -110.24 117.7 34.37 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 111.396 -2.638 . . . . 0.0 106.578 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.37 105.22 13.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 115.728 -2.082 . . . . 0.0 106.198 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -115.13 118.96 34.83 Favored 'General case' 0 N--CA 1.489 1.487 1 O-C-N 131.328 5.392 . . . . 0.0 114.023 -179.739 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.2 m -96.72 145.81 25.46 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 110.643 -2.981 . . . . 0.0 103.758 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.505 ' HB3' ' HD3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -133.62 39.68 3.18 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-O 125.382 2.515 . . . . 0.0 111.295 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 114.06 -80.97 0.29 Allowed Glycine 0 C--O 1.218 -0.851 0 CA-C-N 113.428 -1.715 . . . . 0.0 109.96 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.24 -18.77 13.52 Favored 'General case' 0 CA--C 1.494 -1.202 0 C-N-CA 125.547 1.539 . . . . 0.0 111.876 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -103.55 159.93 15.17 Favored 'General case' 0 C--O 1.198 -1.643 0 O-C-N 125.855 1.972 . . . . 0.0 107.611 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.45 ' O ' HG23 ' A' ' 126' ' ' VAL . 11.0 m -134.01 131.53 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 CA-C-N 109.215 -3.629 . . . . 0.0 112.542 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.7 m -117.86 119.64 35.49 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 116.297 -1.811 . . . . 0.0 110.006 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.24 102.95 12.64 Favored 'General case' 0 N--CA 1.484 1.269 1 O-C-N 129.258 4.099 . . . . 0.0 110.885 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -68.4 167.17 15.19 Favored 'General case' 0 CA--C 1.491 -1.309 0 C-N-CA 114.121 -3.032 . . . . 0.0 116.049 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.3 t -141.8 81.07 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.605 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.467 ' HB3' ' HB2' ' A' ' 115' ' ' LYS . 16.2 m-85 -66.92 175.58 2.42 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 109.968 -3.287 . . . . 0.0 117.976 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . 0.258 4.3 tptt -159.93 99.7 1.39 Allowed 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 109.036 -3.711 . . . . 0.0 107.872 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.529 ' HB2' ' CZ3' ' A' ' 9' ' ' TRP . 28.1 ttpt -57.56 110.03 0.8 Allowed 'General case' 0 C--O 1.218 -0.585 0 CA-C-O 115.539 -2.172 . . . . 0.0 109.904 178.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 8' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.492 -1.262 0 N-CA-C 118.756 2.873 . . . . 0.0 118.756 -178.65 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ttt . . . . . 0 N--CA 1.503 2.192 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.818 HG21 ' HB3' ' A' ' 92' ' ' ASN . 0.2 OUTLIER -70.08 149.98 47.06 Favored 'General case' 0 C--N 1.353 0.748 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.508 179.75 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.539 ' HE2' ' CE3' ' A' ' 89' ' ' TRP . 1.4 mtmt 63.07 176.97 0.15 Allowed 'General case' 0 N--CA 1.439 -1.015 0 O-C-N 126.437 2.335 . . . . 0.0 116.166 179.907 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 29.2 t0 44.9 71.37 0.27 Allowed 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 124.501 2.096 . . . . 0.0 107.759 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 -97.57 -75.88 0.53 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.205 -179.498 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.424 ' OD1' ' N ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 47.26 135.05 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.629 1 O-C-N 131.897 5.748 . . . . 0.0 114.473 -176.677 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.3 -133.87 1.63 Allowed Glycine 0 C--O 1.206 -1.603 0 CA-C-N 109.874 -3.33 . . . . 0.0 114.431 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.9 t -174.47 62.36 0.02 OUTLIER 'General case' 0 C--O 1.204 -1.321 1 O-C-N 131.476 4.868 . . . . 0.0 108.129 -179.023 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.621 ' CZ2' HD13 ' A' ' 116' ' ' LEU 0.253 0.0 OUTLIER -51.82 106.77 0.16 Allowed 'General case' 0 CA--C 1.507 -0.675 1 O-C-N 130.677 4.986 . . . . 0.0 115.595 -179.495 . . . . . . . . 5 4 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -48.8 -25.81 2.05 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 116.966 -1.493 . . . . 0.0 114.162 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.5 ttp 83.65 -74.39 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.9 1 O-C-N 129.609 4.318 . . . . 0.0 105.744 -179.855 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 102.1 -48.08 0.0 OUTLIER 'General case' 0 C--O 1.2 -1.527 0 O-C-N 128.028 3.33 . . . . 0.0 111.773 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.6 137.13 28.12 Favored 'General case' 0 C--N 1.361 1.087 0 CA-C-N 110.143 -3.208 . . . . 0.0 110.006 -179.803 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -121.01 100.23 6.95 Favored 'General case' 0 C--O 1.197 -1.686 0 N-CA-C 117.942 2.571 . . . . 0.0 117.942 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.518 ' HB3' ' C ' ' A' ' 128' ' ' ARG . 15.9 pt-20 5.37 -133.5 0.0 OUTLIER 'General case' 0 CA--C 1.473 -1.987 2 O-C-N 136.34 8.525 . . . . 0.0 117.005 178.402 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 0.3 OUTLIER -112.64 137.25 51.18 Favored 'General case' 0 C--O 1.203 -1.354 1 O-C-N 114.651 -5.031 . . . . 0.0 106.755 -179.519 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.515 ' CE2' HG22 ' A' ' 35' ' ' VAL . 1.9 p90 -118.19 -30.15 5.37 Favored 'General case' 0 CA--C 1.487 -1.469 0 O-C-N 127.565 3.041 . . . . 0.0 114.908 -178.563 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 22' ' ' LYS . 12.3 tt0 -74.78 -53.84 8.44 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-O 115.778 -2.058 . . . . 0.0 110.551 179.757 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.52 ' HA2' ' HB3' ' A' ' 22' ' ' LYS . . . -59.3 -24.35 58.9 Favored Glycine 0 N--CA 1.474 1.217 1 O-C-N 132.869 6.356 . . . . 0.0 111.479 178.741 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -70.77 -46.74 62.38 Favored 'General case' 0 C--O 1.195 -1.767 0 CA-C-O 125.752 2.692 . . . . 0.0 106.047 179.676 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.9 mmt -73.35 -23.71 60.25 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.495 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.52 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -78.99 -28.06 43.41 Favored 'General case' 0 C--O 1.206 -1.231 0 O-C-N 127.901 3.251 . . . . 0.0 110.124 -179.862 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -63.9 -37.62 88.06 Favored 'General case' 0 C--O 1.208 -1.097 1 O-C-N 129.517 4.26 . . . . 0.0 111.734 -179.778 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.862 HD12 ' HB2' ' A' ' 79' ' ' ASP 0.361 1.5 mm? -81.45 -56.23 4.17 Favored 'General case' 0 C--O 1.208 -1.128 2 CA-C-N 105.517 -5.31 . . . . 0.0 108.501 179.98 . . . . . . . . 4 3 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.291 19.3 t0 83.71 79.01 0.02 OUTLIER 'General case' 0 CA--C 1.484 -1.577 3 O-C-N 133.48 6.738 . . . . 0.0 107.258 -179.523 . . . . . . . . 3 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.645 HD12 ' O ' ' A' ' 78' ' ' LEU . 14.0 tt -102.29 41.13 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.839 0 CA-C-O 128.397 3.951 . . . . 0.0 110.052 179.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 73.04 164.35 0.28 Allowed 'General case' 0 N--CA 1.487 1.408 0 CA-C-N 109.701 -3.409 . . . . 0.0 111.641 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -87.45 84.69 7.13 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 118.812 0.733 . . . . 0.0 112.422 179.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 169.53 156.61 0.05 Allowed 'General case' 0 C--N 1.364 1.231 0 O-C-N 126.382 2.301 . . . . 0.0 106.07 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.274 0.4 OUTLIER 101.06 -19.22 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.847 1 O-C-N 130.876 5.11 . . . . 0.0 113.935 179.669 . . . . . . . . 4 3 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.6 162.16 15.99 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 130.562 3.545 . . . . 0.0 108.865 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 84.36 3.14 0.79 Allowed 'General case' 0 C--N 1.31 -1.139 0 O-C-N 128.431 3.582 . . . . 0.0 111.827 -179.826 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 mp -128.87 -33.82 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.137 1 O-C-N 130.191 4.682 . . . . 0.0 111.404 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.48 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -99.52 16.05 24.54 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.914 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.515 HG22 ' CE2' ' A' ' 17' ' ' PHE . 12.1 t -26.78 -52.23 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.2 -1.547 0 O-C-N 127.167 2.792 . . . . 0.0 111.0 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.99 117.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 2 O-C-N 131.132 5.27 . . . . 0.0 109.144 179.674 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.92 HD12 ' N ' ' A' ' 38' ' ' THR . 2.5 pp -87.3 -45.01 10.99 Favored 'General case' 0 N--CA 1.433 -1.288 1 O-C-N 129.406 4.191 . . . . 0.0 110.664 -179.923 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.92 ' N ' HD12 ' A' ' 37' ' ' LEU . 1.3 m 145.64 117.31 0.0 OUTLIER 'General case' 0 CA--C 1.494 -1.206 1 O-C-N 134.569 7.418 . . . . 0.0 116.915 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.588 ' HG2' ' N ' ' A' ' 56' ' ' SER . 5.4 tp60 -158.12 -98.94 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 115.677 -2.409 . . . . 0.0 116.456 179.148 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.53 ' N ' ' HG3' ' A' ' 39' ' ' GLN . 1.9 m 157.72 151.55 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.597 1 O-C-N 132.633 6.208 . . . . 0.0 111.768 -175.359 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.554 ' HE3' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -110.27 131.93 54.62 Favored 'General case' 0 N--CA 1.492 1.649 1 O-C-N 129.791 4.432 . . . . 0.0 101.656 177.979 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.516 HG22 ' N ' ' A' ' 43' ' ' ILE . 3.2 mp -107.8 164.43 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 126.333 2.271 . . . . 0.0 111.19 179.511 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.516 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -141.94 143.59 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.407 0 CA-C-N 112.386 -2.188 . . . . 0.0 106.855 179.789 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 45' ' ' GLN . 4.9 t -117.15 -66.14 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.223 0 C-N-CA 115.735 -2.386 . . . . 0.0 109.844 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.442 ' N ' HG12 ' A' ' 44' ' ' VAL . 1.0 OUTLIER 57.84 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 117.156 2.28 . . . . 0.0 117.156 -179.88 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -121.43 29.11 7.39 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 127.209 2.818 . . . . 0.0 116.685 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 117.57 -74.52 0.28 Allowed Glycine 0 C--O 1.213 -1.17 0 CA-C-O 118.698 -1.056 . . . . 0.0 111.914 -179.799 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.683 ' O ' HG12 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -111.23 -37.62 5.25 Favored 'General case' 0 N--CA 1.438 -1.037 0 O-C-N 126.463 1.92 . . . . 0.0 112.753 -179.828 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -83.75 85.43 7.29 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.519 1.928 . . . . 0.0 111.915 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.863 ' CD2' HD22 ' A' ' 94' ' ' LEU . 76.7 t80 -86.96 79.89 8.61 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 127.293 2.871 . . . . 0.0 112.315 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -95.96 77.13 3.15 Favored 'General case' 0 CA--C 1.481 -1.7 1 O-C-N 129.678 4.361 . . . . 0.0 118.807 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.534 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -65.37 168.92 6.45 Favored 'General case' 0 C--N 1.367 1.332 0 O-C-N 128.221 3.451 . . . . 0.0 107.319 179.812 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.521 ' N ' ' CG2' ' A' ' 52' ' ' THR 0.279 13.1 ttpt -160.3 164.99 32.14 Favored 'General case' 0 N--CA 1.488 1.473 1 O-C-N 129.125 4.016 . . . . 0.0 111.369 -175.856 . . . . . . . . 4 3 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.426 HG22 ' O ' ' A' ' 59' ' ' ARG . 1.4 m -140.45 103.31 4.53 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 110.386 -3.097 . . . . 0.0 107.233 178.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -78.01 -20.17 53.01 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 111.374 -2.648 . . . . 0.0 116.187 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.588 ' N ' ' HG2' ' A' ' 39' ' ' GLN . 2.6 t -31.17 117.96 0.19 Allowed 'General case' 0 N--CA 1.469 0.505 1 O-C-N 132.649 6.218 . . . . 0.0 106.156 -179.838 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.651 HG22 ' CD2' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -52.85 -27.16 17.13 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 129.085 3.991 . . . . 0.0 108.396 -179.775 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.86 ' CD1' HD23 ' A' ' 37' ' ' LEU . 0.4 OUTLIER -61.49 -80.88 0.02 OUTLIER 'General case' 0 C--N 1.355 0.813 0 O-C-N 126.298 2.249 . . . . 0.0 111.297 179.907 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' O ' HG22 ' A' ' 54' ' ' THR . 0.0 OUTLIER -124.48 110.01 13.96 Favored 'General case' 0 C--N 1.368 1.373 0 O-C-N 126.842 2.589 . . . . 0.0 112.534 -179.849 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.18 83.82 1.98 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 128.421 3.576 . . . . 0.0 108.599 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.23 -27.95 29.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.812 3.195 . . . . 0.0 111.427 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.03 155.35 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 127.665 3.103 . . . . 0.0 115.257 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.989 HD21 ' CZ2' ' A' ' 107' ' ' TRP . 8.6 tp -121.16 45.28 2.31 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.371 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -81.44 99.51 8.77 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 126.28 2.238 . . . . 0.0 110.736 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.542 ' CZ ' HG11 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -149.34 173.76 13.17 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 112.831 -1.986 . . . . 0.0 107.367 179.657 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.532 ' N ' ' CG ' ' A' ' 65' ' ' PHE . 2.1 m -132.13 135.07 46.14 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-O 117.099 -1.429 . . . . 0.0 107.683 179.65 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 48' ' ' ASP . 2.1 p -49.22 146.65 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.674 0 O-C-N 126.947 2.655 . . . . 0.0 114.705 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 65.79 16.01 63.07 Favored Glycine 0 N--CA 1.485 1.904 0 O-C-N 128.688 3.742 . . . . 0.0 115.952 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . 0.305 1.2 t -86.06 -23.44 6.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.71 -179.642 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 72.97 72.1 0.13 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 128.559 3.662 . . . . 0.0 108.204 -178.832 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.551 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -58.28 94.8 0.02 OUTLIER 'General case' 0 CA--C 1.506 -0.723 1 CA-C-N 107.107 -4.588 . . . . 0.0 116.014 -179.662 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.25 96.22 2.76 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.894 -179.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.26 107.93 15.32 Favored 'General case' 0 CA--C 1.498 -1.028 0 CA-C-O 122.535 1.16 . . . . 0.0 111.827 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -75.11 -24.07 58.01 Favored 'General case' 0 C--O 1.215 -0.741 0 C-N-CA 117.539 -1.664 . . . . 0.0 110.985 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.5 m 47.75 62.9 2.24 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 112.56 -2.109 . . . . 0.0 114.501 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.58 -34.54 10.54 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 128.014 3.769 . . . . 0.0 114.318 -179.961 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.81 -20.84 76.3 Favored Glycine 0 C--O 1.209 -1.416 0 CA-C-N 109.903 -3.317 . . . . 0.0 113.175 -179.76 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.645 ' O ' HD12 ' A' ' 26' ' ' ILE . 5.2 tp -112.81 -11.02 13.53 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 128.103 2.884 . . . . 0.0 115.33 -179.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.862 ' HB2' HD12 ' A' ' 24' ' ' LEU . 2.7 t70 -173.78 -73.82 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.856 0 C-N-CA 116.079 -2.248 . . . . 0.0 111.613 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.61 76.35 0.26 Allowed Glycine 0 N--CA 1.472 1.047 0 C-N-CA 128.17 2.795 . . . . 0.0 110.681 -179.596 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -116.1 -127.86 0.29 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 109.768 -3.216 . . . . 0.0 109.977 -179.648 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 165.55 61.14 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.24 1.382 . . . . 0.0 110.887 -179.841 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.464 HG12 ' H ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -93.27 179.41 0.52 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-N 111.909 -2.405 . . . . 0.0 114.628 -179.812 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.464 ' H ' HG12 ' A' ' 83' ' ' VAL . 0.6 OUTLIER -126.2 151.71 47.01 Favored 'General case' 0 C--N 1.314 -0.949 1 O-C-N 133.682 6.864 . . . . 0.0 107.521 179.525 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.698 HG21 ' CZ3' ' A' ' 107' ' ' TRP . 24.2 m -149.01 74.16 1.24 Allowed 'General case' 0 C--O 1.203 -1.353 1 O-C-N 129.171 4.044 . . . . 0.0 113.603 -179.735 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.08 132.64 54.43 Favored 'General case' 0 N--CA 1.428 -1.529 2 CA-C-N 106.524 -4.853 . . . . 0.0 109.691 -179.614 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.542 HG11 ' CZ ' ' A' ' 65' ' ' PHE . 2.0 t -122.77 155.35 28.17 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.139 0 CA-C-O 123.705 1.717 . . . . 0.0 110.606 -179.734 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.471 HG23 ' HB ' ' A' ' 95' ' ' VAL . 1.7 t -162.68 157.86 22.35 Favored 'General case' 0 CA--C 1.493 -1.247 0 CA-C-N 109.188 -3.642 . . . . 0.0 111.742 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.673 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.266 26.4 m95 -83.38 128.09 34.21 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-O 114.743 -2.551 . . . . 0.0 105.295 179.863 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.663 ' HG2' HG21 ' A' ' 95' ' ' VAL . 0.2 OUTLIER -81.59 -5.74 58.33 Favored 'General case' 0 CA--C 1.474 -1.955 1 CA-C-O 130.227 4.822 . . . . 0.0 114.223 -179.644 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 105.86 -3.63 38.88 Favored Glycine 0 C--O 1.197 -2.184 1 N-CA-C 103.098 -4.001 . . . . 0.0 103.098 -179.758 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.818 ' HB3' HG21 ' A' ' 2' ' ' THR . 0.2 OUTLIER 179.17 78.68 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.46 0 O-C-N 127.026 2.251 . . . . 0.0 107.568 179.831 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.561 HG22 ' HB2' ' A' ' 90' ' ' GLU . 4.3 t 124.46 163.86 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.361 0 C-N-CA 129.612 3.165 . . . . 0.0 116.944 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.863 HD22 ' CD2' ' A' ' 50' ' ' PHE . 0.6 OUTLIER -103.32 78.15 1.59 Allowed 'General case' 0 CA--C 1.49 -1.354 0 O-C-N 127.641 3.088 . . . . 0.0 116.913 179.989 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.663 HG21 ' HG2' ' A' ' 90' ' ' GLU 0.4 98.7 t -71.55 128.83 35.07 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.254 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 179.948 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.455 ' SG ' HG13 ' A' ' 87' ' ' VAL . 0.0 OUTLIER -125.7 134.61 51.75 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 120.764 1.62 . . . . 0.0 106.668 -179.943 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.9 t -117.64 119.15 60.78 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.475 0 CA-C-O 127.783 3.658 . . . . 0.0 115.413 -179.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.503 ' HG3' ' N ' ' A' ' 106' ' ' GLY 0.301 16.7 mm100 -78.43 98.67 6.11 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 111.49 -2.595 . . . . 0.0 115.736 179.929 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.6 ttmm -85.95 66.98 9.86 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 115.045 -2.662 . . . . 0.0 109.826 179.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -108.82 -156.4 17.81 Favored Glycine 0 C--O 1.203 -1.806 0 CA-C-O 126.051 3.028 . . . . 0.0 113.71 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.1 tm-20 -159.0 140.24 13.04 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 108.266 -3.967 . . . . 0.0 107.752 179.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 95.0 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.439 -0.991 0 C-N-CA 128.352 2.661 . . . . 0.0 111.737 -179.469 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -157.42 170.31 22.74 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-O 125.156 2.408 . . . . 0.0 113.401 179.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -120.02 95.48 4.78 Favored 'General case' 0 CA--C 1.515 -0.389 1 CA-C-N 106.277 -4.965 . . . . 0.0 104.469 179.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.492 ' CA ' ' HG3' ' A' ' 98' ' ' GLN . 5.7 mmm-85 -72.66 -8.48 55.5 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 128.276 3.485 . . . . 0.0 113.969 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.538 ' O ' HG22 ' A' ' 121' ' ' THR . . . -10.7 95.79 0.01 OUTLIER Glycine 0 N--CA 1.431 -1.687 1 O-C-N 133.467 6.729 . . . . 0.0 114.591 179.436 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.989 ' CZ2' HD21 ' A' ' 63' ' ' LEU 0.278 0.0 OUTLIER -116.03 116.15 27.39 Favored 'General case' 0 C--O 1.194 -1.825 0 O-C-N 128.308 3.005 . . . . 0.0 109.235 179.317 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -149.72 170.28 19.09 Favored 'General case' 0 C--O 1.211 -0.957 1 O-C-N 130.353 4.783 . . . . 0.0 112.238 -179.198 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.498 ' NE2' HD23 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -132.82 171.82 13.4 Favored 'General case' 0 C--N 1.366 1.285 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.771 179.974 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -176.27 93.83 0.05 Allowed 'General case' 0 C--N 1.311 -1.077 1 O-C-N 131.332 5.395 . . . . 0.0 117.24 179.32 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 49.0 t -39.07 107.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 C-N-CA 126.969 2.108 . . . . 0.0 113.029 179.473 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.23 88.88 3.01 Favored 'General case' 0 CA--C 1.488 -1.433 0 CA-C-N 109.981 -3.281 . . . . 0.0 114.208 -179.966 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.48 -112.97 3.75 Favored Glycine 0 C--O 1.2 -2.023 0 N-CA-C 117.524 1.769 . . . . 0.0 117.524 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -122.57 39.85 3.82 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 125.241 1.417 . . . . 0.0 113.74 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.49 ' HA ' ' CZ3' ' A' ' 9' ' ' TRP . 0.4 OUTLIER -178.44 162.53 1.48 Allowed 'General case' 0 C--N 1.313 -1.015 1 O-C-N 130.091 4.619 . . . . 0.0 109.407 -179.767 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.621 HD13 ' CZ2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -92.96 173.21 7.86 Favored 'General case' 0 CA--C 1.482 -1.669 0 O-C-N 128.656 3.722 . . . . 0.0 115.607 -179.617 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -142.42 80.72 1.71 Allowed 'General case' 0 C--N 1.366 1.292 1 CA-C-N 107.74 -4.3 . . . . 0.0 114.27 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.88 87.56 4.72 Favored 'General case' 0 CA--C 1.516 -0.346 1 CA-C-N 107.648 -4.342 . . . . 0.0 108.342 -179.851 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -94.7 124.96 39.04 Favored 'General case' 0 C--O 1.243 0.758 0 O-C-N 127.955 3.284 . . . . 0.0 106.689 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.673 HD12 ' N ' ' A' ' 121' ' ' THR . 0.2 OUTLIER -136.72 145.55 44.8 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 125.001 1.438 . . . . 0.0 108.875 -179.749 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.673 ' N ' HD12 ' A' ' 120' ' ' LEU . 1.5 t -127.55 174.27 9.19 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 125.227 1.579 . . . . 0.0 108.703 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 36.5 t -169.01 84.57 0.15 Allowed 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 125.052 1.47 . . . . 0.0 112.345 -179.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.49 -83.37 1.23 Allowed Glycine 0 N--CA 1.442 -0.934 0 O-C-N 127.993 3.308 . . . . 0.0 112.809 179.885 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -113.04 -20.04 11.66 Favored 'General case' 0 CA--C 1.497 -1.064 0 O-C-N 126.736 2.08 . . . . 0.0 112.082 179.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 54.8 mm-40 -91.73 163.65 14.0 Favored 'General case' 0 C--O 1.201 -1.488 0 O-C-N 126.995 2.684 . . . . 0.0 110.435 179.721 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.523 ' O ' HG13 ' A' ' 126' ' ' VAL . 4.6 p -142.8 94.86 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.794 0 CA-C-N 110.006 -3.27 . . . . 0.0 112.077 179.923 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 32.0 m -82.67 135.06 35.13 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-O 117.201 -1.38 . . . . 0.0 112.064 -179.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.518 ' C ' ' HB3' ' A' ' 15' ' ' GLU . 1.5 ttp180 -117.93 113.49 21.79 Favored 'General case' 0 CA--C 1.486 -1.492 0 O-C-N 128.276 3.485 . . . . 0.0 115.902 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -88.25 157.52 18.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 115.977 -2.289 . . . . 0.0 112.037 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 2.5 t -140.13 131.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 N-CA-C 103.01 -2.959 . . . . 0.0 103.01 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.577 ' CD2' ' CB ' ' A' ' 9' ' ' TRP 0.25 4.3 m-30 -119.73 -178.3 3.6 Favored 'General case' 0 CA--C 1.502 -0.89 1 O-C-N 129.247 4.092 . . . . 0.0 113.418 -179.981 . . . . . . . . 4 3 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.43 ' HE3' ' HB2' ' A' ' 132' ' ' LYS 0.274 0.0 OUTLIER -167.21 41.56 0.05 OUTLIER 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 114.558 -2.639 . . . . 0.0 104.479 179.516 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.597 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER 44.59 -151.87 0.04 OUTLIER 'General case' 0 CA--C 1.49 -1.33 1 O-C-N 131.071 5.232 . . . . 0.0 112.881 -179.387 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.513 ' N ' ' CG ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.853 0 N-CA-C 117.652 2.464 . . . . 0.0 117.652 -178.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 mmt . . . . . 0 N--CA 1.51 2.575 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 96.9 m -158.06 -53.41 0.07 Allowed 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 113.494 -1.685 . . . . 0.0 108.45 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.36 -179.84 8.11 Favored 'General case' 0 CA--C 1.496 -1.108 0 C-N-CA 117.891 -1.523 . . . . 0.0 113.917 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 56.63 77.53 0.25 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.97 98.61 3.2 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 116.17 -2.212 . . . . 0.0 109.426 179.895 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -65.77 153.66 41.2 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 130.242 3.417 . . . . 0.0 110.606 179.737 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 169.02 -148.46 12.27 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-O 114.41 -3.439 . . . . 0.0 109.796 -179.904 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.415 HG23 HG21 ' A' ' 40' ' ' THR . 0.4 OUTLIER -158.8 136.8 10.49 Favored 'General case' 0 C--N 1.315 -0.927 1 O-C-N 130.773 4.455 . . . . 0.0 103.695 179.919 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.515 ' CD1' ' N ' ' A' ' 9' ' ' TRP . 0.8 OUTLIER -120.99 124.84 45.84 Favored 'General case' 0 CA--C 1.495 -1.158 1 O-C-N 131.88 5.738 . . . . 0.0 117.854 -179.765 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 132' ' ' LYS . 9.3 mt-10 -83.0 109.76 17.38 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 116.546 -2.062 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.278 8.4 ttm -67.69 81.62 0.18 Allowed 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 125.131 1.52 . . . . 0.0 108.266 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -37.42 -48.67 0.96 Allowed 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 128.989 2.915 . . . . 0.0 110.187 179.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.276 4.0 m -165.8 153.84 10.89 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 108.663 -3.88 . . . . 0.0 110.532 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -105.62 137.93 42.65 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-N 110.31 -3.132 . . . . 0.0 114.293 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.41 -62.48 1.6 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 128.446 3.591 . . . . 0.0 111.562 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.433 ' OD1' ' N ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -135.71 138.69 43.0 Favored 'General case' 0 C--O 1.195 -1.791 0 C-N-CA 125.623 1.569 . . . . 0.0 108.735 179.803 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 37.0 p90 -123.52 -41.88 2.25 Favored 'General case' 0 C--O 1.207 -1.148 0 CA-C-O 124.502 2.096 . . . . 0.0 112.002 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.574 ' N ' ' CD1' ' A' ' 17' ' ' PHE . 1.8 tm-20 -75.55 -34.06 60.7 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-O 115.065 -2.398 . . . . 0.0 112.216 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.551 ' HA2' ' CG ' ' A' ' 22' ' ' LYS . . . -63.96 -29.65 75.45 Favored Glycine 0 N--CA 1.48 1.578 1 O-C-N 133.469 6.73 . . . . 0.0 111.968 -179.941 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.447 ' CD1' HD21 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -80.05 -43.25 22.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-O 125.935 2.779 . . . . 0.0 109.945 179.716 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.568 ' C ' HG22 ' A' ' 26' ' ' ILE . 19.5 mtt -55.66 -42.95 75.8 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 113.812 -1.54 . . . . 0.0 113.685 -179.579 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.551 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -75.36 -20.38 59.02 Favored 'General case' 0 C--O 1.213 -0.827 1 O-C-N 129.828 4.455 . . . . 0.0 114.768 179.131 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 122' ' ' CYS . . . -65.44 -42.46 92.4 Favored 'General case' 0 C--O 1.212 -0.897 1 O-C-N 132.304 6.003 . . . . 0.0 113.314 -179.979 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.744 HD12 ' O ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -89.12 -10.62 46.62 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 108.897 -3.774 . . . . 0.0 106.656 179.924 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 66.52 72.71 0.37 Allowed 'General case' 0 N--CA 1.436 -1.14 0 C-N-CA 129.805 3.242 . . . . 0.0 112.973 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.568 HG22 ' C ' ' A' ' 21' ' ' MET . 8.2 tp -107.48 13.62 8.32 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-O 128.475 3.988 . . . . 0.0 109.456 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -50.25 100.38 0.02 OUTLIER 'General case' 0 C--N 1.357 0.915 0 CA-C-N 109.696 -3.411 . . . . 0.0 111.148 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -144.12 24.67 1.62 Allowed 'General case' 0 CA--C 1.501 -0.907 0 O-C-N 126.604 2.44 . . . . 0.0 112.263 179.71 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.38 49.88 8.31 Favored 'General case' 0 C--O 1.201 -1.481 0 O-C-N 126.966 2.666 . . . . 0.0 110.018 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.57 -26.77 13.72 Favored 'General case' 0 N--CA 1.48 1.032 2 CA-C-N 105.782 -5.19 . . . . 0.0 110.307 -179.855 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -166.99 0.46 Allowed 'General case' 0 C--N 1.315 -0.918 1 O-C-N 129.83 4.456 . . . . 0.0 109.695 -179.763 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 90.06 -28.06 0.04 OUTLIER 'General case' 0 C--O 1.202 -1.431 1 O-C-N 130.084 4.615 . . . . 0.0 113.676 179.815 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -131.37 8.1 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 O-C-N 127.629 3.081 . . . . 0.0 110.317 -179.869 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.72 37.08 2.22 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.102 179.657 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 66.9 t -50.04 -48.75 22.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 126.257 2.223 . . . . 0.0 109.57 179.665 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.561 ' HG3' ' N ' ' A' ' 37' ' ' LEU . 6.8 tpp85 -141.89 144.09 33.64 Favored 'General case' 0 C--O 1.211 -0.938 2 O-C-N 129.908 4.505 . . . . 0.0 108.29 179.074 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.637 ' O ' ' N ' ' A' ' 39' ' ' GLN . 1.2 mp -89.02 96.08 10.58 Favored 'General case' 0 C--O 1.209 -1.046 2 O-C-N 132.892 6.37 . . . . 0.0 103.736 177.06 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.689 HG21 ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER 5.23 -51.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.261 1 O-C-N 137.34 9.15 . . . . 0.0 109.865 -177.879 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.637 ' N ' ' O ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -147.72 -166.42 2.52 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 118.96 2.948 . . . . 0.0 118.96 179.658 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.579 ' N ' ' CG ' ' A' ' 39' ' ' GLN . 17.6 m -42.26 149.08 0.17 Allowed 'General case' 0 N--CA 1.426 -1.659 1 C-N-CA 132.782 4.433 . . . . 0.0 115.359 179.293 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.499 ' C ' ' HD3' ' A' ' 41' ' ' LYS 0.289 0.1 OUTLIER -109.28 149.86 28.81 Favored 'General case' 0 N--CA 1.49 1.529 2 O-C-N 131.27 5.356 . . . . 0.0 101.421 178.185 . . . . . . . . 5 4 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.527 ' HB ' ' O ' ' A' ' 53' ' ' LYS . 2.3 mp -127.02 163.14 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 O-C-N 125.102 1.501 . . . . 0.0 111.534 179.342 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.496 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -132.77 143.16 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 CA-C-N 111.181 -2.736 . . . . 0.0 109.568 179.615 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . 0.265 86.9 t -151.77 118.12 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 116.612 -2.035 . . . . 0.0 111.286 -179.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.504 ' HG2' ' CD1' ' A' ' 50' ' ' PHE . 36.9 mt-30 -118.62 111.56 18.71 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -100.32 26.53 6.49 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 128.856 3.847 . . . . 0.0 111.37 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 109.51 -121.59 6.15 Favored Glycine 0 C--O 1.213 -1.156 0 O-C-N 120.844 -1.16 . . . . 0.0 115.345 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -59.69 -27.25 66.27 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 117.469 -1.692 . . . . 0.0 113.883 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -100.79 109.99 22.03 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 128.855 3.847 . . . . 0.0 110.593 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.541 ' CD1' ' C ' ' A' ' 50' ' ' PHE . 0.5 OUTLIER -113.61 111.95 22.7 Favored 'General case' 0 C--N 1.311 -1.088 1 O-C-N 129.119 4.012 . . . . 0.0 110.78 179.9 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -123.48 102.28 7.79 Favored 'General case' 0 C--O 1.196 -1.754 1 O-C-N 129.473 4.233 . . . . 0.0 117.8 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.518 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.3 160.71 28.64 Favored 'General case' 0 N--CA 1.473 0.676 1 O-C-N 130.256 4.722 . . . . 0.0 106.176 179.172 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.527 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -166.16 146.56 6.38 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 179.738 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.488 ' HA ' HD12 ' A' ' 42' ' ' ILE . 9.8 t -111.64 162.91 14.68 Favored 'General case' 0 C--N 1.31 -1.131 0 O-C-N 126.707 2.504 . . . . 0.0 113.406 -179.725 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.515 ' HB2' HD11 ' A' ' 42' ' ' ILE . 1.7 t-20 -106.8 -12.42 15.51 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 115.622 -2.132 . . . . 0.0 112.287 -179.764 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.484 ' HB2' HD23 ' A' ' 37' ' ' LEU . 98.8 p -23.61 120.36 0.04 OUTLIER 'General case' 0 CA--C 1.509 -0.63 1 O-C-N 131.634 5.584 . . . . 0.0 107.687 178.409 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.689 ' HB ' HG21 ' A' ' 38' ' ' THR . 0.6 OUTLIER -51.31 -31.3 21.09 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 128.031 3.332 . . . . 0.0 107.472 179.816 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.5 ' CG ' ' HG ' ' A' ' 37' ' ' LEU . 13.6 m-85 -57.09 -73.45 0.07 Allowed 'General case' 0 C--N 1.351 0.658 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 179.931 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.406 ' NH1' HD21 ' A' ' 37' ' ' LEU . 0.6 OUTLIER -155.78 129.93 8.76 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 113.415 -1.721 . . . . 0.0 111.084 -179.655 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -105.53 54.75 0.7 Allowed 'General case' 0 C--O 1.211 -0.942 0 O-C-N 127.82 3.2 . . . . 0.0 111.992 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -75.02 73.93 2.2 Favored 'General case' 0 N--CA 1.47 0.556 1 O-C-N 129.766 4.416 . . . . 0.0 106.85 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.435 ' HA ' ' HA ' ' A' ' 53' ' ' LYS . 5.0 p30 -45.54 114.22 0.72 Allowed 'General case' 0 C--O 1.202 -1.412 0 O-C-N 128.379 3.549 . . . . 0.0 116.05 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.568 ' HG ' ' CE2' ' A' ' 65' ' ' PHE . 4.0 tp -65.86 79.69 0.08 Allowed 'General case' 0 C--O 1.214 -0.791 1 O-C-N 129.65 4.344 . . . . 0.0 110.579 179.32 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.413 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 5.7 m-20 -111.01 96.95 6.46 Favored 'General case' 0 CA--C 1.486 -1.483 0 C-N-CA 115.917 -2.313 . . . . 0.0 113.568 -178.348 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.568 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -130.12 -176.05 3.82 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 125.875 2.75 . . . . 0.0 106.5 178.665 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.645 HG22 HG23 ' A' ' 69' ' ' VAL . 1.0 OUTLIER -137.33 156.01 48.74 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.421 ' HA ' ' CG1' ' A' ' 87' ' ' VAL . 20.5 t -64.5 149.26 11.24 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.203 0 O-C-N 128.923 3.889 . . . . 0.0 115.515 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 32.53 31.93 0.01 OUTLIER Glycine 0 N--CA 1.468 0.803 1 O-C-N 130.445 4.841 . . . . 0.0 117.359 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.645 HG23 HG22 ' A' ' 66' ' ' THR . 0.9 OUTLIER -91.14 -16.38 8.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.609 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 68.03 90.91 0.09 Allowed 'General case' 0 C--N 1.355 0.816 1 O-C-N 129.121 4.013 . . . . 0.0 109.787 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.522 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.1 OUTLIER -80.46 82.22 6.54 Favored 'General case' 0 CA--C 1.494 -1.194 0 O-C-N 127.13 2.769 . . . . 0.0 114.882 179.834 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -59.04 88.58 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 113.618 -1.628 . . . . 0.0 111.33 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.467 ' HB2' ' CA ' ' A' ' 82' ' ' ASN . 0.1 OUTLIER 60.8 161.76 0.06 Allowed 'General case' 0 C--O 1.209 -1.055 0 C-N-CA 126.638 1.975 . . . . 0.0 112.821 179.994 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 149.8 73.58 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 128.387 3.554 . . . . 0.0 113.983 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.295 0.8 OUTLIER -132.3 97.27 4.07 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 116.072 -1.918 . . . . 0.0 109.504 179.931 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -151.01 124.62 9.03 Favored 'General case' 0 C--N 1.316 -0.876 0 O-C-N 128.684 3.74 . . . . 0.0 111.776 179.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 122.44 -41.09 1.89 Allowed Glycine 0 C--O 1.216 -1.027 0 CA-C-N 109.717 -3.401 . . . . 0.0 112.889 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.744 ' O ' HD12 ' A' ' 24' ' ' LEU . 6.1 tp -106.01 -9.45 17.05 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 129.619 3.776 . . . . 0.0 114.629 -179.851 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.527 ' OD2' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -149.18 -62.74 0.23 Allowed 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.824 -179.85 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.75 52.18 3.59 Favored Glycine 0 C--O 1.214 -1.132 0 CA-C-O 126.442 3.246 . . . . 0.0 112.611 -179.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.98 -156.86 0.71 Allowed 'General case' 0 C--N 1.354 0.792 0 CA-C-N 110.616 -2.792 . . . . 0.0 113.847 -179.773 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.467 ' CA ' ' HB2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -151.92 109.58 3.63 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.805 1.288 . . . . 0.0 107.88 178.265 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.859 HG11 ' HB3' ' A' ' 98' ' ' GLN . 72.6 t -140.48 127.78 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.524 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -176.811 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -59.79 88.28 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 112.467 -2.152 . . . . 0.0 109.608 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.522 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 52.5 m -85.88 67.22 9.95 Favored 'General case' 0 C--O 1.196 -1.711 0 O-C-N 128.504 3.628 . . . . 0.0 116.214 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.476 HD21 ' OG1' ' A' ' 88' ' ' THR . 1.2 tt -58.59 146.97 34.01 Favored 'General case' 0 C--O 1.211 -0.925 1 CA-C-N 107.713 -4.312 . . . . 0.0 115.73 -179.744 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.464 ' N ' ' HG ' ' A' ' 86' ' ' LEU . 59.7 t -130.54 132.4 64.55 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.29 0 C-N-CA 127.499 2.32 . . . . 0.0 107.268 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.672 HG22 ' H ' ' A' ' 89' ' ' TRP 0.358 27.8 m -142.57 -156.62 0.7 Allowed 'General case' 0 CA--C 1.48 -1.729 0 CA-C-N 112.698 -2.046 . . . . 0.0 105.698 -179.554 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.705 ' HA ' ' CE3' ' A' ' 89' ' ' TRP 0.279 10.9 m95 -154.18 143.51 21.38 Favored 'General case' 0 CA--C 1.51 -0.595 0 O-C-N 118.349 -2.72 . . . . 0.0 105.492 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.0 OUTLIER -111.21 -146.38 0.41 Allowed 'General case' 0 CA--C 1.483 -1.605 0 O-C-N 126.583 2.427 . . . . 0.0 111.268 179.39 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -74.28 -30.93 59.92 Favored Glycine 0 N--CA 1.487 2.072 1 N-CA-C 101.144 -4.782 . . . . 0.0 101.144 179.741 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -164.29 69.3 0.18 Allowed 'General case' 0 C--O 1.197 -1.695 1 O-C-N 133.2 5.883 . . . . 0.0 111.625 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.645 ' O ' ' N ' ' A' ' 90' ' ' GLU . 0.1 OUTLIER 162.94 133.09 0.01 OUTLIER 'General case' 0 C--O 1.206 -1.219 0 N-CA-C 119.395 3.109 . . . . 0.0 119.395 178.049 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.954 HD21 ' HG2' ' A' ' 109' ' ' GLN . 0.5 OUTLIER -61.06 10.84 0.02 OUTLIER 'General case' 0 CA--C 1.478 -1.807 0 N-CA-C 120.246 3.424 . . . . 0.0 120.246 -178.293 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.0 t 3.92 114.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.482 -1.656 0 N-CA-C 119.318 3.081 . . . . 0.0 119.318 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.432 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 7.0 p -132.94 140.39 47.81 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 124.847 2.26 . . . . 0.0 108.313 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.421 ' O ' ' N ' ' A' ' 99' ' ' LYS . 0.2 OUTLIER -135.32 80.75 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.722 0 CA-C-N 110.013 -3.267 . . . . 0.0 116.533 179.794 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.859 ' HB3' HG11 ' A' ' 83' ' ' VAL . 10.8 mt-30 -50.21 93.8 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 123.937 1.827 . . . . 0.0 108.358 -179.942 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.574 ' C ' HG13 ' A' ' 83' ' ' VAL . 0.0 OUTLIER -88.98 106.7 18.6 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 109.258 -3.61 . . . . 0.0 111.395 -179.767 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.434 ' CA ' HG22 ' A' ' 83' ' ' VAL . . . -105.57 -83.98 1.7 Allowed Glycine 0 C--O 1.197 -2.188 1 CA-C-O 127.9 4.056 . . . . 0.0 110.141 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -176.4 -54.2 0.01 OUTLIER 'General case' 0 C--N 1.355 0.819 1 CA-C-N 107.051 -4.575 . . . . 0.0 112.765 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -87.25 -52.62 5.29 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 125.971 2.796 . . . . 0.0 115.666 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -102.28 158.76 15.96 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 110.362 -3.108 . . . . 0.0 116.424 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -117.2 85.08 2.26 Favored 'General case' 0 N--CA 1.49 1.565 1 CA-C-N 107.309 -4.496 . . . . 0.0 102.158 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.488 ' CZ ' ' HB3' ' A' ' 105' ' ' ARG . 0.0 OUTLIER -79.13 7.4 7.57 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 126.366 2.291 . . . . 0.0 115.921 -179.188 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 120' ' ' LEU . . . -49.75 131.62 27.27 Favored Glycine 0 C--O 1.204 -1.756 1 O-C-N 129.372 4.17 . . . . 0.0 110.582 179.25 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.551 ' CZ2' ' CE2' ' A' ' 65' ' ' PHE . 6.5 p90 -117.17 8.78 13.34 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 129.723 3.837 . . . . 0.0 119.387 -179.593 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -28.47 142.81 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 1 CA-C-N 108.26 -4.064 . . . . 0.0 112.757 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.954 ' HG2' HD21 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -123.16 148.65 45.52 Favored 'General case' 0 C--N 1.362 1.127 0 CA-C-O 113.709 -3.043 . . . . 0.0 108.954 179.876 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -145.64 84.6 1.68 Allowed 'General case' 0 C--N 1.303 -1.44 1 O-C-N 132.097 5.873 . . . . 0.0 115.066 179.59 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.468 HG12 ' O ' ' A' ' 111' ' ' VAL . 18.5 t -22.75 104.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.491 -1.311 0 C-N-CA 126.671 1.988 . . . . 0.0 115.802 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -134.85 153.77 51.91 Favored 'General case' 0 CA--C 1.481 -1.678 0 CA-C-N 111.137 -2.756 . . . . 0.0 118.183 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 50.29 -93.14 0.01 OUTLIER Glycine 0 C--O 1.198 -2.1 0 CA-C-O 123.599 1.666 . . . . 0.0 113.813 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -147.63 31.86 0.88 Allowed 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.18 -169.23 2.86 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 128.164 3.415 . . . . 0.0 111.189 -179.611 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' A' ' 116' ' ' LEU . 37.1 tp -128.62 88.06 2.68 Favored 'General case' 0 C--O 1.201 -1.493 0 CA-C-O 127.226 3.393 . . . . 0.0 111.435 179.795 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -44.86 97.11 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.731 1 CA-C-N 107.823 -4.262 . . . . 0.0 117.383 -179.177 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.408 ' HB2' ' CE1' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -78.87 120.63 23.76 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 113.545 -3.121 . . . . 0.0 105.403 178.26 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -134.13 85.63 2.21 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 126.923 2.639 . . . . 0.0 106.682 -178.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 106' ' ' GLY . 0.1 OUTLIER -98.48 148.04 24.14 Favored 'General case' 0 CA--C 1.483 -1.61 1 O-C-N 129.757 4.41 . . . . 0.0 108.857 -179.956 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.9 m -110.09 160.54 16.37 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 111.429 -2.623 . . . . 0.0 105.135 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.603 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -159.96 47.24 0.26 Allowed 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 125.899 2.761 . . . . 0.0 112.275 179.845 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 99.13 -98.33 1.96 Allowed Glycine 0 N--CA 1.438 -1.195 0 CA-C-N 111.739 -2.482 . . . . 0.0 110.709 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -83.61 -29.61 27.6 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 109.305 -3.448 . . . . 0.0 111.026 179.819 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -103.15 160.45 14.64 Favored 'General case' 0 C--O 1.207 -1.174 0 O-C-N 127.531 3.02 . . . . 0.0 109.75 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.57 101.14 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.5 -0.97 1 CA-C-N 108.303 -4.044 . . . . 0.0 112.327 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 22.2 m -79.67 149.7 31.16 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 113.307 -1.769 . . . . 0.0 109.726 179.789 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -140.58 76.14 1.54 Allowed 'General case' 0 N--CA 1.476 0.866 0 O-C-N 127.74 3.15 . . . . 0.0 110.491 179.953 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.86 176.1 0.58 Allowed 'General case' 0 CA--C 1.485 -1.538 0 C-N-CA 117.747 -1.581 . . . . 0.0 114.501 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . 0.259 83.9 t -149.64 87.55 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.199 -1.563 0 CA-C-O 125.037 2.351 . . . . 0.0 105.624 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 118' ' ' LEU . 3.4 m-85 -70.57 -178.67 1.86 Allowed 'General case' 0 CA--C 1.486 -1.496 0 CA-C-N 109.015 -3.72 . . . . 0.0 117.625 -179.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 10' ' ' GLU . 0.8 OUTLIER -163.96 117.01 1.43 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 111.461 -2.609 . . . . 0.0 108.067 -179.907 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.648 ' C ' ' HD3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -56.14 49.85 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 119.918 3.303 . . . . 0.0 119.918 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.424 ' CB ' ' O ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.263 1.788 0 CA-C-O 113.062 -3.351 . . . . 0.0 118.352 -178.697 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mtp . . . . . 0 N--CA 1.501 2.11 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.1 m -70.58 -23.71 62.64 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 179.867 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm -102.47 10.87 38.65 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 -179.962 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -96.82 84.45 3.6 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 116.577 -1.678 . . . . 0.0 107.284 -179.853 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.438 ' HG3' HG11 ' A' ' 111' ' ' VAL . 1.3 tm0? -117.79 145.85 44.24 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 103.85 -2.648 . . . . 0.0 103.85 -179.893 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -154.54 149.35 26.61 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 129.43 3.092 . . . . 0.0 110.933 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -178.64 -173.56 44.09 Favored Glycine 0 C--O 1.21 -1.349 0 CA-C-O 116.15 -2.472 . . . . 0.0 110.722 179.788 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.687 HG22 ' HG2' ' A' ' 134' ' ' LYS . 5.6 t -139.29 22.2 2.57 Favored 'General case' 0 C--O 1.208 -1.114 0 O-C-N 129.859 3.917 . . . . 0.0 109.83 179.858 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.628 ' HB2' ' CD1' ' A' ' 131' ' ' PHE 0.291 0.0 OUTLIER -23.66 124.45 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.443 1 O-C-N 133.768 6.917 . . . . 0.0 112.081 179.552 . . . . . . . . 5 4 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -74.09 -3.21 28.11 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 -179.172 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.516 ' HG3' HG21 ' A' ' 130' ' ' VAL 0.313 1.0 OUTLIER 49.59 35.97 9.56 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 114.074 -2.87 . . . . 0.0 103.269 179.707 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.484 ' HB2' ' HB2' ' A' ' 132' ' ' LYS . 4.8 tt0 -26.77 -46.92 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.256 2 O-C-N 132.542 6.152 . . . . 0.0 113.919 -178.876 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.689 ' O ' HG12 ' A' ' 130' ' ' VAL . 3.2 t -121.72 -152.22 0.5 Allowed 'General case' 0 C--O 1.245 0.817 0 C-N-CA 117.894 -1.522 . . . . 0.0 112.312 -178.522 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.802 ' HB2' HG12 ' A' ' 130' ' ' VAL . 2.4 t-20 157.34 136.92 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 O-C-N 125.371 1.669 . . . . 0.0 111.797 179.437 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.573 ' HB2' ' HB3' ' A' ' 128' ' ' ARG . 8.5 mm-40 -91.71 -70.16 0.7 Allowed 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 127.795 3.184 . . . . 0.0 108.16 179.505 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -96.15 157.74 15.76 Favored 'General case' 0 C--O 1.202 -1.413 0 O-C-N 120.812 -1.18 . . . . 0.0 112.872 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -149.01 -48.39 0.15 Allowed 'General case' 0 C--O 1.22 -0.49 0 O-C-N 125.257 1.598 . . . . 0.0 111.284 -179.942 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.474 ' CG ' ' HB2' ' A' ' 31' ' ' ARG . 1.3 mt-10 -67.58 -45.69 74.83 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 111.924 -2.398 . . . . 0.0 115.848 179.782 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.23 -22.92 65.76 Favored Glycine 0 N--CA 1.483 1.77 0 O-C-N 129.1 4.0 . . . . 0.0 111.345 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.524 ' CD1' HD21 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -78.78 -43.67 24.96 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-O 124.962 2.315 . . . . 0.0 107.666 179.992 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 17.8 mtt -66.42 -33.08 74.9 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 113.055 -1.884 . . . . 0.0 111.69 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -73.4 -25.54 60.59 Favored 'General case' 0 C--O 1.214 -0.773 0 O-C-N 128.053 3.346 . . . . 0.0 114.436 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.34 -52.49 32.77 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.968 3.918 . . . . 0.0 111.029 179.923 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.524 HD21 ' CD1' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -86.18 -6.39 59.0 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 110.056 -3.247 . . . . 0.0 108.633 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 39.64 73.91 0.11 Allowed 'General case' 0 CA--C 1.484 -1.566 0 O-C-N 127.653 3.095 . . . . 0.0 108.115 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.643 ' CD1' HD12 ' A' ' 78' ' ' LEU . 10.8 tt -65.68 -26.34 38.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.029 1 CA-C-N 108.191 -4.095 . . . . 0.0 109.069 -179.964 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.447 ' OD1' HG23 ' A' ' 26' ' ' ILE . 21.9 p-10 145.97 134.58 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 111.277 -2.692 . . . . 0.0 109.208 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.442 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.3 OUTLIER -94.45 87.61 5.22 Favored 'General case' 0 N--CA 1.483 1.182 1 O-C-N 129.913 4.508 . . . . 0.0 108.477 179.358 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 28' ' ' PHE . . . 150.31 65.84 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 1 O-C-N 129.493 4.246 . . . . 0.0 104.229 -179.363 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.557 HG22 ' O ' ' A' ' 30' ' ' THR . 2.8 m 142.28 66.58 0.0 OUTLIER 'General case' 0 C--O 1.205 -1.247 2 O-C-N 132.815 6.322 . . . . 0.0 109.009 -179.894 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HB2' ' CG ' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -138.08 -56.24 0.66 Allowed 'General case' 0 N--CA 1.447 -0.61 2 O-C-N 130.254 4.721 . . . . 0.0 108.987 -179.711 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.567 ' C ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -88.44 1.27 55.11 Favored 'General case' 0 C--O 1.205 -1.255 0 O-C-N 127.156 2.785 . . . . 0.0 113.715 179.886 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.657 ' N ' HD12 ' A' ' 33' ' ' ILE . 1.7 mp -108.23 -47.63 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 2 O-C-N 129.394 4.184 . . . . 0.0 114.681 -179.621 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.476 ' HA ' ' CE2' ' A' ' 58' ' ' PHE . . . -54.73 -44.42 73.53 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 122.491 1.139 . . . . 0.0 113.214 179.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.421 HG12 ' N ' ' A' ' 36' ' ' ARG . 78.4 t 25.81 -74.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.204 -1.342 0 CA-C-N 110.388 -3.096 . . . . 0.0 115.123 -179.806 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 34' ' ' ALA . 2.8 tmm_? -176.3 100.56 0.06 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.683 -1.599 . . . . 0.0 111.012 179.856 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.646 HD23 ' CE2' ' A' ' 58' ' ' PHE . 0.8 OUTLIER -94.84 -0.6 53.94 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 129.05 3.969 . . . . 0.0 110.59 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.524 ' N ' HD12 ' A' ' 37' ' ' LEU . 16.6 m 133.84 88.33 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.752 1 O-C-N 132.964 6.415 . . . . 0.0 111.503 -179.662 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.468 ' HG3' ' HG2' ' A' ' 11' ' ' MET . 0.0 OUTLIER -88.25 -179.05 6.06 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 116.288 -2.165 . . . . 0.0 115.581 -179.584 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.6 m -178.6 137.39 0.16 Allowed 'General case' 0 N--CA 1.431 -1.384 1 O-C-N 129.913 4.508 . . . . 0.0 112.498 179.583 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.586 ' HD2' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -122.54 157.13 32.73 Favored 'General case' 0 N--CA 1.489 1.494 1 O-C-N 129.321 4.138 . . . . 0.0 102.523 179.694 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.51 ' N ' ' O ' ' A' ' 53' ' ' LYS . 6.7 mt -149.82 104.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.433 0 O-C-N 127.547 3.03 . . . . 0.0 112.287 -178.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.403 ' CD1' ' CE1' ' A' ' 50' ' ' PHE 0.258 0.1 OUTLIER -83.39 135.4 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.496 2 CA-C-N 106.444 -4.889 . . . . 0.0 110.525 -179.855 . . . . . . . . 5 4 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -143.95 96.58 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.522 0 CA-C-N 111.77 -2.468 . . . . 0.0 116.419 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.479 ' HG2' ' HB2' ' A' ' 50' ' ' PHE . 36.5 mt-30 -94.84 126.73 40.35 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.154 179.211 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -132.83 31.85 3.88 Favored 'General case' 0 CA--C 1.49 -1.328 1 O-C-N 130.373 4.795 . . . . 0.0 111.99 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.85 120.36 0.66 Allowed Glycine 0 C--O 1.204 -1.764 0 O-C-N 126.061 2.101 . . . . 0.0 112.685 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 70.43 -69.69 0.17 Allowed 'General case' 0 C--O 1.212 -0.869 0 CA-C-O 116.683 -1.627 . . . . 0.0 112.015 179.854 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 41.2 m-20 -95.91 114.14 25.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 128.074 3.359 . . . . 0.0 111.493 -179.956 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.622 ' CD2' HD13 ' A' ' 94' ' ' LEU . 3.0 t80 -115.39 139.98 49.53 Favored 'General case' 0 CA--C 1.489 -1.385 1 O-C-N 129.52 4.262 . . . . 0.0 114.968 -179.806 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.522 ' N ' ' CD1' ' A' ' 50' ' ' PHE . 67.5 mttt -144.86 102.19 3.75 Favored 'General case' 0 CA--C 1.489 -1.378 0 N-CA-C 118.952 2.945 . . . . 0.0 118.952 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.775 HG22 ' HB2' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -68.29 160.96 28.35 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 128.652 3.72 . . . . 0.0 105.67 178.449 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 42' ' ' ILE 0.25 0.0 OUTLIER -158.03 127.4 5.82 Favored 'General case' 0 CA--C 1.482 -1.669 1 O-C-N 130.449 4.843 . . . . 0.0 112.08 -175.681 . . . . . . . . 5 4 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.408 HG22 ' N ' ' A' ' 61' ' ' TYR 0.283 0.4 OUTLIER -94.88 147.65 23.14 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 124.277 1.989 . . . . 0.0 112.853 179.708 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -132.36 59.33 1.72 Allowed 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 110.282 -3.145 . . . . 0.0 116.958 -179.402 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 m -93.85 -176.39 4.02 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 130.695 3.598 . . . . 0.0 106.214 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.501 ' HB ' HD21 ' A' ' 37' ' ' LEU . 92.2 m -113.27 -50.39 2.87 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 128.902 3.876 . . . . 0.0 107.659 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.646 ' CE2' HD23 ' A' ' 37' ' ' LEU . 9.0 m-85 -50.06 -57.36 7.79 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 128.579 3.675 . . . . 0.0 110.368 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -154.34 105.82 2.71 Favored 'General case' 0 C--O 1.213 -0.836 1 O-C-N 130.812 5.07 . . . . 0.0 114.112 -179.729 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -86.63 80.84 8.45 Favored 'General case' 0 C--O 1.205 -1.276 1 O-C-N 130.563 4.915 . . . . 0.0 112.066 -179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.408 ' N ' HG22 ' A' ' 54' ' ' THR . 5.5 t80 -68.06 166.86 15.11 Favored 'General case' 0 C--O 1.219 -0.521 0 O-C-N 128.79 3.806 . . . . 0.0 107.174 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -140.2 89.37 2.29 Favored 'General case' 0 C--O 1.207 -1.145 1 O-C-N 129.819 4.45 . . . . 0.0 113.014 179.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.775 ' HB2' HG22 ' A' ' 52' ' ' THR . 4.6 tp -72.85 64.35 0.67 Allowed 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.62 -1.627 . . . . 0.0 112.4 179.796 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.516 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 2.9 t0 -95.5 104.9 16.82 Favored 'General case' 0 C--O 1.21 -0.983 0 CA-C-N 112.636 -2.075 . . . . 0.0 105.551 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.506 ' HB3' HG21 ' A' ' 87' ' ' VAL . 9.6 m-85 -123.03 -178.48 3.97 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.354 2.262 . . . . 0.0 110.716 179.824 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.458 ' CG2' HG23 ' A' ' 69' ' ' VAL . 0.8 OUTLIER -150.68 133.3 15.73 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 103.783 -2.673 . . . . 0.0 103.783 179.34 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.56 HG21 ' HE1' ' A' ' 89' ' ' TRP . 54.8 t -52.75 137.77 12.36 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.297 0 O-C-N 126.994 2.684 . . . . 0.0 114.973 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 33.12 45.23 0.26 Allowed Glycine 0 N--CA 1.468 0.831 1 O-C-N 130.969 5.168 . . . . 0.0 117.363 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.458 HG23 ' CG2' ' A' ' 66' ' ' THR 0.319 0.4 OUTLIER -88.72 -14.04 9.58 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.791 0 C-N-CA 119.022 -1.071 . . . . 0.0 109.62 179.928 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 65.41 71.33 0.44 Allowed 'General case' 0 C--N 1.364 1.235 1 O-C-N 129.568 4.293 . . . . 0.0 109.547 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -65.46 72.22 0.05 OUTLIER 'General case' 0 CA--C 1.503 -0.86 2 O-C-N 130.835 5.085 . . . . 0.0 112.763 -179.805 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.43 101.72 0.05 OUTLIER 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 113.127 -1.851 . . . . 0.0 115.427 179.784 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.488 ' HG3' ' CA ' ' A' ' 82' ' ' ASN . 0.2 OUTLIER 63.07 -164.26 0.26 Allowed 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 123.694 1.712 . . . . 0.0 113.224 179.328 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 75.28 88.23 0.09 Allowed 'General case' 0 C--O 1.203 -1.378 0 CA-C-N 109.086 -3.688 . . . . 0.0 113.411 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . 0.26 72.8 p -116.67 -8.38 11.45 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 111.132 -2.758 . . . . 0.0 116.1 -179.74 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.36 151.67 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.925 1 O-C-N 129.214 4.071 . . . . 0.0 116.411 -179.684 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.19 -55.04 4.93 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 110.165 -3.198 . . . . 0.0 113.565 179.712 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.643 HD12 ' CD1' ' A' ' 26' ' ' ILE . 12.9 tp -80.93 -47.88 13.09 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 128.017 2.834 . . . . 0.0 113.158 179.911 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -112.56 -58.97 2.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 125.772 2.701 . . . . 0.0 112.142 179.847 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.59 49.6 5.69 Favored Glycine 0 C--O 1.207 -1.593 0 CA-C-N 111.748 -2.478 . . . . 0.0 111.968 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.44 ' CG ' ' N ' ' A' ' 82' ' ' ASN . 2.0 ttm-85 -121.04 -104.58 0.39 Allowed 'General case' 0 C--N 1.366 1.315 0 CA-C-N 109.968 -3.116 . . . . 0.0 114.644 -179.827 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.488 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 6.5 m-20 156.02 103.31 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.836 0 O-C-N 125.729 1.893 . . . . 0.0 108.341 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.579 HG13 ' HA3' ' A' ' 100' ' ' GLY . 1.5 t -153.72 145.31 14.47 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.372 0 O-C-N 126.852 2.595 . . . . 0.0 117.267 -179.332 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -56.17 161.24 2.53 Favored 'General case' 0 C--O 1.235 0.335 1 O-C-N 129.455 4.222 . . . . 0.0 106.87 178.791 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.2 m -161.28 95.23 1.02 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-O 126.389 2.995 . . . . 0.0 110.77 -179.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tp -101.7 111.76 24.12 Favored 'General case' 0 N--CA 1.429 -1.483 1 CA-C-N 108.106 -4.134 . . . . 0.0 116.993 -179.176 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.506 HG21 ' HB3' ' A' ' 65' ' ' PHE . 81.0 t -82.5 144.48 10.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 179.272 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.423 ' CG2' ' N ' ' A' ' 89' ' ' TRP 0.315 1.1 m -162.17 168.75 21.97 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-O 126.734 3.159 . . . . 0.0 110.732 -179.774 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.729 ' HA ' ' CE3' ' A' ' 89' ' ' TRP . 56.4 m95 -98.17 139.4 34.02 Favored 'General case' 0 C--N 1.361 1.078 0 CA-C-O 114.755 -2.545 . . . . 0.0 106.658 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.667 ' HB2' HG22 ' A' ' 93' ' ' THR . 0.0 OUTLIER -85.53 -49.49 8.01 Favored 'General case' 0 CA--C 1.483 -1.609 1 CA-C-O 132.231 5.777 . . . . 0.0 112.41 179.797 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -170.56 -56.4 0.04 OUTLIER Glycine 0 C--O 1.213 -1.189 1 CA-C-N 108.119 -4.128 . . . . 0.0 103.285 -179.763 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -141.38 49.37 1.63 Allowed 'General case' 0 N--CA 1.444 -0.731 1 O-C-N 131.949 5.147 . . . . 0.0 109.694 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.667 HG22 ' HB2' ' A' ' 90' ' ' GLU . 1.1 t -176.45 155.99 1.48 Allowed 'General case' 0 C--O 1.203 -1.385 0 N-CA-C 118.063 2.616 . . . . 0.0 118.063 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.622 HD13 ' CD2' ' A' ' 50' ' ' PHE . 0.8 OUTLIER -85.6 98.83 10.87 Favored 'General case' 0 CA--C 1.487 -1.47 0 O-C-N 127.907 3.254 . . . . 0.0 115.168 -179.798 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.497 HG13 ' HE2' ' A' ' 108' ' ' LYS . 49.9 t -99.68 120.96 49.78 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.377 0 CA-C-N 110.897 -2.865 . . . . 0.0 114.017 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.588 ' CB ' ' CH2' ' A' ' 107' ' ' TRP . 12.1 m -132.5 134.26 44.8 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 103.373 -2.825 . . . . 0.0 103.373 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.5 t -120.1 116.3 49.96 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.488 0 CA-C-N 108.715 -3.857 . . . . 0.0 119.268 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.99 109.26 19.69 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-N 112.459 -2.155 . . . . 0.0 107.436 179.556 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.12 116.18 27.98 Favored 'General case' 0 C--O 1.195 -1.773 0 O-C-N 128.05 3.344 . . . . 0.0 113.619 -179.017 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.579 ' HA3' HG13 ' A' ' 83' ' ' VAL . . . 172.41 176.5 41.19 Favored Glycine 0 C--O 1.199 -2.062 0 CA-C-N 113.172 -1.831 . . . . 0.0 112.402 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.404 ' HG2' ' CG ' ' A' ' 102' ' ' LYS . 4.5 tt0 3.45 -61.15 0.0 OUTLIER 'General case' 0 CA--C 1.492 -1.275 2 O-C-N 130.996 4.586 . . . . 0.0 114.537 179.645 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER -149.51 -37.21 0.16 Allowed 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 179.474 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -52.19 124.39 12.98 Favored 'General case' 0 N--CA 1.441 -0.918 0 O-C-N 126.544 2.403 . . . . 0.0 116.349 -179.771 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -112.02 67.97 0.66 Allowed 'General case' 0 N--CA 1.484 1.268 2 O-C-N 130.039 4.587 . . . . 0.0 102.148 179.781 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.461 ' HD2' ' HA ' ' A' ' 105' ' ' ARG . 23.5 mmm-85 -94.84 36.73 1.17 Allowed 'General case' 0 C--O 1.203 -1.364 1 O-C-N 129.321 4.138 . . . . 0.0 110.167 179.772 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -77.58 67.82 2.81 Favored Glycine 0 N--CA 1.445 -0.759 0 O-C-N 128.297 3.498 . . . . 0.0 111.445 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.588 ' CH2' ' CB ' ' A' ' 96' ' ' CYS . 0.0 OUTLIER -80.98 141.65 34.22 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 129.699 3.823 . . . . 0.0 110.553 179.397 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.497 ' HE2' HG13 ' A' ' 95' ' ' VAL . 3.0 ptpt -164.61 165.78 20.76 Favored 'General case' 0 N--CA 1.443 -0.786 1 O-C-N 129.265 4.103 . . . . 0.0 114.159 -178.728 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -116.28 175.27 5.63 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 109.729 -3.396 . . . . 0.0 106.415 -179.618 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.471 ' C ' HG23 ' A' ' 111' ' ' VAL . 15.0 m95 -125.78 -56.24 1.48 Allowed 'General case' 0 C--N 1.306 -1.311 1 O-C-N 130.659 4.974 . . . . 0.0 116.242 179.713 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.506 ' HA ' ' HB3' ' A' ' 116' ' ' LEU . 4.9 t 78.31 44.27 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 CA-C-O 127.453 3.501 . . . . 0.0 108.485 -176.06 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.603 ' HG3' ' CZ ' ' A' ' 117' ' ' TYR . 0.3 OUTLIER -103.07 129.88 50.03 Favored 'General case' 0 CA--C 1.477 -1.841 1 CA-C-N 107.081 -4.6 . . . . 0.0 110.823 -178.388 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . 0.423 ' O ' ' NZ ' ' A' ' 115' ' ' LYS . . . 48.14 67.42 1.61 Allowed Glycine 0 C--O 1.194 -2.352 0 C-N-CA 125.026 1.298 . . . . 0.0 115.711 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 72.67 -43.4 0.56 Allowed 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 129.027 2.931 . . . . 0.0 118.679 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.513 ' HG3' ' CD1' ' A' ' 117' ' ' TYR . 4.6 ptpp? -100.78 -174.91 2.74 Favored 'General case' 0 C--N 1.312 -1.062 0 O-C-N 128.831 3.832 . . . . 0.0 108.064 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.638 HD12 ' CG ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -138.09 62.24 1.57 Allowed 'General case' 0 C--O 1.194 -1.838 0 O-C-N 126.914 2.634 . . . . 0.0 108.672 178.928 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.776 ' HB3' ' HB3' ' A' ' 129' ' ' GLN . 0.0 OUTLIER -32.27 131.81 0.14 Allowed 'General case' 0 C--N 1.365 1.258 1 O-C-N 130.521 4.888 . . . . 0.0 116.005 -177.093 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.631 ' HB2' ' CE2' ' A' ' 131' ' ' PHE . 0.7 OUTLIER -87.83 65.84 8.53 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 128.661 3.726 . . . . 0.0 111.628 -178.87 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -77.8 122.5 25.5 Favored 'General case' 0 CA--C 1.485 -1.541 0 O-C-N 127.692 3.12 . . . . 0.0 108.014 -179.629 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 121' ' ' THR . 0.9 OUTLIER -146.15 -179.79 6.97 Favored 'General case' 0 CA--C 1.486 -1.512 0 C-N-CA 117.213 -1.795 . . . . 0.0 114.092 -179.791 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.479 ' O ' HD12 ' A' ' 120' ' ' LEU . 44.8 m -128.36 160.89 30.8 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . 0.263 0.3 OUTLIER -173.6 107.77 0.14 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 117.656 -1.164 . . . . 0.0 110.953 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 12.12 76.9 0.01 OUTLIER Glycine 0 C--O 1.218 -0.849 1 O-C-N 129.896 4.498 . . . . 0.0 114.725 179.593 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 38.9 m-20 101.15 -53.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.391 0 O-C-N 129.048 3.44 . . . . 0.0 111.032 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -77.35 171.06 15.45 Favored 'General case' 0 C--O 1.2 -1.543 1 O-C-N 130.611 4.944 . . . . 0.0 110.323 -179.8 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.1 m -145.17 102.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 1 CA-C-N 107.28 -4.509 . . . . 0.0 111.31 179.454 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.45 175.18 1.43 Allowed 'General case' 0 CA--C 1.494 -1.208 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 -179.625 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.573 ' HB3' ' HB2' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -142.04 64.63 1.38 Allowed 'General case' 0 C--N 1.346 0.446 0 C-N-CA 114.165 -3.014 . . . . 0.0 116.679 179.647 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.776 ' HB3' ' HB3' ' A' ' 117' ' ' TYR . 8.9 mt-30 57.24 -169.09 0.11 Allowed 'General case' 0 CA--C 1.482 -1.662 0 N-CA-C 120.815 3.635 . . . . 0.0 120.815 175.616 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 14' ' ' ASN 0.256 1.5 m -173.5 -46.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 O-C-N 126.568 2.418 . . . . 0.0 113.448 -178.775 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.638 ' CG ' HD12 ' A' ' 116' ' ' LEU . 43.7 m-85 -29.94 158.94 0.0 OUTLIER 'General case' 0 CA--C 1.477 -1.853 0 N-CA-C 120.929 3.677 . . . . 0.0 120.929 -174.913 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 12' ' ' GLU 0.338 0.0 OUTLIER -169.46 108.67 0.42 Allowed 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 108.729 -3.85 . . . . 0.0 104.964 -178.86 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.497 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 31.6 ttpt -64.93 73.01 0.04 OUTLIER 'General case' 0 CA--C 1.478 -1.79 0 C-N-CA 117.717 -1.593 . . . . 0.0 113.7 -179.331 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.687 ' HG2' HG22 ' A' ' 8' ' ' THR . 14.9 mttt . . . . . 0 CA--C 1.496 -1.119 0 O-C-N 119.981 -1.699 . . . . 0.0 114.782 179.812 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 N--CA 1.505 2.284 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 95.9 m -158.1 -47.93 0.06 Allowed 'General case' 0 C--O 1.207 -1.175 0 CA-C-O 123.539 1.637 . . . . 0.0 109.41 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.59 -157.04 0.02 OUTLIER 'General case' 0 CA--C 1.493 -1.22 0 C-N-CA 117.573 -1.651 . . . . 0.0 114.604 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.68 -173.73 0.8 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 104.887 -2.264 . . . . 0.0 104.887 179.87 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -122.39 -144.2 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 104.368 -2.456 . . . . 0.0 104.368 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.47 131.72 12.8 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 128.317 2.647 . . . . 0.0 110.713 179.713 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 178.16 -119.43 0.67 Allowed Glycine 0 C--O 1.22 -0.758 0 C-N-CA 115.832 -3.08 . . . . 0.0 115.864 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.446 ' C ' ' CD1' ' A' ' 9' ' ' TRP . 0.6 OUTLIER -179.75 151.07 0.42 Allowed 'General case' 0 C--O 1.211 -0.926 1 O-C-N 133.457 6.034 . . . . 0.0 105.441 -178.85 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.553 ' CE3' ' HA ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -145.12 114.14 6.94 Favored 'General case' 0 CA--C 1.495 -1.153 1 O-C-N 129.298 4.124 . . . . 0.0 116.117 -179.446 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.413 ' HA ' ' HA ' ' A' ' 40' ' ' THR . 0.8 OUTLIER -82.61 95.08 7.67 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 114.846 -2.742 . . . . 0.0 106.94 179.643 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.509 ' HB3' ' HG2' ' A' ' 39' ' ' GLN . 32.5 ttm -28.28 -46.54 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 O-C-N 128.351 3.532 . . . . 0.0 107.148 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 93.35 -63.34 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.728 1 O-C-N 129.301 4.125 . . . . 0.0 111.729 179.291 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.98 -178.53 4.93 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 108.901 -3.772 . . . . 0.0 111.416 -179.568 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.475 ' ND2' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -165.5 154.94 12.43 Favored 'General case' 0 C--O 1.2 -1.51 0 O-C-N 126.289 2.243 . . . . 0.0 115.799 179.975 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.501 ' HG3' ' N ' ' A' ' 16' ' ' ASN . 3.1 tt0 -125.7 145.48 50.16 Favored 'General case' 0 N--CA 1.476 0.854 2 O-C-N 132.825 6.328 . . . . 0.0 110.738 -179.986 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.501 ' N ' ' HG3' ' A' ' 15' ' ' GLU . 53.3 t30 36.82 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.138 0 CA-C-O 124.252 1.977 . . . . 0.0 115.744 -179.713 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -112.43 -39.5 4.37 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 111.636 -2.529 . . . . 0.0 109.562 -179.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -75.17 -35.02 61.62 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.317 -1.31 . . . . 0.0 111.956 179.849 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.02 -27.15 58.81 Favored Glycine 0 C--N 1.351 1.379 0 O-C-N 128.909 3.881 . . . . 0.0 107.028 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.497 ' CE1' HD11 ' A' ' 120' ' ' LEU . 2.1 t80 -72.31 -29.6 64.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 123.483 1.611 . . . . 0.0 108.576 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.432 ' HG2' HG21 ' A' ' 26' ' ' ILE . 9.8 mtt -77.76 -25.31 49.06 Favored 'General case' 0 CA--C 1.494 -1.208 0 C-N-CA 116.594 -2.042 . . . . 0.0 111.004 179.901 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -75.5 -27.01 58.6 Favored 'General case' 0 C--O 1.204 -1.304 0 O-C-N 127.799 3.187 . . . . 0.0 115.02 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.905 ' HB2' ' HG3' ' A' ' 125' ' ' GLN . . . -71.48 -44.93 63.82 Favored 'General case' 0 C--O 1.215 -0.718 1 O-C-N 134.461 7.351 . . . . 0.0 112.807 -179.859 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.859 HD11 ' HB ' ' A' ' 26' ' ' ILE . 2.6 pp -90.46 -6.05 55.33 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 110.24 -3.164 . . . . 0.0 108.202 -179.895 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.6 t0 32.12 91.28 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 127.606 3.574 . . . . 0.0 113.01 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.859 ' HB ' HD11 ' A' ' 24' ' ' LEU . 9.9 tt -106.03 41.11 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.211 -0.959 1 CA-C-N 107.472 -4.422 . . . . 0.0 111.17 179.69 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t0 80.47 134.54 0.06 Allowed 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 109.887 -3.324 . . . . 0.0 113.323 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.454 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 43.0 m-85 -67.59 137.03 55.36 Favored 'General case' 0 CA--C 1.505 -0.751 0 O-C-N 125.626 1.829 . . . . 0.0 111.795 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 28' ' ' PHE . . . 73.99 74.29 0.12 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 125.811 2.72 . . . . 0.0 109.155 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.429 HG22 ' O ' ' A' ' 30' ' ' THR . 34.1 m -140.76 40.73 1.84 Allowed 'General case' 0 N--CA 1.478 0.974 1 CA-C-N 106.85 -4.704 . . . . 0.0 110.794 179.939 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.79 -170.21 3.47 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 111.231 -2.713 . . . . 0.0 109.329 -179.318 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.495 ' C ' ' CG1' ' A' ' 33' ' ' ILE . 4.6 tttp 76.38 30.69 0.65 Allowed 'General case' 0 C--N 1.314 -0.96 1 O-C-N 129.498 4.249 . . . . 0.0 112.425 -179.62 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.495 ' CG1' ' C ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -162.11 -55.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 2 O-C-N 129.834 4.459 . . . . 0.0 111.539 -179.959 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -87.62 50.3 1.97 Allowed 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 124.887 2.28 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.0 t -71.76 -44.21 68.78 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.578 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.186 -179.944 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.907 ' C ' HD23 ' A' ' 37' ' ' LEU . 0.0 OUTLIER 160.04 132.51 0.0 OUTLIER 'General case' 0 N--CA 1.433 -1.299 1 O-C-N 130.684 4.99 . . . . 0.0 111.664 179.706 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.928 HD12 ' CG2' ' A' ' 57' ' ' THR . 0.1 OUTLIER -150.11 117.35 6.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 108.738 -3.847 . . . . 0.0 106.351 -179.981 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.426 ' HB ' ' HB ' ' A' ' 57' ' ' THR . 7.8 m 47.32 46.57 16.93 Favored 'General case' 0 CA--C 1.506 -0.742 1 O-C-N 131.096 5.247 . . . . 0.0 112.755 179.872 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.509 ' HG2' ' HB3' ' A' ' 11' ' ' MET . 0.4 OUTLIER -56.84 123.23 14.32 Favored 'General case' 0 CA--C 1.494 -1.174 0 O-C-N 125.135 1.522 . . . . 0.0 113.555 179.873 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.502 HG22 ' O ' ' A' ' 40' ' ' THR . 45.3 m -147.95 67.85 1.1 Allowed 'General case' 0 C--N 1.313 -0.994 1 O-C-N 130.114 4.634 . . . . 0.0 117.457 -179.114 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.648 ' HA ' ' CB ' ' A' ' 55' ' ' ASN . 0.1 OUTLIER -66.47 144.82 56.26 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 115.29 -2.29 . . . . 0.0 104.921 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.661 HD13 ' HB ' ' A' ' 54' ' ' THR . 2.6 mt -125.83 166.17 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.515 1 O-C-N 131.806 5.692 . . . . 0.0 113.263 -177.343 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.532 ' N ' ' CG2' ' A' ' 42' ' ' ILE 0.274 0.5 OUTLIER -149.85 143.37 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-N 110.829 -2.896 . . . . 0.0 112.484 179.405 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.501 HG12 ' N ' ' A' ' 45' ' ' GLN . 41.1 t -111.68 -71.1 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.322 0 CA-C-N 111.799 -2.455 . . . . 0.0 114.445 -179.786 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.501 ' N ' HG12 ' A' ' 44' ' ' VAL . 0.4 OUTLIER 60.8 116.5 0.01 OUTLIER 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 124.099 1.905 . . . . 0.0 113.206 -179.899 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -137.98 -4.12 1.76 Allowed 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 110.365 -3.107 . . . . 0.0 116.326 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.72 114.24 3.39 Favored Glycine 0 CA--C 1.493 -1.343 0 CA-C-N 121.16 1.8 . . . . 0.0 112.2 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 52.46 30.6 8.54 Favored 'General case' 0 C--O 1.212 -0.876 0 O-C-N 125.39 1.288 . . . . 0.0 111.693 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.5 t30 177.79 90.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.504 2.322 . . . . 0.0 109.218 -179.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.689 ' CD2' HD13 ' A' ' 94' ' ' LEU . 32.9 t80 -103.3 95.4 6.07 Favored 'General case' 0 CA--C 1.482 -1.657 1 O-C-N 130.25 4.719 . . . . 0.0 116.648 -179.551 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -106.9 173.29 6.39 Favored 'General case' 0 C--O 1.197 -1.66 0 C-N-CA 114.899 -2.72 . . . . 0.0 111.438 178.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -138.28 136.79 36.82 Favored 'General case' 0 N--CA 1.472 0.647 2 O-C-N 132.542 6.151 . . . . 0.0 104.921 177.592 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.603 ' O ' ' CE ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -156.42 115.38 3.43 Favored 'General case' 0 CA--C 1.483 -1.609 0 O-C-N 127.722 3.139 . . . . 0.0 113.887 -176.704 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.705 ' HA ' ' HB3' ' A' ' 60' ' ' ASN . 3.0 m 96.93 147.08 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 130.033 3.333 . . . . 0.0 105.276 177.393 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.648 ' CB ' ' HA ' ' A' ' 41' ' ' LYS . 5.9 p30 -171.76 47.2 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.378 1 O-C-N 129.667 4.354 . . . . 0.0 116.513 -176.832 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 m 148.5 168.46 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 O-C-N 128.867 3.855 . . . . 0.0 107.884 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.928 ' CG2' HD12 ' A' ' 37' ' ' LEU . 5.1 t -83.1 -36.97 24.42 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 111.853 -2.431 . . . . 0.0 106.204 -179.861 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.912 ' HB3' HD11 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -61.15 -29.83 70.02 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 125.682 1.864 . . . . 0.0 110.622 -179.937 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.1 OUTLIER -178.2 162.4 1.56 Allowed 'General case' 0 CA--C 1.504 -0.818 1 O-C-N 131.375 5.422 . . . . 0.0 116.392 -179.938 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.705 ' HB3' ' HA ' ' A' ' 54' ' ' THR . 0.0 OUTLIER -138.47 86.58 2.17 Favored 'General case' 0 CA--C 1.503 -0.853 2 O-C-N 130.778 5.049 . . . . 0.0 114.078 -177.546 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -81.53 93.03 6.6 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 127.186 2.804 . . . . 0.0 110.186 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -43.42 148.25 0.33 Allowed 'General case' 0 C--O 1.206 -1.206 1 O-C-N 129.877 4.486 . . . . 0.0 111.406 -179.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.557 ' HB3' ' HB ' ' A' ' 52' ' ' THR . 4.7 tp -128.9 62.25 1.5 Allowed 'General case' 0 C--O 1.214 -0.789 1 O-C-N 129.321 4.138 . . . . 0.0 110.791 179.903 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -79.97 94.24 5.86 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 127.748 3.155 . . . . 0.0 110.363 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.634 ' CE2' ' CH2' ' A' ' 107' ' ' TRP . 6.9 m-85 -129.59 137.75 50.89 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 127.103 3.335 . . . . 0.0 109.854 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.635 ' O ' HG23 ' A' ' 69' ' ' VAL . 0.9 OUTLIER -125.4 108.8 12.03 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 109.039 -3.71 . . . . 0.0 103.027 179.594 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.909 HG21 ' CD1' ' A' ' 89' ' ' TRP . 12.5 t -41.77 129.79 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.488 -1.419 1 O-C-N 130.854 5.096 . . . . 0.0 114.716 -179.771 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.18 12.81 69.9 Favored Glycine 0 N--CA 1.48 1.583 1 O-C-N 129.277 4.111 . . . . 0.0 116.287 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 66' ' ' THR 0.275 1.7 t -73.82 -34.01 39.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.864 -179.792 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.415 ' O ' ' N ' ' A' ' 72' ' ' ASP . 27.2 tt0 65.43 73.81 0.39 Allowed 'General case' 0 C--N 1.366 1.306 0 C-N-CA 112.489 -3.685 . . . . 0.0 108.442 -179.374 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.678 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 0.2 OUTLIER -63.16 77.92 0.02 OUTLIER 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 126.905 3.24 . . . . 0.0 112.569 -179.488 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 70' ' ' GLU . 77.8 m-20 -61.72 78.21 0.02 OUTLIER 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -179.82 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.531 ' HG2' ' CA ' ' A' ' 83' ' ' VAL . 21.4 mt-10 56.35 108.98 0.01 OUTLIER 'General case' 0 CA--C 1.49 -1.352 1 CA-C-O 129.061 4.267 . . . . 0.0 114.642 179.679 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -176.62 97.84 0.05 Allowed 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 109.772 -3.376 . . . . 0.0 115.641 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.92 130.8 5.75 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 111.391 -2.641 . . . . 0.0 111.336 -179.932 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.93 148.79 20.95 Favored 'General case' 0 CA--C 1.508 -0.656 0 O-C-N 128.448 3.592 . . . . 0.0 111.899 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.54 -3.99 72.41 Favored Glycine 0 C--O 1.21 -1.369 0 CA-C-N 109.405 -3.543 . . . . 0.0 113.067 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.498 ' HA ' ' CD1' ' A' ' 26' ' ' ILE . 0.9 OUTLIER -146.93 19.87 1.27 Allowed 'General case' 0 C--N 1.347 0.494 0 O-C-N 127.868 2.746 . . . . 0.0 116.982 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.7 t0 174.66 -59.5 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.53 0.519 . . . . 0.0 110.96 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 74.51 72.95 0.97 Allowed Glycine 0 CA--C 1.503 -0.668 0 CA-C-O 126.545 3.303 . . . . 0.0 111.989 -179.797 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.54 -177.63 3.87 Favored 'General case' 0 C--N 1.363 1.194 1 CA-C-N 107.965 -4.118 . . . . 0.0 111.239 179.954 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.444 ' CA ' ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.11 82.68 1.2 Allowed 'General case' 0 C--O 1.202 -1.407 0 O-C-N 127.533 3.021 . . . . 0.0 108.145 179.643 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 99' ' ' LYS . 2.3 t -134.19 143.79 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 CA-C-N 111.194 -2.73 . . . . 0.0 117.926 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.8 mtmm -50.89 155.3 1.22 Allowed 'General case' 0 N--CA 1.465 0.291 1 O-C-N 130.139 4.649 . . . . 0.0 106.999 179.299 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.678 ' HB ' ' HB3' ' A' ' 71' ' ' PHE . 1.1 m -158.47 78.46 0.79 Allowed 'General case' 0 C--O 1.194 -1.848 0 CA-C-O 127.764 3.65 . . . . 0.0 111.823 -179.452 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 96' ' ' CYS . 7.5 tt -68.9 139.13 55.12 Favored 'General case' 0 N--CA 1.431 -1.381 1 CA-C-N 107.412 -4.449 . . . . 0.0 111.864 -179.953 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.427 HG13 ' HA ' ' A' ' 67' ' ' VAL . 14.8 p -132.73 132.45 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 C-N-CA 126.085 1.754 . . . . 0.0 110.759 179.883 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.728 ' HA ' HG13 ' A' ' 67' ' ' VAL . 1.4 t -155.21 175.13 14.24 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 126.886 3.231 . . . . 0.0 110.92 179.847 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' TRP . . . . . 0.909 ' CD1' HG21 ' A' ' 67' ' ' VAL . 42.0 m95 -96.22 144.25 26.6 Favored 'General case' 0 CA--C 1.506 -0.732 0 C-N-CA 127.569 2.347 . . . . 0.0 107.874 180.0 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.549 ' HB2' HG23 ' A' ' 95' ' ' VAL . 6.6 tp10 -91.98 -45.46 8.32 Favored 'General case' 0 C--O 1.21 -1.016 1 CA-C-O 131.706 5.527 . . . . 0.0 111.324 179.878 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -178.95 -49.21 0.08 OUTLIER Glycine 0 C--N 1.359 1.85 1 CA-C-N 105.586 -5.279 . . . . 0.0 105.405 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.64 30.42 1.7 Allowed 'General case' 0 C--O 1.212 -0.9 1 O-C-N 131.678 4.987 . . . . 0.0 111.225 179.912 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.433 HG22 ' CB ' ' A' ' 90' ' ' GLU . 2.6 t -161.54 154.05 20.16 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -179.964 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.689 HD13 ' CD2' ' A' ' 50' ' ' PHE . 2.0 tp -89.61 88.14 7.3 Favored 'General case' 0 CA--C 1.486 -1.496 0 O-C-N 129.048 3.968 . . . . 0.0 118.101 179.742 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.549 HG23 ' HB2' ' A' ' 90' ' ' GLU 0.359 40.9 t -86.29 114.97 26.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.251 0 CA-C-N 110.403 -3.09 . . . . 0.0 112.556 179.681 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -138.55 137.4 37.0 Favored 'General case' 0 C--O 1.2 -1.532 0 CA-C-O 122.227 1.013 . . . . 0.0 108.362 -179.491 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 2.6 t -122.92 137.28 56.92 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.59 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 179.76 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.554 ' HB2' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -94.06 94.21 8.28 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 125.369 2.509 . . . . 0.0 107.921 179.399 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.546 ' O ' HG12 ' A' ' 83' ' ' VAL . 71.4 tttt -91.19 128.73 37.12 Favored 'General case' 0 C--O 1.201 -1.467 1 CA-C-N 107.501 -4.409 . . . . 0.0 113.236 -179.9 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 102' ' ' LYS . . . 157.4 171.26 23.2 Favored Glycine 0 C--O 1.203 -1.836 0 CA-C-N 112.964 -1.925 . . . . 0.0 108.538 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 14.09 -70.23 0.0 OUTLIER 'General case' 0 CA--C 1.5 -0.959 2 O-C-N 130.254 4.149 . . . . 0.0 114.414 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' CD ' ' N ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER -153.1 -43.01 0.1 Allowed 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 127.37 2.268 . . . . 0.0 115.028 179.636 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.496 ' N ' ' CD ' ' A' ' 102' ' ' LYS . 2.8 mp0 -35.91 105.96 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.221 3.045 . . . . 0.0 119.221 -179.527 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.49 ' O ' ' HB ' ' A' ' 121' ' ' THR . 5.9 m120 -94.52 71.57 3.68 Favored 'General case' 0 N--CA 1.492 1.671 3 CA-C-N 106.96 -4.655 . . . . 0.0 99.436 177.415 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 105' ' ' ARG . 14.5 tpt85 -107.17 12.64 28.16 Favored 'General case' 0 C--N 1.31 -1.136 1 O-C-N 134.314 7.259 . . . . 0.0 111.623 -176.908 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.554 ' N ' ' HB2' ' A' ' 98' ' ' GLN . . . -75.52 141.71 28.02 Favored Glycine 0 C--O 1.203 -1.783 2 O-C-N 130.98 5.175 . . . . 0.0 111.42 179.949 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . 0.634 ' CH2' ' CE2' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -123.93 145.47 49.12 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 129.832 3.901 . . . . 0.0 111.112 179.532 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.404 ' HD2' ' CZ3' ' A' ' 110' ' ' TRP . 6.4 ptpp? -156.11 172.58 18.18 Favored 'General case' 0 C--O 1.202 -1.411 0 O-C-N 128.283 3.489 . . . . 0.0 111.975 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.53 ' CG ' ' HB3' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -133.54 175.47 9.39 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 110.279 -3.146 . . . . 0.0 109.565 -179.627 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.498 ' CD1' ' HB2' ' A' ' 117' ' ' TYR . 0.2 OUTLIER -172.27 84.29 0.07 Allowed 'General case' 0 CA--C 1.502 -0.891 1 O-C-N 130.05 4.594 . . . . 0.0 115.208 179.73 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.5 t -37.32 90.8 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.503 -0.83 0 CA-C-O 124.654 2.168 . . . . 0.0 111.859 179.399 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -91.87 47.49 1.35 Allowed 'General case' 0 CA--C 1.486 -1.492 0 CA-C-N 110.079 -3.237 . . . . 0.0 116.662 -179.853 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.23 -103.36 1.22 Allowed Glycine 0 C--O 1.212 -1.239 0 O-C-N 121.034 -1.041 . . . . 0.0 115.483 179.752 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -100.08 -8.09 24.16 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.21 177.84 7.5 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 128.898 3.874 . . . . 0.0 108.345 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.614 ' O ' HD23 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -138.12 117.99 13.28 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 126.734 2.521 . . . . 0.0 113.146 179.723 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.498 ' HB2' ' CD1' ' A' ' 110' ' ' TRP . 22.3 m-85 -71.06 151.36 44.62 Favored 'General case' 0 C--O 1.202 -1.429 0 CA-C-N 111.514 -2.584 . . . . 0.0 114.432 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.491 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -121.18 52.53 1.2 Allowed 'General case' 0 CA--C 1.5 -0.946 2 O-C-N 131.729 5.643 . . . . 0.0 108.733 -179.991 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.91 146.29 32.62 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 127.876 2.47 . . . . 0.0 108.43 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.701 HD12 ' O ' ' A' ' 121' ' ' THR . 0.1 OUTLIER -156.5 162.14 39.97 Favored 'General case' 0 CA--C 1.486 -1.517 0 O-C-N 126.263 2.227 . . . . 0.0 111.231 -179.755 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.701 ' O ' HD12 ' A' ' 120' ' ' LEU . 1.2 m -118.15 162.98 17.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 127.52 3.012 . . . . 0.0 105.134 -179.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.475 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.6 OUTLIER -166.32 47.72 0.07 Allowed 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 126.245 2.926 . . . . 0.0 110.918 179.52 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 77.19 61.48 2.64 Favored Glycine 0 C--O 1.238 0.38 0 CA-C-N 110.269 -3.15 . . . . 0.0 110.952 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 66.36 41.83 3.19 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 128.112 2.89 . . . . 0.0 111.774 179.69 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.905 ' HG3' ' HB2' ' A' ' 23' ' ' ALA . 5.4 mm-40 -131.58 31.53 4.28 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 127.569 3.043 . . . . 0.0 104.586 179.828 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.587 HG13 ' NH1' ' A' ' 128' ' ' ARG . 9.7 p -22.44 75.32 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 O-C-N 127.739 3.149 . . . . 0.0 114.764 179.819 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 13.1 t -68.31 139.77 55.92 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 119.51 -1.994 . . . . 0.0 111.19 -179.847 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.587 ' NH1' HG13 ' A' ' 126' ' ' VAL . 0.3 OUTLIER -119.28 147.5 44.21 Favored 'General case' 0 N--CA 1.47 0.542 1 O-C-N 129.266 4.104 . . . . 0.0 110.667 179.657 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -132.48 178.87 6.5 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 128.267 3.479 . . . . 0.0 110.92 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.27 141.52 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 103.282 -2.858 . . . . 0.0 103.282 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.491 ' CZ ' ' HB2' ' A' ' 118' ' ' LEU . 42.6 m-85 -127.18 171.04 11.78 Favored 'General case' 0 CA--C 1.486 -1.511 0 O-C-N 128.399 3.562 . . . . 0.0 114.861 -179.856 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.42 ' HD2' ' N ' ' A' ' 133' ' ' LYS 0.322 0.1 OUTLIER -157.27 117.97 3.56 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 112.723 -3.513 . . . . 0.0 103.296 179.997 . . . . . . . . 4 4 . 1 . 024 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.553 ' HA ' ' CE3' ' A' ' 9' ' ' TRP . 10.9 pttt -52.94 130.61 34.05 Favored 'General case' 0 C--O 1.205 -1.256 1 O-C-N 130.292 4.745 . . . . 0.0 110.268 179.373 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.413 ' HG2' ' C ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.799 0 O-C-N 126.212 2.195 . . . . 0.0 115.902 -179.227 . . . . . . . . 2 2 . 1 stop_ save_